HEADER RNA 12-APR-00 XXXX TITLE CRYSTAL STRUCTURE OF A VITAMIN B12 BINDING RNA APTAMER WITH LIGAND AT TITLE 2 2.3 A KEYWDS B12 BINDING RNA, VITAMIN B12, COBALAMIN, RNA EXPDTA X-RAY DIFFRACTION AUTHOR D.SUSSMAN,C.WILSON JRNL AUTH D.SUSSMAN,C.WILSON JRNL TITL A WATER CHANNEL IN THE CORE OF THE VITAMIN B(12) RNA JRNL TITL 2 APTAMER. JRNL REF STRUCTURE FOLD.DES. V. 8 719 2000 JRNL REFN ISSN 0969-2126 JRNL PMID 10903943 JRNL DOI 10.1016/S0969-2126(00)00159-3 SEQRES 1 A 35 G G A A C C G G U G C G C SEQRES 2 A 35 A U A A C C A C C U C A G SEQRES 3 A 35 U G C G A G C A A SEQRES 1 B 35 G G A A C C G G U G C G C SEQRES 2 B 35 A U A A C C A C C U C A G SEQRES 3 B 35 U G C G A G C A A SEQRES 1 C 35 G G A A C C G G U G C G C SEQRES 2 C 35 A U A A C C A C C U C A G SEQRES 3 C 35 U G C G A G C A A SEQRES 1 D 35 G G A A C C G G U G C G C SEQRES 2 D 35 A U A A C C A C C U C A G SEQRES 3 D 35 U G C G A G C A A SEQRES 1 E 35 G G A A C C G G U G C G C SEQRES 2 E 35 A U A A C C A C C U C A G SEQRES 3 E 35 U G C G A G C A A HETNAM CNC CYANOCOBALAMIN FORMUL 6 CNC 5(C63 H89 CO N14 O14 P 2+) FORMUL 11 HOH *725(H2 O) SITE 1 AC1 22 C A 211 A A 214 A A 216 C A 229 SITE 2 AC1 22 G A 230 A A 231 HOH A1151 HOH A1180 SITE 3 AC1 22 HOH A1246 HOH A1253 HOH A1272 HOH A1387 SITE 4 AC1 22 HOH A1459 HOH A1503 HOH A1508 HOH A1673 SITE 5 AC1 22 HOH A1764 HOH B1490 HOH B1612 A D 516 SITE 6 AC1 22 HOH D1189 HOH D1443 SITE 1 AC2 22 HOH A1290 C B 311 A B 314 A B 316 SITE 2 AC2 22 C B 329 G B 330 HOH B1121 HOH B1137 SITE 3 AC2 22 HOH B1266 HOH B1293 HOH B1364 HOH B1420 SITE 4 AC2 22 HOH B1468 HOH B1612 HOH B1707 HOH B1709 SITE 5 AC2 22 HOH B1725 HOH B1777 HOH B1802 CNC D1001 SITE 6 AC2 22 HOH D1256 HOH D1328 SITE 1 AC3 15 C C 411 A C 414 A C 416 C C 429 SITE 2 AC3 15 G C 430 HOH C1109 HOH C1139 HOH C1178 SITE 3 AC3 15 HOH C1211 HOH C1236 HOH C1258 HOH C1271 SITE 4 AC3 15 HOH C1454 A E 117 HOH E1314 SITE 1 AC4 21 A A 216 A A 217 HOH A1246 CNC B 801 SITE 2 AC4 21 HOH B1725 C D 511 A D 514 A D 516 SITE 3 AC4 21 C D 529 G D 530 HOH D1107 HOH D1143 SITE 4 AC4 21 HOH D1168 HOH D1232 HOH D1255 HOH D1256 SITE 5 AC4 21 HOH D1288 HOH D1328 HOH D1332 HOH D1409 SITE 6 AC4 21 HOH D1591 SITE 1 AC5 13 A C 417 HOH C1211 C E 111 A E 114 SITE 2 AC5 13 A E 116 C E 129 G E 130 HOH E1281 SITE 3 AC5 13 HOH E1321 HOH E1585 HOH E1754 HOH E1759 SITE 4 AC5 13 HOH E1778 CRYST1 91.270 98.080 217.970 90.00 90.00 90.00 I 2 2 2 40 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 0.010957 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010196 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004588 0.00000 MODEL 1 ATOM 1 OP3 G E 101 84.689 94.777 101.988 1.00 56.11 O ATOM 2 P G E 101 84.384 93.357 102.474 1.00 56.81 P ATOM 3 OP1 G E 101 83.713 93.308 103.857 1.00 55.97 O ATOM 4 OP2 G E 101 85.618 92.420 102.392 1.00 56.40 O ATOM 5 O5' G E 101 83.306 92.751 101.409 1.00 55.56 O ATOM 6 C5' G E 101 83.760 92.025 100.257 1.00 55.38 C ATOM 7 C4' G E 101 82.584 91.554 99.428 1.00 55.09 C ATOM 8 O4' G E 101 82.096 90.251 99.874 1.00 55.23 O ATOM 9 C3' G E 101 81.362 92.459 99.448 1.00 54.69 C ATOM 10 O3' G E 101 81.524 93.561 98.562 1.00 54.16 O ATOM 11 C2' G E 101 80.241 91.489 99.095 1.00 54.65 C ATOM 12 O2' G E 101 80.191 91.141 97.737 1.00 54.26 O ATOM 13 C1' G E 101 80.672 90.257 99.893 1.00 54.87 C ATOM 14 N9 G E 101 80.234 90.400 101.280 1.00 54.74 N ATOM 15 C8 G E 101 81.016 90.618 102.393 1.00 54.65 C ATOM 16 N7 G E 101 80.319 90.758 103.490 1.00 54.68 N ATOM 17 C5 G E 101 78.998 90.606 103.077 1.00 54.53 C ATOM 18 C6 G E 101 77.792 90.663 103.814 1.00 54.30 C ATOM 19 O6 G E 101 77.638 90.864 105.026 1.00 54.27 O ATOM 20 N1 G E 101 76.685 90.465 102.997 1.00 53.98 N ATOM 21 C2 G E 101 76.726 90.249 101.648 1.00 54.19 C ATOM 22 N2 G E 101 75.545 90.087 101.038 1.00 54.13 N ATOM 23 N3 G E 101 77.842 90.193 100.945 1.00 54.39 N ATOM 24 C4 G E 101 78.933 90.378 101.719 1.00 54.53 C ATOM 25 P G E 102 80.734 94.932 98.843 1.00 53.67 P ATOM 26 OP1 G E 102 81.199 95.989 97.911 1.00 53.73 O ATOM 27 OP2 G E 102 80.665 95.240 100.303 1.00 53.58 O ATOM 28 O5' G E 102 79.271 94.546 98.391 1.00 52.75 O ATOM 29 C5' G E 102 78.225 95.396 98.739 1.00 51.39 C ATOM 30 C4' G E 102 76.904 94.742 98.509 1.00 50.48 C ATOM 31 O4' G E 102 76.770 93.455 99.182 1.00 50.11 O ATOM 32 C3' G E 102 75.778 95.597 99.039 1.00 49.81 C ATOM 33 O3' G E 102 75.544 96.561 98.048 1.00 49.21 O ATOM 34 C2' G E 102 74.702 94.576 99.364 1.00 49.58 C ATOM 35 O2' G E 102 74.028 94.159 98.191 1.00 49.31 O ATOM 36 C1' G E 102 75.566 93.440 99.942 1.00 49.40 C ATOM 37 N9 G E 102 75.963 93.608 101.343 1.00 48.79 N ATOM 38 C8 G E 102 77.253 93.773 101.793 1.00 48.52 C ATOM 39 N7 G E 102 77.334 93.918 103.089 1.00 48.26 N ATOM 40 C5 G E 102 76.022 93.837 103.532 1.00 48.11 C ATOM 41 C6 G E 102 75.489 93.928 104.849 1.00 47.94 C ATOM 42 O6 G E 102 76.094 94.106 105.919 1.00 47.81 O ATOM 43 N1 G E 102 74.104 93.795 104.849 1.00 47.70 N ATOM 44 C2 G E 102 73.330 93.602 103.738 1.00 47.69 C ATOM 45 N2 G E 102 72.012 93.501 103.957 1.00 47.40 N ATOM 46 N3 G E 102 73.809 93.513 102.501 1.00 48.00 N ATOM 47 C4 G E 102 75.156 93.641 102.471 1.00 48.31 C ATOM 48 P A E 103 75.817 98.093 98.388 1.00 49.20 P ATOM 49 OP1 A E 103 75.999 98.828 97.097 1.00 49.32 O ATOM 50 OP2 A E 103 76.877 98.170 99.423 1.00 49.03 O ATOM 51 O5' A E 103 74.407 98.498 99.004 1.00 48.75 O ATOM 52 C5' A E 103 73.236 98.248 98.228 1.00 48.19 C ATOM 53 C4' A E 103 72.030 98.048 99.103 1.00 47.66 C ATOM 54 O4' A E 103 72.162 96.854 99.920 1.00 47.91 O ATOM 55 C3' A E 103 71.756 99.147 100.109 1.00 47.16 C ATOM 56 O3' A E 103 71.185 100.278 99.484 1.00 46.43 O ATOM 57 C2' A E 103 70.823 98.446 101.080 1.00 47.39 C ATOM 58 O2' A E 103 69.516 98.298 100.564 1.00 47.15 O ATOM 59 C1' A E 103 71.479 97.061 101.157 1.00 47.80 C ATOM 60 N9 A E 103 72.459 97.010 102.245 1.00 47.94 N ATOM 61 C8 A E 103 73.828 97.064 102.147 1.00 47.97 C ATOM 62 N7 A E 103 74.443 97.060 103.309 1.00 48.06 N ATOM 63 C5 A E 103 73.409 96.980 104.233 1.00 48.06 C ATOM 64 C6 A E 103 73.395 96.950 105.639 1.00 48.11 C ATOM 65 N6 A E 103 74.503 96.986 106.384 1.00 48.07 N ATOM 66 N1 A E 103 72.194 96.883 106.256 1.00 48.03 N ATOM 67 C2 A E 103 71.089 96.847 105.504 1.00 47.93 C ATOM 68 N3 A E 103 70.971 96.871 104.176 1.00 48.14 N ATOM 69 C4 A E 103 72.182 96.940 103.592 1.00 47.98 C ATOM 70 P A E 104 71.431 101.725 100.118 1.00 45.70 P ATOM 71 OP1 A E 104 70.930 102.822 99.243 1.00 45.43 O ATOM 72 OP2 A E 104 72.849 101.713 100.550 1.00 45.57 O ATOM 73 O5' A E 104 70.503 101.687 101.405 1.00 46.14 O ATOM 74 C5' A E 104 69.157 101.237 101.316 1.00 46.28 C ATOM 75 C4' A E 104 68.566 101.099 102.700 1.00 46.38 C ATOM 76 O4' A E 104 69.147 99.954 103.396 1.00 46.57 O ATOM 77 C3' A E 104 68.822 102.275 103.630 1.00 46.29 C ATOM 78 O3' A E 104 67.931 103.353 103.372 1.00 46.14 O ATOM 79 C2' A E 104 68.656 101.639 105.006 1.00 46.34 C ATOM 80 O2' A E 104 67.299 101.457 105.353 1.00 46.16 O ATOM 81 C1' A E 104 69.295 100.264 104.779 1.00 46.48 C ATOM 82 N9 A E 104 70.724 100.251 105.100 1.00 46.89 N ATOM 83 C8 A E 104 71.789 100.375 104.232 1.00 46.94 C ATOM 84 N7 A E 104 72.964 100.331 104.821 1.00 46.90 N ATOM 85 C5 A E 104 72.656 100.164 106.166 1.00 47.10 C ATOM 86 C6 A E 104 73.462 100.050 107.319 1.00 47.07 C ATOM 87 N6 A E 104 74.802 100.071 107.301 1.00 46.87 N ATOM 88 N1 A E 104 72.835 99.910 108.509 1.00 46.91 N ATOM 89 C2 A E 104 71.496 99.877 108.533 1.00 46.91 C ATOM 90 N3 A E 104 70.630 99.964 107.525 1.00 47.15 N ATOM 91 C4 A E 104 71.278 100.114 106.354 1.00 47.09 C ATOM 92 P C E 105 68.159 104.759 104.115 1.00 46.43 P ATOM 93 OP1 C E 105 66.932 105.579 103.876 1.00 45.95 O ATOM 94 OP2 C E 105 69.498 105.309 103.754 1.00 45.92 O ATOM 95 O5' C E 105 68.209 104.323 105.655 1.00 46.79 O ATOM 96 C5' C E 105 68.673 105.205 106.678 1.00 47.11 C ATOM 97 C4' C E 105 68.384 104.609 108.041 1.00 47.45 C ATOM 98 O4' C E 105 69.034 103.319 108.176 1.00 47.74 O ATOM 99 C3' C E 105 68.882 105.410 109.232 1.00 47.65 C ATOM 100 O3' C E 105 67.916 106.383 109.564 1.00 47.75 O ATOM 101 C2' C E 105 68.983 104.349 110.317 1.00 47.73 C ATOM 102 O2' C E 105 67.727 104.016 110.881 1.00 47.63 O ATOM 103 C1' C E 105 69.480 103.148 109.512 1.00 47.71 C ATOM 104 N1 C E 105 70.939 103.053 109.479 1.00 47.92 N ATOM 105 C2 C E 105 71.634 102.775 110.657 1.00 47.91 C ATOM 106 O2 C E 105 70.997 102.600 111.710 1.00 48.01 O ATOM 107 N3 C E 105 72.980 102.703 110.619 1.00 47.79 N ATOM 108 C4 C E 105 73.627 102.899 109.469 1.00 47.92 C ATOM 109 N4 C E 105 74.960 102.838 109.477 1.00 48.06 N ATOM 110 C5 C E 105 72.942 103.174 108.259 1.00 47.92 C ATOM 111 C6 C E 105 71.612 103.242 108.309 1.00 47.91 C ATOM 112 P C E 106 68.375 107.800 110.138 1.00 47.79 P ATOM 113 OP1 C E 106 67.141 108.640 110.217 1.00 48.19 O ATOM 114 OP2 C E 106 69.538 108.271 109.357 1.00 47.76 O ATOM 115 O5' C E 106 68.828 107.478 111.623 1.00 47.69 O ATOM 116 C5' C E 106 67.876 107.035 112.577 1.00 47.36 C ATOM 117 C4' C E 106 68.543 106.810 113.907 1.00 47.20 C ATOM 118 O4' C E 106 69.411 105.647 113.842 1.00 47.36 O ATOM 119 C3' C E 106 69.463 107.926 114.369 1.00 47.08 C ATOM 120 O3' C E 106 68.741 109.004 114.940 1.00 46.85 O ATOM 121 C2' C E 106 70.348 107.205 115.369 1.00 47.16 C ATOM 122 O2' C E 106 69.631 106.960 116.562 1.00 47.17 O ATOM 123 C1' C E 106 70.561 105.870 114.651 1.00 47.23 C ATOM 124 N1 C E 106 71.754 105.849 113.777 1.00 47.31 N ATOM 125 C2 C E 106 73.019 105.659 114.357 1.00 47.03 C ATOM 126 O2 C E 106 73.097 105.540 115.591 1.00 47.09 O ATOM 127 N3 C E 106 74.114 105.607 113.558 1.00 46.69 N ATOM 128 C4 C E 106 73.981 105.742 112.234 1.00 46.81 C ATOM 129 N4 C E 106 75.078 105.675 111.480 1.00 46.57 N ATOM 130 C5 C E 106 72.713 105.948 111.621 1.00 46.91 C ATOM 131 C6 C E 106 71.636 105.999 112.421 1.00 47.12 C ATOM 132 P G E 107 69.316 110.493 114.783 1.00 46.93 P ATOM 133 OP1 G E 107 68.322 111.482 115.294 1.00 46.67 O ATOM 134 OP2 G E 107 69.826 110.629 113.386 1.00 46.70 O ATOM 135 O5' G E 107 70.583 110.472 115.755 1.00 46.79 O ATOM 136 C5' G E 107 70.428 110.274 117.165 1.00 46.41 C ATOM 137 C4' G E 107 71.776 110.318 117.853 1.00 46.22 C ATOM 138 O4' G E 107 72.531 109.121 117.533 1.00 46.03 O ATOM 139 C3' G E 107 72.689 111.451 117.415 1.00 46.04 C ATOM 140 O3' G E 107 72.412 112.692 118.033 1.00 46.29 O ATOM 141 C2' G E 107 74.055 110.925 117.800 1.00 46.05 C ATOM 142 O2' G E 107 74.292 111.062 119.181 1.00 46.15 O ATOM 143 C1' G E 107 73.911 109.448 117.427 1.00 46.06 C ATOM 144 N9 G E 107 74.330 109.241 116.043 1.00 46.13 N ATOM 145 C8 G E 107 73.530 109.173 114.920 1.00 45.99 C ATOM 146 N7 G E 107 74.208 109.002 113.816 1.00 45.82 N ATOM 147 C5 G E 107 75.533 108.945 114.232 1.00 45.80 C ATOM 148 C6 G E 107 76.730 108.775 113.485 1.00 45.48 C ATOM 149 O6 G E 107 76.869 108.647 112.273 1.00 45.66 O ATOM 150 N1 G E 107 77.846 108.779 114.305 1.00 45.76 N ATOM 151 C2 G E 107 77.824 108.944 115.670 1.00 45.86 C ATOM 152 N2 G E 107 79.007 108.930 116.283 1.00 45.84 N ATOM 153 N3 G E 107 76.722 109.110 116.379 1.00 45.81 N ATOM 154 C4 G E 107 75.622 109.095 115.604 1.00 45.90 C ATOM 155 P G E 108 72.732 114.048 117.230 1.00 46.66 P ATOM 156 OP1 G E 108 72.265 115.235 117.993 1.00 46.90 O ATOM 157 OP2 G E 108 72.231 113.830 115.849 1.00 47.16 O ATOM 158 O5' G E 108 74.327 114.073 117.152 1.00 46.04 O ATOM 159 C5' G E 108 75.106 114.000 118.336 1.00 45.04 C ATOM 160 C4' G E 108 76.570 113.850 118.005 1.00 44.47 C ATOM 161 O4' G E 108 76.817 112.562 117.385 1.00 44.01 O ATOM 162 C3' G E 108 77.147 114.838 117.007 1.00 44.39 C ATOM 163 O3' G E 108 77.420 116.100 117.595 1.00 44.70 O ATOM 164 C2' G E 108 78.420 114.123 116.587 1.00 44.04 C ATOM 165 O2' G E 108 79.415 114.160 117.586 1.00 44.09 O ATOM 166 C1' G E 108 77.925 112.678 116.497 1.00 43.48 C ATOM 167 N9 G E 108 77.481 112.360 115.140 1.00 42.74 N ATOM 168 C8 G E 108 76.186 112.270 114.690 1.00 42.49 C ATOM 169 N7 G E 108 76.105 111.976 113.417 1.00 42.05 N ATOM 170 C5 G E 108 77.424 111.868 113.002 1.00 41.70 C ATOM 171 C6 G E 108 77.966 111.558 111.726 1.00 41.46 C ATOM 172 O6 G E 108 77.371 111.311 110.670 1.00 41.50 O ATOM 173 N1 G E 108 79.353 111.547 111.753 1.00 41.10 N ATOM 174 C2 G E 108 80.117 111.799 112.852 1.00 40.83 C ATOM 175 N2 G E 108 81.423 111.741 112.665 1.00 40.50 N ATOM 176 N3 G E 108 79.634 112.087 114.043 1.00 41.15 N ATOM 177 C4 G E 108 78.289 112.102 114.049 1.00 41.93 C ATOM 178 P U E 109 77.517 117.417 116.667 1.00 45.39 P ATOM 179 OP1 U E 109 77.840 118.558 117.564 1.00 45.61 O ATOM 180 OP2 U E 109 76.327 117.499 115.778 1.00 45.07 O ATOM 181 O5' U E 109 78.807 117.170 115.773 1.00 45.24 O ATOM 182 C5' U E 109 80.086 117.247 116.364 1.00 45.43 C ATOM 183 C4' U E 109 81.162 117.132 115.319 1.00 45.65 C ATOM 184 O4' U E 109 81.186 115.794 114.742 1.00 45.70 O ATOM 185 C3' U E 109 81.033 118.037 114.107 1.00 45.80 C ATOM 186 O3' U E 109 81.406 119.373 114.383 1.00 45.83 O ATOM 187 C2' U E 109 81.985 117.350 113.144 1.00 46.04 C ATOM 188 O2' U E 109 83.319 117.533 113.588 1.00 46.16 O ATOM 189 C1' U E 109 81.617 115.878 113.384 1.00 45.86 C ATOM 190 N1 U E 109 80.498 115.477 112.510 1.00 45.76 N ATOM 191 C2 U E 109 80.796 114.940 111.259 1.00 45.66 C ATOM 192 O2 U E 109 81.942 114.750 110.869 1.00 45.80 O ATOM 193 N3 U E 109 79.706 114.637 110.480 1.00 45.56 N ATOM 194 C4 U E 109 78.377 114.806 110.802 1.00 45.62 C ATOM 195 O4 U E 109 77.501 114.511 109.975 1.00 45.35 O ATOM 196 C5 U E 109 78.155 115.352 112.110 1.00 45.63 C ATOM 197 C6 U E 109 79.198 115.654 112.899 1.00 45.50 C ATOM 198 P G E 110 80.701 120.582 113.582 1.00 46.35 P ATOM 199 OP1 G E 110 81.070 121.891 114.204 1.00 46.20 O ATOM 200 OP2 G E 110 79.264 120.244 113.376 1.00 46.20 O ATOM 201 O5' G E 110 81.400 120.535 112.149 1.00 45.85 O ATOM 202 C5' G E 110 82.810 120.676 112.027 1.00 44.82 C ATOM 203 C4' G E 110 83.152 121.453 110.781 1.00 44.22 C ATOM 204 O4' G E 110 82.883 120.656 109.597 1.00 43.90 O ATOM 205 C3' G E 110 82.334 122.706 110.518 1.00 43.75 C ATOM 206 O3' G E 110 82.731 123.798 111.349 1.00 43.87 O ATOM 207 C2' G E 110 82.661 122.964 109.051 1.00 43.40 C ATOM 208 O2' G E 110 83.956 123.496 108.893 1.00 43.10 O ATOM 209 C1' G E 110 82.725 121.538 108.496 1.00 43.04 C ATOM 210 N9 G E 110 81.558 121.141 107.714 1.00 42.25 N ATOM 211 C8 G E 110 80.231 121.265 108.054 1.00 41.81 C ATOM 212 N7 G E 110 79.419 120.845 107.121 1.00 40.98 N ATOM 213 C5 G E 110 80.264 120.405 106.109 1.00 41.14 C ATOM 214 C6 G E 110 79.968 119.833 104.850 1.00 40.37 C ATOM 215 O6 G E 110 78.865 119.598 104.355 1.00 40.17 O ATOM 216 N1 G E 110 81.124 119.533 104.141 1.00 40.13 N ATOM 217 C2 G E 110 82.403 119.761 104.581 1.00 40.28 C ATOM 218 N2 G E 110 83.397 119.428 103.743 1.00 40.23 N ATOM 219 N3 G E 110 82.692 120.283 105.754 1.00 40.88 N ATOM 220 C4 G E 110 81.585 120.581 106.461 1.00 41.38 C ATOM 221 P C E 111 81.682 124.983 111.678 1.00 44.46 P ATOM 222 OP1 C E 111 82.454 126.085 112.343 1.00 44.29 O ATOM 223 OP2 C E 111 80.460 124.422 112.351 1.00 44.02 O ATOM 224 O5' C E 111 81.254 125.553 110.257 1.00 43.47 O ATOM 225 C5' C E 111 81.373 126.936 109.986 1.00 42.89 C ATOM 226 C4' C E 111 82.380 127.161 108.897 1.00 42.73 C ATOM 227 O4' C E 111 81.887 126.519 107.718 1.00 42.34 O ATOM 228 C3' C E 111 82.552 128.616 108.497 1.00 42.78 C ATOM 229 O3' C E 111 83.599 129.146 109.309 1.00 43.56 O ATOM 230 C2' C E 111 82.957 128.536 107.015 1.00 42.33 C ATOM 231 O2' C E 111 84.346 128.654 106.772 1.00 42.05 O ATOM 232 C1' C E 111 82.451 127.146 106.598 1.00 41.92 C ATOM 233 N1 C E 111 81.470 127.052 105.521 1.00 41.37 N ATOM 234 C2 C E 111 81.858 126.471 104.313 1.00 41.14 C ATOM 235 O2 C E 111 83.046 126.121 104.174 1.00 40.52 O ATOM 236 N3 C E 111 80.933 126.302 103.336 1.00 40.61 N ATOM 237 C4 C E 111 79.672 126.701 103.534 1.00 40.70 C ATOM 238 N4 C E 111 78.789 126.505 102.554 1.00 40.17 N ATOM 239 C5 C E 111 79.261 127.321 104.751 1.00 40.69 C ATOM 240 C6 C E 111 80.185 127.483 105.704 1.00 41.24 C ATOM 241 P G E 112 83.284 129.674 110.809 1.00 44.96 P ATOM 242 OP1 G E 112 83.890 128.669 111.744 1.00 43.96 O ATOM 243 OP2 G E 112 81.831 130.033 110.970 1.00 44.37 O ATOM 244 O5' G E 112 84.117 131.044 110.843 1.00 44.38 O ATOM 245 C5' G E 112 83.801 132.119 111.742 1.00 44.36 C ATOM 246 C4' G E 112 84.153 133.438 111.089 1.00 44.41 C ATOM 247 O4' G E 112 85.422 133.235 110.415 1.00 43.92 O ATOM 248 C3' G E 112 83.183 133.863 109.997 1.00 44.46 C ATOM 249 O3' G E 112 82.071 133.020 109.779 1.00 45.40 O ATOM 250 C2' G E 112 84.061 134.540 108.942 1.00 44.30 C ATOM 251 O2' G E 112 84.208 135.920 109.195 1.00 44.61 O ATOM 252 C1' G E 112 85.430 133.896 109.176 1.00 43.87 C ATOM 253 N9 G E 112 86.032 133.007 108.184 1.00 43.60 N ATOM 254 C8 G E 112 86.313 131.674 108.346 1.00 43.24 C ATOM 255 N7 G E 112 86.933 131.149 107.320 1.00 43.18 N ATOM 256 C5 G E 112 87.052 132.190 106.415 1.00 43.12 C ATOM 257 C6 G E 112 87.640 132.224 105.108 1.00 43.35 C ATOM 258 O6 G E 112 88.196 131.307 104.467 1.00 43.05 O ATOM 259 N1 G E 112 87.540 133.485 104.541 1.00 43.21 N ATOM 260 C2 G E 112 86.957 134.569 105.138 1.00 43.41 C ATOM 261 N2 G E 112 86.968 135.697 104.411 1.00 43.50 N ATOM 262 N3 G E 112 86.408 134.557 106.349 1.00 43.39 N ATOM 263 C4 G E 112 86.489 133.344 106.924 1.00 43.46 C ATOM 264 P C E 113 80.662 133.627 109.302 1.00 45.55 P ATOM 265 OP1 C E 113 80.188 134.612 110.293 1.00 46.30 O ATOM 266 OP2 C E 113 79.840 132.423 109.045 1.00 46.14 O ATOM 267 O5' C E 113 81.003 134.376 107.930 1.00 45.79 O ATOM 268 C5' C E 113 81.051 135.797 107.870 1.00 45.96 C ATOM 269 C4' C E 113 81.423 136.269 106.480 1.00 46.30 C ATOM 270 O4' C E 113 82.791 135.904 106.169 1.00 46.46 O ATOM 271 C3' C E 113 80.603 135.700 105.330 1.00 46.72 C ATOM 272 O3' C E 113 79.380 136.409 105.181 1.00 47.11 O ATOM 273 C2' C E 113 81.533 135.903 104.136 1.00 46.76 C ATOM 274 O2' C E 113 81.517 137.217 103.604 1.00 47.30 O ATOM 275 C1' C E 113 82.901 135.639 104.774 1.00 46.62 C ATOM 276 N1 C E 113 83.315 134.247 104.617 1.00 46.32 N ATOM 277 C2 C E 113 84.026 133.881 103.481 1.00 46.41 C ATOM 278 O2 C E 113 84.279 134.746 102.630 1.00 46.66 O ATOM 279 N3 C E 113 84.423 132.598 103.331 1.00 46.48 N ATOM 280 C4 C E 113 84.132 131.702 104.278 1.00 46.45 C ATOM 281 N4 C E 113 84.551 130.440 104.107 1.00 46.52 N ATOM 282 C5 C E 113 83.397 132.055 105.446 1.00 46.49 C ATOM 283 C6 C E 113 83.012 133.323 105.572 1.00 46.26 C ATOM 284 P A E 114 78.022 135.625 104.797 1.00 47.59 P ATOM 285 OP1 A E 114 78.182 135.166 103.393 1.00 47.51 O ATOM 286 OP2 A E 114 76.872 136.509 105.164 1.00 47.38 O ATOM 287 O5' A E 114 77.962 134.326 105.727 1.00 46.48 O ATOM 288 C5' A E 114 76.814 133.467 105.684 1.00 45.60 C ATOM 289 C4' A E 114 77.228 132.006 105.585 1.00 44.73 C ATOM 290 O4' A E 114 77.916 131.764 104.326 1.00 44.23 O ATOM 291 C3' A E 114 78.183 131.512 106.664 1.00 44.34 C ATOM 292 O3' A E 114 77.943 130.130 106.833 1.00 44.19 O ATOM 293 C2' A E 114 79.539 131.672 105.988 1.00 44.03 C ATOM 294 O2' A E 114 80.524 130.844 106.565 1.00 44.32 O ATOM 295 C1' A E 114 79.191 131.207 104.579 1.00 43.61 C ATOM 296 N9 A E 114 80.094 131.630 103.513 1.00 43.04 N ATOM 297 C8 A E 114 80.162 132.876 102.940 1.00 43.17 C ATOM 298 N7 A E 114 81.032 132.962 101.957 1.00 42.83 N ATOM 299 C5 A E 114 81.580 131.688 101.888 1.00 42.37 C ATOM 300 C6 A E 114 82.544 131.125 101.038 1.00 42.13 C ATOM 301 N6 A E 114 83.143 131.801 100.065 1.00 41.86 N ATOM 302 N1 A E 114 82.869 129.829 101.223 1.00 41.95 N ATOM 303 C2 A E 114 82.254 129.153 102.200 1.00 42.02 C ATOM 304 N3 A E 114 81.326 129.568 103.059 1.00 42.28 N ATOM 305 C4 A E 114 81.024 130.861 102.847 1.00 42.53 C ATOM 306 P U E 115 77.621 129.538 108.281 1.00 44.92 P ATOM 307 OP1 U E 115 76.397 130.230 108.762 1.00 45.30 O ATOM 308 OP2 U E 115 78.847 129.533 109.121 1.00 44.85 O ATOM 309 O5' U E 115 77.204 128.028 107.987 1.00 44.54 O ATOM 310 C5' U E 115 76.004 127.728 107.274 1.00 43.87 C ATOM 311 C4' U E 115 75.755 126.235 107.254 1.00 43.55 C ATOM 312 O4' U E 115 76.553 125.593 106.218 1.00 43.39 O ATOM 313 C3' U E 115 76.082 125.498 108.547 1.00 43.29 C ATOM 314 O3' U E 115 75.159 124.439 108.711 1.00 43.04 O ATOM 315 C2' U E 115 77.404 124.813 108.212 1.00 43.38 C ATOM 316 O2' U E 115 77.608 123.650 108.997 1.00 43.48 O ATOM 317 C1' U E 115 77.146 124.431 106.759 1.00 43.50 C ATOM 318 N1 U E 115 78.309 124.049 105.934 1.00 43.66 N ATOM 319 C2 U E 115 78.049 123.468 104.702 1.00 43.68 C ATOM 320 O2 U E 115 76.920 123.268 104.303 1.00 43.39 O ATOM 321 N3 U E 115 79.153 123.132 103.963 1.00 43.66 N ATOM 322 C4 U E 115 80.472 123.308 104.312 1.00 43.71 C ATOM 323 O4 U E 115 81.361 122.941 103.526 1.00 43.21 O ATOM 324 C5 U E 115 80.672 123.915 105.604 1.00 43.63 C ATOM 325 C6 U E 115 79.609 124.254 106.350 1.00 43.80 C ATOM 326 P A E 116 73.622 124.764 109.025 1.00 42.93 P ATOM 327 OP1 A E 116 73.446 126.238 109.145 1.00 42.92 O ATOM 328 OP2 A E 116 73.179 123.847 110.122 1.00 42.10 O ATOM 329 O5' A E 116 72.882 124.356 107.681 1.00 42.41 O ATOM 330 C5' A E 116 72.900 123.011 107.223 1.00 41.37 C ATOM 331 C4' A E 116 71.710 122.762 106.336 1.00 40.61 C ATOM 332 O4' A E 116 71.668 123.751 105.277 1.00 40.89 O ATOM 333 C3' A E 116 71.728 121.441 105.600 1.00 40.06 C ATOM 334 O3' A E 116 71.306 120.414 106.473 1.00 38.75 O ATOM 335 C2' A E 116 70.779 121.713 104.449 1.00 40.29 C ATOM 336 O2' A E 116 69.440 121.681 104.886 1.00 40.42 O ATOM 337 C1' A E 116 71.153 123.159 104.094 1.00 40.44 C ATOM 338 N9 A E 116 72.200 123.235 103.079 1.00 40.66 N ATOM 339 C8 A E 116 73.395 123.912 103.159 1.00 40.65 C ATOM 340 N7 A E 116 74.172 123.745 102.111 1.00 40.72 N ATOM 341 C5 A E 116 73.432 122.907 101.280 1.00 40.90 C ATOM 342 C6 A E 116 73.701 122.342 100.021 1.00 40.71 C ATOM 343 N6 A E 116 74.835 122.527 99.355 1.00 40.29 N ATOM 344 N1 A E 116 72.745 121.567 99.468 1.00 41.12 N ATOM 345 C2 A E 116 71.602 121.366 100.145 1.00 40.91 C ATOM 346 N3 A E 116 71.237 121.826 101.332 1.00 40.65 N ATOM 347 C4 A E 116 72.207 122.601 101.857 1.00 40.82 C ATOM 348 P A E 117 72.118 119.044 106.494 1.00 38.18 P ATOM 349 OP1 A E 117 71.693 118.185 107.632 1.00 37.52 O ATOM 350 OP2 A E 117 73.564 119.386 106.325 1.00 37.77 O ATOM 351 O5' A E 117 71.657 118.350 105.123 1.00 37.85 O ATOM 352 C5' A E 117 70.271 118.146 104.828 1.00 36.50 C ATOM 353 C4' A E 117 70.085 117.693 103.388 1.00 35.49 C ATOM 354 O4' A E 117 70.478 118.743 102.474 1.00 35.44 O ATOM 355 C3' A E 117 70.916 116.500 102.954 1.00 34.90 C ATOM 356 O3' A E 117 70.315 115.296 103.388 1.00 34.49 O ATOM 357 C2' A E 117 70.911 116.654 101.443 1.00 34.95 C ATOM 358 O2' A E 117 69.662 116.330 100.866 1.00 34.82 O ATOM 359 C1' A E 117 71.057 118.166 101.308 1.00 35.03 C ATOM 360 N9 A E 117 72.454 118.594 101.226 1.00 35.06 N ATOM 361 C8 A E 117 73.213 119.177 102.213 1.00 34.89 C ATOM 362 N7 A E 117 74.434 119.475 101.837 1.00 34.71 N ATOM 363 C5 A E 117 74.492 119.047 100.520 1.00 34.73 C ATOM 364 C6 A E 117 75.512 119.075 99.569 1.00 34.39 C ATOM 365 N6 A E 117 76.730 119.571 99.800 1.00 33.81 N ATOM 366 N1 A E 117 75.239 118.576 98.353 1.00 34.27 N ATOM 367 C2 A E 117 74.023 118.086 98.114 1.00 34.44 C ATOM 368 N3 A E 117 72.981 117.999 98.918 1.00 34.71 N ATOM 369 C4 A E 117 73.279 118.501 100.127 1.00 34.99 C ATOM 370 P C E 118 71.237 114.097 103.928 1.00 34.62 P ATOM 371 OP1 C E 118 70.380 112.985 104.429 1.00 34.35 O ATOM 372 OP2 C E 118 72.266 114.681 104.828 1.00 34.77 O ATOM 373 O5' C E 118 72.011 113.607 102.613 1.00 34.69 O ATOM 374 C5' C E 118 71.312 113.126 101.460 1.00 33.38 C ATOM 375 C4' C E 118 72.253 113.054 100.287 1.00 32.79 C ATOM 376 O4' C E 118 72.694 114.395 99.946 1.00 32.72 O ATOM 377 C3' C E 118 73.546 112.299 100.543 1.00 32.36 C ATOM 378 O3' C E 118 73.365 110.912 100.387 1.00 31.58 O ATOM 379 C2' C E 118 74.475 112.882 99.492 1.00 32.65 C ATOM 380 O2' C E 118 74.268 112.328 98.206 1.00 32.98 O ATOM 381 C1' C E 118 74.038 114.349 99.484 1.00 32.78 C ATOM 382 N1 C E 118 74.859 115.168 100.383 1.00 33.37 N ATOM 383 C2 C E 118 76.154 115.523 99.985 1.00 33.34 C ATOM 384 O2 C E 118 76.564 115.150 98.879 1.00 33.66 O ATOM 385 N3 C E 118 76.925 116.256 100.809 1.00 32.77 N ATOM 386 C4 C E 118 76.455 116.630 101.996 1.00 33.20 C ATOM 387 N4 C E 118 77.252 117.349 102.782 1.00 32.68 N ATOM 388 C5 C E 118 75.139 116.287 102.431 1.00 33.55 C ATOM 389 C6 C E 118 74.378 115.567 101.597 1.00 33.36 C ATOM 390 P C E 119 74.277 109.891 101.226 1.00 31.54 P ATOM 391 OP1 C E 119 73.942 108.497 100.860 1.00 31.65 O ATOM 392 OP2 C E 119 74.190 110.305 102.648 1.00 32.02 O ATOM 393 O5' C E 119 75.763 110.214 100.756 1.00 31.30 O ATOM 394 C5' C E 119 76.231 109.862 99.463 1.00 30.15 C ATOM 395 C4' C E 119 77.625 110.407 99.263 1.00 29.60 C ATOM 396 O4' C E 119 77.586 111.851 99.420 1.00 29.60 O ATOM 397 C3' C E 119 78.661 109.969 100.285 1.00 29.45 C ATOM 398 O3' C E 119 79.203 108.677 100.035 1.00 29.38 O ATOM 399 C2' C E 119 79.695 111.080 100.182 1.00 29.41 C ATOM 400 O2' C E 119 80.512 111.014 99.036 1.00 29.01 O ATOM 401 C1' C E 119 78.792 112.297 100.023 1.00 29.73 C ATOM 402 N1 C E 119 78.459 112.909 101.318 1.00 29.98 N ATOM 403 C2 C E 119 79.388 113.768 101.931 1.00 30.03 C ATOM 404 O2 C E 119 80.487 113.949 101.392 1.00 29.44 O ATOM 405 N3 C E 119 79.059 114.377 103.090 1.00 30.18 N ATOM 406 C4 C E 119 77.870 114.141 103.650 1.00 30.60 C ATOM 407 N4 C E 119 77.587 114.750 104.798 1.00 30.72 N ATOM 408 C5 C E 119 76.918 113.264 103.062 1.00 30.59 C ATOM 409 C6 C E 119 77.253 112.668 101.908 1.00 30.48 C ATOM 410 P A E 120 79.556 107.707 101.275 1.00 29.06 P ATOM 411 OP1 A E 120 80.081 106.431 100.747 1.00 29.64 O ATOM 412 OP2 A E 120 78.414 107.686 102.224 1.00 29.14 O ATOM 413 O5' A E 120 80.767 108.463 101.991 1.00 29.82 O ATOM 414 C5' A E 120 82.009 108.618 101.332 1.00 29.48 C ATOM 415 C4' A E 120 82.901 109.538 102.121 1.00 29.81 C ATOM 416 O4' A E 120 82.280 110.844 102.283 1.00 29.79 O ATOM 417 C3' A E 120 83.207 109.097 103.544 1.00 30.06 C ATOM 418 O3' A E 120 84.232 108.111 103.526 1.00 30.50 O ATOM 419 C2' A E 120 83.637 110.412 104.184 1.00 29.68 C ATOM 420 O2' A E 120 84.896 110.788 103.685 1.00 29.72 O ATOM 421 C1' A E 120 82.642 111.388 103.551 1.00 29.65 C ATOM 422 N9 A E 120 81.424 111.568 104.338 1.00 29.53 N ATOM 423 C8 A E 120 80.183 111.034 104.102 1.00 29.63 C ATOM 424 N7 A E 120 79.276 111.377 104.993 1.00 29.56 N ATOM 425 C5 A E 120 79.971 112.191 105.874 1.00 29.77 C ATOM 426 C6 A E 120 79.583 112.879 107.048 1.00 29.63 C ATOM 427 N6 A E 120 78.352 112.838 107.562 1.00 29.70 N ATOM 428 N1 A E 120 80.520 113.618 107.685 1.00 29.35 N ATOM 429 C2 A E 120 81.752 113.648 107.190 1.00 29.46 C ATOM 430 N3 A E 120 82.247 113.037 106.104 1.00 29.85 N ATOM 431 C4 A E 120 81.293 112.318 105.482 1.00 29.72 C ATOM 432 P C E 121 84.283 106.990 104.678 1.00 31.07 P ATOM 433 OP1 C E 121 85.453 106.123 104.399 1.00 30.99 O ATOM 434 OP2 C E 121 82.942 106.404 104.839 1.00 30.56 O ATOM 435 O5' C E 121 84.613 107.829 105.999 1.00 32.01 O ATOM 436 C5' C E 121 85.888 108.452 106.150 1.00 32.28 C ATOM 437 C4' C E 121 85.875 109.422 107.307 1.00 32.73 C ATOM 438 O4' C E 121 84.803 110.374 107.111 1.00 32.89 O ATOM 439 C3' C E 121 85.610 108.837 108.687 1.00 33.01 C ATOM 440 O3' C E 121 86.815 108.294 109.215 1.00 33.96 O ATOM 441 C2' C E 121 85.118 110.063 109.446 1.00 33.10 C ATOM 442 O2' C E 121 86.188 110.961 109.701 1.00 33.49 O ATOM 443 C1' C E 121 84.258 110.738 108.371 1.00 33.02 C ATOM 444 N1 C E 121 82.831 110.367 108.380 1.00 32.91 N ATOM 445 C2 C E 121 81.989 111.018 109.276 1.00 33.11 C ATOM 446 O2 C E 121 82.469 111.858 110.039 1.00 33.53 O ATOM 447 N3 C E 121 80.670 110.722 109.291 1.00 33.25 N ATOM 448 C4 C E 121 80.185 109.813 108.450 1.00 33.07 C ATOM 449 N4 C E 121 78.878 109.575 108.501 1.00 33.39 N ATOM 450 C5 C E 121 81.023 109.118 107.524 1.00 32.79 C ATOM 451 C6 C E 121 82.332 109.425 107.525 1.00 32.52 C ATOM 452 P C E 122 86.772 107.037 110.242 1.00 35.49 P ATOM 453 OP1 C E 122 88.177 106.601 110.481 1.00 34.66 O ATOM 454 OP2 C E 122 85.767 106.030 109.824 1.00 34.96 O ATOM 455 O5' C E 122 86.246 107.723 111.577 1.00 36.10 O ATOM 456 C5' C E 122 86.860 108.905 112.068 1.00 37.91 C ATOM 457 C4' C E 122 86.281 109.267 113.414 1.00 39.23 C ATOM 458 O4' C E 122 84.865 109.587 113.259 1.00 39.18 O ATOM 459 C3' C E 122 86.345 108.159 114.458 1.00 40.00 C ATOM 460 O3' C E 122 86.448 108.778 115.750 1.00 41.84 O ATOM 461 C2' C E 122 84.990 107.466 114.271 1.00 39.81 C ATOM 462 O2' C E 122 84.560 106.708 115.390 1.00 39.68 O ATOM 463 C1' C E 122 84.079 108.667 113.988 1.00 39.58 C ATOM 464 N1 C E 122 82.866 108.382 113.191 1.00 39.73 N ATOM 465 C2 C E 122 81.621 108.792 113.686 1.00 39.79 C ATOM 466 O2 C E 122 81.576 109.368 114.780 1.00 39.76 O ATOM 467 N3 C E 122 80.501 108.549 112.961 1.00 39.71 N ATOM 468 C4 C E 122 80.594 107.924 111.781 1.00 39.93 C ATOM 469 N4 C E 122 79.465 107.706 111.089 1.00 39.32 N ATOM 470 C5 C E 122 81.849 107.492 111.255 1.00 39.71 C ATOM 471 C6 C E 122 82.948 107.737 111.987 1.00 39.83 C ATOM 472 P U E 123 87.832 108.711 116.594 1.00 42.72 P ATOM 473 OP1 U E 123 88.965 108.913 115.658 1.00 43.38 O ATOM 474 OP2 U E 123 87.781 107.460 117.411 1.00 42.25 O ATOM 475 O5' U E 123 87.760 110.040 117.474 1.00 43.40 O ATOM 476 C5' U E 123 88.224 111.272 116.925 1.00 45.05 C ATOM 477 C4' U E 123 87.651 112.472 117.662 1.00 45.97 C ATOM 478 O4' U E 123 86.202 112.501 117.517 1.00 47.33 O ATOM 479 C3' U E 123 87.929 112.573 119.161 1.00 46.37 C ATOM 480 O3' U E 123 88.050 113.961 119.547 1.00 45.27 O ATOM 481 C2' U E 123 86.630 112.054 119.777 1.00 47.12 C ATOM 482 O2' U E 123 86.339 112.630 121.038 1.00 47.36 O ATOM 483 C1' U E 123 85.603 112.601 118.799 1.00 47.97 C ATOM 484 N1 U E 123 84.348 111.833 118.832 1.00 49.19 N ATOM 485 C2 U E 123 83.233 112.460 119.376 1.00 49.79 C ATOM 486 O2 U E 123 83.265 113.608 119.802 1.00 50.29 O ATOM 487 N3 U E 123 82.089 111.702 119.407 1.00 50.05 N ATOM 488 C4 U E 123 81.939 110.402 118.959 1.00 50.28 C ATOM 489 O4 U E 123 80.832 109.845 119.058 1.00 50.30 O ATOM 490 C5 U E 123 83.137 109.818 118.401 1.00 50.24 C ATOM 491 C6 U E 123 84.272 110.539 118.358 1.00 49.62 C ATOM 492 P C E 124 89.507 114.582 119.879 1.00 44.17 P ATOM 493 OP1 C E 124 90.169 113.764 120.937 1.00 44.27 O ATOM 494 OP2 C E 124 89.305 116.048 120.100 1.00 44.03 O ATOM 495 O5' C E 124 90.304 114.306 118.515 1.00 42.43 O ATOM 496 C5' C E 124 91.711 114.544 118.376 1.00 38.66 C ATOM 497 C4' C E 124 91.992 115.184 117.021 1.00 36.49 C ATOM 498 O4' C E 124 93.417 115.414 116.882 1.00 35.15 O ATOM 499 C3' C E 124 91.605 114.337 115.815 1.00 35.21 C ATOM 500 O3' C E 124 91.337 115.192 114.703 1.00 34.71 O ATOM 501 C2' C E 124 92.880 113.531 115.572 1.00 34.63 C ATOM 502 O2' C E 124 92.975 113.033 114.254 1.00 33.56 O ATOM 503 C1' C E 124 93.940 114.597 115.849 1.00 34.20 C ATOM 504 N1 C E 124 95.250 114.097 116.289 1.00 33.11 N ATOM 505 C2 C E 124 96.390 114.572 115.649 1.00 32.44 C ATOM 506 O2 C E 124 96.264 115.375 114.731 1.00 32.14 O ATOM 507 N3 C E 124 97.600 114.152 116.046 1.00 31.96 N ATOM 508 C4 C E 124 97.707 113.277 117.040 1.00 32.18 C ATOM 509 N4 C E 124 98.923 112.879 117.369 1.00 31.82 N ATOM 510 C5 C E 124 96.561 112.766 117.726 1.00 32.24 C ATOM 511 C6 C E 124 95.359 113.198 117.315 1.00 32.90 C ATOM 512 P A E 125 89.825 115.650 114.372 1.00 33.91 P ATOM 513 OP1 A E 125 89.821 116.184 112.991 1.00 34.30 O ATOM 514 OP2 A E 125 89.333 116.498 115.464 1.00 34.20 O ATOM 515 O5' A E 125 89.001 114.299 114.374 1.00 34.39 O ATOM 516 C5' A E 125 89.200 113.308 113.377 1.00 35.23 C ATOM 517 C4' A E 125 87.872 112.951 112.762 1.00 36.37 C ATOM 518 O4' A E 125 86.939 112.618 113.824 1.00 37.23 O ATOM 519 C3' A E 125 87.198 114.082 111.996 1.00 36.78 C ATOM 520 O3' A E 125 87.667 114.065 110.640 1.00 36.04 O ATOM 521 C2' A E 125 85.717 113.722 112.098 1.00 37.51 C ATOM 522 O2' A E 125 85.331 112.719 111.187 1.00 38.54 O ATOM 523 C1' A E 125 85.643 113.080 113.484 1.00 38.38 C ATOM 524 N9 A E 125 85.131 113.955 114.546 1.00 39.94 N ATOM 525 C8 A E 125 85.632 115.157 114.997 1.00 40.38 C ATOM 526 N7 A E 125 84.915 115.704 115.952 1.00 40.93 N ATOM 527 C5 A E 125 83.876 114.796 116.151 1.00 41.08 C ATOM 528 C6 A E 125 82.769 114.789 117.029 1.00 41.42 C ATOM 529 N6 A E 125 82.522 115.761 117.918 1.00 41.45 N ATOM 530 N1 A E 125 81.914 113.737 116.963 1.00 41.59 N ATOM 531 C2 A E 125 82.163 112.765 116.077 1.00 41.19 C ATOM 532 N3 A E 125 83.166 112.656 115.205 1.00 41.07 N ATOM 533 C4 A E 125 83.997 113.716 115.293 1.00 40.78 C ATOM 534 P G E 126 88.437 115.335 110.036 1.00 35.35 P ATOM 535 OP1 G E 126 89.912 115.266 110.222 1.00 36.24 O ATOM 536 OP2 G E 126 87.710 116.560 110.442 1.00 36.26 O ATOM 537 O5' G E 126 88.271 115.150 108.470 1.00 35.34 O ATOM 538 C5' G E 126 87.027 115.334 107.839 1.00 32.58 C ATOM 539 C4' G E 126 87.135 116.433 106.810 1.00 30.94 C ATOM 540 O4' G E 126 85.817 116.525 106.227 1.00 29.97 O ATOM 541 C3' G E 126 87.413 117.812 107.404 1.00 30.29 C ATOM 542 O3' G E 126 87.834 118.744 106.407 1.00 29.06 O ATOM 543 C2' G E 126 86.020 118.246 107.820 1.00 29.94 C ATOM 544 O2' G E 126 85.902 119.647 107.890 1.00 30.22 O ATOM 545 C1' G E 126 85.225 117.732 106.626 1.00 29.93 C ATOM 546 N9 G E 126 83.797 117.514 106.816 1.00 29.77 N ATOM 547 C8 G E 126 83.000 117.988 107.831 1.00 29.76 C ATOM 548 N7 G E 126 81.735 117.707 107.660 1.00 29.55 N ATOM 549 C5 G E 126 81.703 116.979 106.478 1.00 29.40 C ATOM 550 C6 G E 126 80.615 116.429 105.775 1.00 29.20 C ATOM 551 O6 G E 126 79.419 116.473 106.063 1.00 28.97 O ATOM 552 N1 G E 126 81.032 115.788 104.612 1.00 29.10 N ATOM 553 C2 G E 126 82.332 115.699 104.174 1.00 29.00 C ATOM 554 N2 G E 126 82.536 115.056 103.004 1.00 28.88 N ATOM 555 N3 G E 126 83.353 116.209 104.824 1.00 29.09 N ATOM 556 C4 G E 126 82.971 116.836 105.956 1.00 29.42 C ATOM 557 P U E 127 89.360 118.771 105.908 1.00 27.82 P ATOM 558 OP1 U E 127 89.940 117.408 106.059 1.00 28.33 O ATOM 559 OP2 U E 127 90.044 119.917 106.519 1.00 28.26 O ATOM 560 O5' U E 127 89.187 119.143 104.367 1.00 28.48 O ATOM 561 C5' U E 127 88.687 118.192 103.416 1.00 28.27 C ATOM 562 C4' U E 127 87.915 118.896 102.310 1.00 28.65 C ATOM 563 O4' U E 127 86.709 119.479 102.889 1.00 28.84 O ATOM 564 C3' U E 127 88.642 120.055 101.622 1.00 28.53 C ATOM 565 O3' U E 127 88.162 120.224 100.285 1.00 28.37 O ATOM 566 C2' U E 127 88.096 121.258 102.375 1.00 28.78 C ATOM 567 O2' U E 127 88.161 122.456 101.636 1.00 28.98 O ATOM 568 C1' U E 127 86.641 120.835 102.521 1.00 29.07 C ATOM 569 N1 U E 127 85.897 121.561 103.547 1.00 29.92 N ATOM 570 C2 U E 127 84.782 122.259 103.149 1.00 30.69 C ATOM 571 O2 U E 127 84.385 122.273 101.978 1.00 31.18 O ATOM 572 N3 U E 127 84.141 122.936 104.152 1.00 30.77 N ATOM 573 C4 U E 127 84.494 122.978 105.474 1.00 30.69 C ATOM 574 O4 U E 127 83.799 123.628 106.258 1.00 31.36 O ATOM 575 C5 U E 127 85.654 122.222 105.811 1.00 30.38 C ATOM 576 C6 U E 127 86.298 121.552 104.858 1.00 30.47 C ATOM 577 P G E 128 88.784 119.360 99.077 1.00 28.13 P ATOM 578 OP1 G E 128 90.028 118.685 99.520 1.00 28.28 O ATOM 579 OP2 G E 128 88.826 120.221 97.877 1.00 27.97 O ATOM 580 O5' G E 128 87.653 118.265 98.859 1.00 27.45 O ATOM 581 C5' G E 128 87.930 117.019 98.228 1.00 25.82 C ATOM 582 C4' G E 128 86.633 116.355 97.814 1.00 24.76 C ATOM 583 O4' G E 128 85.859 116.035 98.992 1.00 23.77 O ATOM 584 C3' G E 128 85.662 117.208 97.010 1.00 24.04 C ATOM 585 O3' G E 128 86.027 117.325 95.644 1.00 24.13 O ATOM 586 C2' G E 128 84.372 116.420 97.168 1.00 24.08 C ATOM 587 O2' G E 128 84.319 115.280 96.324 1.00 24.24 O ATOM 588 C1' G E 128 84.500 115.911 98.611 1.00 23.63 C ATOM 589 N9 G E 128 83.653 116.636 99.551 1.00 23.49 N ATOM 590 C8 G E 128 84.041 117.475 100.575 1.00 23.15 C ATOM 591 N7 G E 128 83.026 117.950 101.257 1.00 22.88 N ATOM 592 C5 G E 128 81.907 117.399 100.642 1.00 22.79 C ATOM 593 C6 G E 128 80.535 117.539 100.951 1.00 23.10 C ATOM 594 O6 G E 128 80.015 118.194 101.873 1.00 22.93 O ATOM 595 N1 G E 128 79.732 116.809 100.075 1.00 22.64 N ATOM 596 C2 G E 128 80.204 116.022 99.039 1.00 23.07 C ATOM 597 N2 G E 128 79.271 115.362 98.292 1.00 22.27 N ATOM 598 N3 G E 128 81.493 115.885 98.752 1.00 22.68 N ATOM 599 C4 G E 128 82.275 116.595 99.585 1.00 23.02 C ATOM 600 P C E 129 85.892 118.757 94.894 1.00 24.21 P ATOM 601 OP1 C E 129 86.414 118.595 93.524 1.00 24.46 O ATOM 602 OP2 C E 129 86.504 119.809 95.752 1.00 24.76 O ATOM 603 O5' C E 129 84.318 119.020 94.876 1.00 24.91 O ATOM 604 C5' C E 129 83.424 118.074 94.277 1.00 26.56 C ATOM 605 C4' C E 129 81.978 118.343 94.670 1.00 27.64 C ATOM 606 O4' C E 129 81.774 118.053 96.070 1.00 27.93 O ATOM 607 C3' C E 129 81.478 119.772 94.543 1.00 28.49 C ATOM 608 O3' C E 129 81.180 120.097 93.205 1.00 30.43 O ATOM 609 C2' C E 129 80.222 119.746 95.408 1.00 28.39 C ATOM 610 O2' C E 129 79.108 119.187 94.747 1.00 27.85 O ATOM 611 C1' C E 129 80.656 118.803 96.541 1.00 28.00 C ATOM 612 N1 C E 129 81.050 119.509 97.777 1.00 27.48 N ATOM 613 C2 C E 129 80.063 119.849 98.664 1.00 27.21 C ATOM 614 O2 C E 129 78.904 119.514 98.403 1.00 27.52 O ATOM 615 N3 C E 129 80.381 120.527 99.789 1.00 27.30 N ATOM 616 C4 C E 129 81.643 120.834 100.038 1.00 26.96 C ATOM 617 N4 C E 129 81.905 121.483 101.174 1.00 26.55 N ATOM 618 C5 C E 129 82.692 120.484 99.142 1.00 26.99 C ATOM 619 C6 C E 129 82.353 119.826 98.037 1.00 27.07 C ATOM 620 P G E 130 81.369 121.611 92.686 1.00 31.87 P ATOM 621 OP1 G E 130 80.094 122.290 93.073 1.00 32.33 O ATOM 622 OP2 G E 130 81.800 121.605 91.264 1.00 31.93 O ATOM 623 O5' G E 130 82.553 122.219 93.565 1.00 31.56 O ATOM 624 C5' G E 130 83.189 123.441 93.188 1.00 30.92 C ATOM 625 C4' G E 130 84.278 123.785 94.179 1.00 30.93 C ATOM 626 O4' G E 130 83.717 124.437 95.353 1.00 30.43 O ATOM 627 C3' G E 130 85.059 122.595 94.709 1.00 30.81 C ATOM 628 O3' G E 130 86.381 123.009 94.999 1.00 31.98 O ATOM 629 C2' G E 130 84.311 122.257 95.990 1.00 30.27 C ATOM 630 O2' G E 130 85.133 121.618 96.941 1.00 29.74 O ATOM 631 C1' G E 130 83.939 123.647 96.497 1.00 29.91 C ATOM 632 N9 G E 130 82.708 123.688 97.272 1.00 29.43 N ATOM 633 C8 G E 130 81.461 123.342 96.833 1.00 28.92 C ATOM 634 N7 G E 130 80.527 123.568 97.713 1.00 28.25 N ATOM 635 C5 G E 130 81.199 124.076 98.806 1.00 28.29 C ATOM 636 C6 G E 130 80.703 124.511 100.028 1.00 28.34 C ATOM 637 O6 G E 130 79.518 124.545 100.397 1.00 27.64 O ATOM 638 N1 G E 130 81.726 124.952 100.873 1.00 28.16 N ATOM 639 C2 G E 130 83.070 124.979 100.542 1.00 28.66 C ATOM 640 N2 G E 130 83.923 125.466 101.468 1.00 28.48 N ATOM 641 N3 G E 130 83.542 124.569 99.379 1.00 28.79 N ATOM 642 C4 G E 130 82.555 124.136 98.563 1.00 28.95 C ATOM 643 P A E 131 87.602 122.371 94.188 1.00 32.91 P ATOM 644 OP1 A E 131 87.087 121.297 93.287 1.00 33.58 O ATOM 645 OP2 A E 131 88.686 122.052 95.146 1.00 33.31 O ATOM 646 O5' A E 131 88.060 123.538 93.229 1.00 35.38 O ATOM 647 C5' A E 131 88.710 124.678 93.736 1.00 38.26 C ATOM 648 C4' A E 131 88.146 125.918 93.095 1.00 40.00 C ATOM 649 O4' A E 131 86.715 125.976 93.317 1.00 40.09 O ATOM 650 C3' A E 131 88.690 127.205 93.683 1.00 41.09 C ATOM 651 O3' A E 131 89.872 127.552 93.012 1.00 43.55 O ATOM 652 C2' A E 131 87.562 128.181 93.451 1.00 40.94 C ATOM 653 O2' A E 131 87.562 128.630 92.112 1.00 40.75 O ATOM 654 C1' A E 131 86.353 127.282 93.722 1.00 40.55 C ATOM 655 N9 A E 131 86.013 127.212 95.140 1.00 40.63 N ATOM 656 C8 A E 131 86.303 126.212 96.040 1.00 40.64 C ATOM 657 N7 A E 131 85.852 126.446 97.251 1.00 40.71 N ATOM 658 C5 A E 131 85.227 127.683 97.138 1.00 40.78 C ATOM 659 C6 A E 131 84.542 128.499 98.067 1.00 40.84 C ATOM 660 N6 A E 131 84.355 128.188 99.357 1.00 40.99 N ATOM 661 N1 A E 131 84.041 129.668 97.618 1.00 40.99 N ATOM 662 C2 A E 131 84.212 129.989 96.333 1.00 40.87 C ATOM 663 N3 A E 131 84.829 129.312 95.370 1.00 40.87 N ATOM 664 C4 A E 131 85.320 128.160 95.844 1.00 40.66 C ATOM 665 P G E 132 91.108 128.112 93.852 1.00 45.88 P ATOM 666 OP1 G E 132 92.351 127.610 93.174 1.00 45.35 O ATOM 667 OP2 G E 132 90.877 127.836 95.302 1.00 45.44 O ATOM 668 O5' G E 132 90.977 129.685 93.680 1.00 46.52 O ATOM 669 C5' G E 132 91.038 130.540 94.804 1.00 48.81 C ATOM 670 C4' G E 132 89.824 131.432 94.833 1.00 50.08 C ATOM 671 O4' G E 132 88.649 130.661 95.205 1.00 50.52 O ATOM 672 C3' G E 132 89.875 132.549 95.860 1.00 50.76 C ATOM 673 O3' G E 132 90.648 133.623 95.337 1.00 51.81 O ATOM 674 C2' G E 132 88.397 132.879 96.053 1.00 50.78 C ATOM 675 O2' G E 132 87.873 133.662 94.997 1.00 50.77 O ATOM 676 C1' G E 132 87.778 131.476 95.989 1.00 50.67 C ATOM 677 N9 G E 132 87.624 130.843 97.298 1.00 50.58 N ATOM 678 C8 G E 132 88.094 129.603 97.678 1.00 50.50 C ATOM 679 N7 G E 132 87.774 129.290 98.906 1.00 50.49 N ATOM 680 C5 G E 132 87.060 130.391 99.371 1.00 50.37 C ATOM 681 C6 G E 132 86.458 130.634 100.635 1.00 50.17 C ATOM 682 O6 G E 132 86.423 129.899 101.624 1.00 50.38 O ATOM 683 N1 G E 132 85.848 131.876 100.683 1.00 50.01 N ATOM 684 C2 G E 132 85.807 132.774 99.651 1.00 50.05 C ATOM 685 N2 G E 132 85.158 133.921 99.904 1.00 49.86 N ATOM 686 N3 G E 132 86.357 132.566 98.462 1.00 50.21 N ATOM 687 C4 G E 132 86.963 131.361 98.394 1.00 50.37 C ATOM 688 P C E 133 91.875 134.213 96.189 1.00 52.32 P ATOM 689 OP1 C E 133 92.753 134.936 95.224 1.00 52.16 O ATOM 690 OP2 C E 133 92.449 133.127 97.039 1.00 52.18 O ATOM 691 O5' C E 133 91.135 135.253 97.144 1.00 52.33 O ATOM 692 C5' C E 133 90.214 136.196 96.608 1.00 52.44 C ATOM 693 C4' C E 133 89.399 136.816 97.718 1.00 52.65 C ATOM 694 O4' C E 133 88.392 135.877 98.179 1.00 52.58 O ATOM 695 C3' C E 133 90.173 137.178 98.975 1.00 52.70 C ATOM 696 O3' C E 133 90.939 138.371 98.832 1.00 52.88 O ATOM 697 C2' C E 133 89.071 137.216 100.031 1.00 52.80 C ATOM 698 O2' C E 133 88.275 138.389 100.049 1.00 53.12 O ATOM 699 C1' C E 133 88.198 136.041 99.578 1.00 52.72 C ATOM 700 N1 C E 133 88.567 134.781 100.238 1.00 52.65 N ATOM 701 C2 C E 133 88.029 134.492 101.503 1.00 52.58 C ATOM 702 O2 C E 133 87.274 135.327 102.043 1.00 52.28 O ATOM 703 N3 C E 133 88.347 133.317 102.100 1.00 52.46 N ATOM 704 C4 C E 133 89.165 132.455 101.487 1.00 52.45 C ATOM 705 N4 C E 133 89.443 131.304 102.103 1.00 52.33 N ATOM 706 C5 C E 133 89.735 132.734 100.211 1.00 52.50 C ATOM 707 C6 C E 133 89.412 133.896 99.628 1.00 52.60 C ATOM 708 P A E 134 92.401 138.470 99.522 1.00 53.05 P ATOM 709 OP1 A E 134 93.053 139.723 99.037 1.00 53.23 O ATOM 710 OP2 A E 134 93.122 137.183 99.368 1.00 52.94 O ATOM 711 O5' A E 134 92.039 138.674 101.058 1.00 52.60 O ATOM 712 C5' A E 134 91.151 139.717 101.439 1.00 52.05 C ATOM 713 C4' A E 134 90.624 139.490 102.832 1.00 51.93 C ATOM 714 O4' A E 134 89.762 138.321 102.857 1.00 51.60 O ATOM 715 C3' A E 134 91.667 139.201 103.900 1.00 51.80 C ATOM 716 O3' A E 134 92.338 140.384 104.329 1.00 52.32 O ATOM 717 C2' A E 134 90.826 138.518 104.973 1.00 51.45 C ATOM 718 O2' A E 134 89.995 139.409 105.691 1.00 51.25 O ATOM 719 C1' A E 134 89.921 137.644 104.100 1.00 51.24 C ATOM 720 N9 A E 134 90.532 136.339 103.834 1.00 50.60 N ATOM 721 C8 A E 134 91.275 135.945 102.743 1.00 50.17 C ATOM 722 N7 A E 134 91.695 134.701 102.809 1.00 49.85 N ATOM 723 C5 A E 134 91.197 134.246 104.027 1.00 49.90 C ATOM 724 C6 A E 134 91.297 133.000 104.694 1.00 49.57 C ATOM 725 N6 A E 134 91.958 131.948 104.204 1.00 49.15 N ATOM 726 N1 A E 134 90.686 132.879 105.896 1.00 49.51 N ATOM 727 C2 A E 134 90.018 133.940 106.391 1.00 49.70 C ATOM 728 N3 A E 134 89.853 135.157 105.860 1.00 50.08 N ATOM 729 C4 A E 134 90.475 135.245 104.665 1.00 50.15 C ATOM 730 P A E 135 93.882 140.303 104.784 1.00 52.80 P ATOM 731 OP1 A E 135 94.363 141.685 105.075 1.00 52.97 O ATOM 732 OP2 A E 135 94.630 139.462 103.809 1.00 52.44 O ATOM 733 O5' A E 135 93.804 139.532 106.177 1.00 52.31 O ATOM 734 C5' A E 135 93.043 140.060 107.259 1.00 51.90 C ATOM 735 C4' A E 135 93.044 139.085 108.420 1.00 51.90 C ATOM 736 O4' A E 135 92.357 137.858 108.021 1.00 51.67 O ATOM 737 C3' A E 135 94.421 138.630 108.896 1.00 51.79 C ATOM 738 O3' A E 135 95.186 139.576 109.707 1.00 51.65 O ATOM 739 C2' A E 135 94.109 137.275 109.525 1.00 51.59 C ATOM 740 O2' A E 135 93.565 137.407 110.831 1.00 51.51 O ATOM 741 C1' A E 135 93.032 136.735 108.565 1.00 51.36 C ATOM 742 N9 A E 135 93.547 135.934 107.446 1.00 50.73 N ATOM 743 C8 A E 135 94.054 136.402 106.259 1.00 50.62 C ATOM 744 N7 A E 135 94.461 135.456 105.443 1.00 50.37 N ATOM 745 C5 A E 135 94.200 134.282 106.138 1.00 50.16 C ATOM 746 C6 A E 135 94.410 132.914 105.817 1.00 50.11 C ATOM 747 N6 A E 135 94.952 132.495 104.667 1.00 49.65 N ATOM 748 N1 A E 135 94.038 131.989 106.729 1.00 49.71 N ATOM 749 C2 A E 135 93.498 132.415 107.878 1.00 49.85 C ATOM 750 N3 A E 135 93.254 133.664 108.296 1.00 50.01 N ATOM 751 C4 A E 135 93.633 134.559 107.370 1.00 50.27 C TER 752 A E 135 HETATM 753 CO CNC E 601 75.181 128.200 98.489 1.00 51.30 CO HETATM 754 N21 CNC E 601 75.273 126.845 97.146 1.00 50.76 N HETATM 755 N22 CNC E 601 73.330 127.783 98.848 1.00 51.01 N HETATM 756 N23 CNC E 601 75.342 129.648 99.827 1.00 51.25 N HETATM 757 N24 CNC E 601 77.039 128.415 98.094 1.00 50.96 N HETATM 758 C1 CNC E 601 76.526 126.771 96.314 1.00 50.32 C HETATM 759 C20 CNC E 601 76.461 127.729 95.110 1.00 50.28 C HETATM 760 C2 CNC E 601 76.512 125.193 95.852 1.00 50.10 C HETATM 761 C25 CNC E 601 77.309 124.946 94.530 1.00 49.88 C HETATM 762 C26 CNC E 601 77.048 124.310 97.009 1.00 49.72 C HETATM 763 C27 CNC E 601 76.866 122.818 96.877 1.00 49.55 C HETATM 764 O28 CNC E 601 75.780 122.277 96.608 1.00 48.96 O HETATM 765 N29 CNC E 601 77.971 122.109 97.086 1.00 49.72 N HETATM 766 C3 CNC E 601 74.986 124.969 95.741 1.00 50.21 C HETATM 767 C30 CNC E 601 74.217 125.234 94.414 1.00 50.18 C HETATM 768 C31 CNC E 601 73.808 123.922 93.694 1.00 50.05 C HETATM 769 C32 CNC E 601 73.032 124.159 92.446 1.00 50.18 C HETATM 770 O34 CNC E 601 71.811 123.898 92.443 1.00 50.55 O HETATM 771 N33 CNC E 601 73.639 124.648 91.389 1.00 49.82 N HETATM 772 C4 CNC E 601 74.469 125.838 96.880 1.00 50.40 C HETATM 773 C5 CNC E 601 73.158 125.670 97.506 1.00 50.40 C HETATM 774 C35 CNC E 601 72.436 124.327 97.208 1.00 50.23 C HETATM 775 C6 CNC E 601 72.638 126.619 98.399 1.00 50.85 C HETATM 776 C7 CNC E 601 71.272 126.609 99.196 1.00 51.10 C HETATM 777 C36 CNC E 601 70.007 126.147 98.378 1.00 51.07 C HETATM 778 C37 CNC E 601 71.556 125.751 100.459 1.00 51.05 C HETATM 779 C38 CNC E 601 70.355 125.615 101.356 1.00 51.34 C HETATM 780 O39 CNC E 601 70.301 126.255 102.407 1.00 51.78 O HETATM 781 N40 CNC E 601 69.409 124.782 100.950 1.00 51.67 N HETATM 782 C8 CNC E 601 71.109 128.114 99.576 1.00 51.31 C HETATM 783 C41 CNC E 601 70.369 128.951 98.496 1.00 51.93 C HETATM 784 C42 CNC E 601 70.346 130.475 98.668 1.00 52.71 C HETATM 785 C43 CNC E 601 69.664 131.157 97.576 1.00 53.04 C HETATM 786 O44 CNC E 601 68.700 130.661 96.934 1.00 53.41 O HETATM 787 N45 CNC E 601 70.135 132.370 97.248 1.00 53.37 N HETATM 788 C9 CNC E 601 72.568 128.520 99.639 1.00 51.20 C HETATM 789 C10 CNC E 601 72.998 129.566 100.468 1.00 51.33 C HETATM 790 C11 CNC E 601 74.299 130.014 100.598 1.00 51.33 C HETATM 791 C12 CNC E 601 74.781 130.944 101.744 1.00 51.39 C HETATM 792 C46 CNC E 601 75.197 130.072 102.926 1.00 51.22 C HETATM 793 C47 CNC E 601 73.625 131.863 102.282 1.00 51.31 C HETATM 794 C13 CNC E 601 76.003 131.562 101.111 1.00 51.51 C HETATM 795 C48 CNC E 601 75.769 132.811 100.220 1.00 52.40 C HETATM 796 C49 CNC E 601 75.520 134.213 100.919 1.00 53.54 C HETATM 797 C50 CNC E 601 76.541 135.249 100.536 1.00 54.14 C HETATM 798 O51 CNC E 601 77.752 135.041 100.767 1.00 54.76 O HETATM 799 N52 CNC E 601 76.104 136.390 99.943 1.00 54.52 N HETATM 800 C14 CNC E 601 76.433 130.399 100.183 1.00 51.24 C HETATM 801 C15 CNC E 601 77.716 130.228 99.630 1.00 51.02 C HETATM 802 C53 CNC E 601 78.832 131.164 100.152 1.00 50.97 C HETATM 803 C16 CNC E 601 78.018 129.202 98.602 1.00 50.90 C HETATM 804 C17 CNC E 601 79.391 128.794 98.018 1.00 50.81 C HETATM 805 C54 CNC E 601 80.104 127.976 99.115 1.00 50.74 C HETATM 806 C55 CNC E 601 80.328 129.910 97.544 1.00 51.16 C HETATM 807 C56 CNC E 601 79.764 130.966 96.628 1.00 51.93 C HETATM 808 C57 CNC E 601 80.651 132.171 96.556 1.00 52.53 C HETATM 809 O58 CNC E 601 80.719 132.951 97.552 1.00 52.59 O HETATM 810 N59 CNC E 601 81.323 132.330 95.401 1.00 52.97 N HETATM 811 C18 CNC E 601 78.947 127.929 96.771 1.00 50.62 C HETATM 812 C60 CNC E 601 79.972 126.859 96.289 1.00 50.35 C HETATM 813 C61 CNC E 601 80.794 127.320 95.071 1.00 50.39 C HETATM 814 O63 CNC E 601 81.946 126.705 94.876 1.00 50.48 O HETATM 815 N62 CNC E 601 80.367 128.211 94.367 1.00 50.79 N HETATM 816 C19 CNC E 601 77.638 127.337 97.266 1.00 50.53 C HETATM 817 C1P CNC E 601 82.229 133.433 95.152 1.00 53.57 C HETATM 818 C2P CNC E 601 81.523 134.599 94.487 1.00 54.05 C HETATM 819 C3P CNC E 601 82.526 135.636 93.967 1.00 53.93 C HETATM 820 O3 CNC E 601 80.748 134.053 93.324 1.00 54.22 O HETATM 821 O4 CNC E 601 78.959 135.925 93.239 1.00 54.65 O HETATM 822 O5 CNC E 601 78.741 133.720 91.953 1.00 54.44 O HETATM 823 P CNC E 601 79.202 134.416 93.195 1.00 54.62 P HETATM 824 O2 CNC E 601 78.644 133.755 94.498 1.00 53.86 O HETATM 825 C3R CNC E 601 77.296 134.010 94.925 1.00 53.57 C HETATM 826 C2R CNC E 601 76.324 132.934 94.522 1.00 53.43 C HETATM 827 O7R CNC E 601 76.942 131.635 94.438 1.00 53.59 O HETATM 828 C1R CNC E 601 75.336 132.976 95.726 1.00 53.15 C HETATM 829 O6R CNC E 601 76.055 133.496 96.851 1.00 53.44 O HETATM 830 C4R CNC E 601 77.269 134.126 96.411 1.00 53.69 C HETATM 831 C5R CNC E 601 77.323 135.572 96.952 1.00 53.96 C HETATM 832 O8R CNC E 601 76.297 136.449 96.357 1.00 54.90 O HETATM 833 N1B CNC E 601 74.827 131.635 96.070 1.00 52.83 N HETATM 834 C8B CNC E 601 73.685 130.998 95.488 1.00 52.90 C HETATM 835 C2B CNC E 601 75.327 130.786 96.967 1.00 52.36 C HETATM 836 N3B CNC E 601 74.673 129.607 97.076 1.00 51.77 N HETATM 837 C9B CNC E 601 73.617 129.753 96.127 1.00 52.55 C HETATM 838 C4B CNC E 601 72.565 128.844 95.734 1.00 52.66 C HETATM 839 C5B CNC E 601 71.650 129.239 94.745 1.00 53.03 C HETATM 840 C5M CNC E 601 70.546 128.231 94.367 1.00 53.16 C HETATM 841 C6B CNC E 601 71.724 130.529 94.107 1.00 53.09 C HETATM 842 C6M CNC E 601 70.731 130.964 93.032 1.00 52.91 C HETATM 843 C7B CNC E 601 72.772 131.436 94.484 1.00 53.12 C HETATM 844 N1A CNC E 601 75.911 126.229 100.638 1.00 50.49 N HETATM 845 C1A CNC E 601 75.654 126.985 99.822 1.00 50.92 C HETATM 846 O HOH E1108 83.247 126.855 91.978 0.97 9.23 O HETATM 847 O HOH E1113 84.811 113.973 105.398 0.81 19.03 O HETATM 848 O HOH E1118 80.023 105.506 108.671 0.94 13.11 O HETATM 849 O HOH E1120 77.676 121.657 93.234 0.78 9.60 O HETATM 850 O HOH E1122 91.188 111.641 118.616 1.54 37.29 O HETATM 851 O HOH E1160 69.680 93.692 101.681 1.15 30.04 O HETATM 852 O HOH E1163 75.309 111.297 106.352 1.04 24.22 O HETATM 853 O HOH E1175 78.760 120.930 101.871 0.88 25.72 O HETATM 854 O HOH E1176 84.643 117.452 110.984 0.86 15.58 O HETATM 855 O HOH E1177 95.154 111.708 113.010 0.92 27.05 O HETATM 856 O HOH E1185 84.178 110.238 98.161 0.92 20.48 O HETATM 857 O HOH E1190 91.072 117.593 121.107 0.86 20.78 O HETATM 858 O HOH E1195 77.051 109.606 103.681 0.90 29.06 O HETATM 859 O HOH E1196 83.358 119.964 115.209 1.17 37.05 O HETATM 860 O HOH E1200 87.527 124.761 103.624 1.20 31.14 O HETATM 861 O HOH E1219 92.292 114.533 111.700 0.67 16.10 O HETATM 862 O HOH E1220 73.335 127.496 103.900 1.09 22.89 O HETATM 863 O HOH E1226 76.422 118.899 96.118 0.79 24.01 O HETATM 864 O HOH E1245 81.699 113.934 96.004 1.06 42.39 O HETATM 865 O HOH E1268 69.271 109.958 120.575 1.02 29.54 O HETATM 866 O HOH E1281 75.996 125.803 103.339 0.74 40.83 O HETATM 867 O HOH E1284 75.027 120.806 104.442 0.86 32.39 O HETATM 868 O HOH E1286 77.001 123.305 101.253 1.02 41.13 O HETATM 869 O HOH E1296 91.823 123.848 91.938 1.06 32.04 O HETATM 870 O HOH E1303 91.182 129.696 99.376 1.26 38.35 O HETATM 871 O HOH E1308 76.683 112.911 96.377 0.75 30.03 O HETATM 872 O HOH E1314 70.784 116.868 97.729 0.89 28.75 O HETATM 873 O HOH E1321 74.812 120.960 94.220 0.89 44.65 O HETATM 874 O HOH E1331 89.709 122.321 105.896 1.03 39.26 O HETATM 875 O HOH E1344 75.991 115.469 96.023 0.79 29.48 O HETATM 876 O HOH E1356 91.643 120.953 97.263 0.82 41.59 O HETATM 877 O HOH E1358 78.893 131.499 111.326 1.07 43.79 O HETATM 878 O HOH E1361 83.028 114.839 122.410 1.13 46.50 O HETATM 879 O HOH E1372 81.588 124.667 90.326 0.98 44.86 O HETATM 880 O HOH E1377 72.305 111.496 104.197 0.84 45.49 O HETATM 881 O HOH E1390 77.295 121.194 110.656 0.96 34.15 O HETATM 882 O HOH E1391 92.744 119.370 105.282 0.90 28.39 O HETATM 883 O HOH E1392 88.675 111.142 121.322 0.91 23.88 O HETATM 884 O HOH E1393 87.128 117.767 113.096 0.78 37.73 O HETATM 885 O HOH E1405 69.346 123.148 95.865 1.14 43.58 O HETATM 886 O HOH E1411 78.704 93.458 106.515 0.97 44.28 O HETATM 887 O HOH E1421 74.915 106.516 108.315 0.81 17.53 O HETATM 888 O HOH E1428 76.880 120.939 107.232 0.74 20.00 O HETATM 889 O HOH E1432 71.743 115.621 107.555 1.01 37.57 O HETATM 890 O HOH E1449 69.343 130.253 101.998 1.02 44.62 O HETATM 891 O HOH E1473 77.078 117.002 107.986 1.22 46.01 O HETATM 892 O HOH E1477 86.634 119.382 90.806 0.89 29.40 O HETATM 893 O HOH E1482 87.585 128.797 105.627 0.86 25.12 O HETATM 894 O HOH E1493 86.696 120.915 110.415 0.92 37.55 O HETATM 895 O HOH E1495 84.377 105.060 111.785 0.60 38.61 O HETATM 896 O HOH E1499 74.391 117.425 107.584 0.98 42.80 O HETATM 897 O HOH E1510 77.808 124.534 111.714 0.93 41.74 O HETATM 898 O HOH E1515 92.079 128.929 105.536 0.95 39.39 O HETATM 899 O HOH E1519 84.760 136.335 97.833 1.08 45.33 O HETATM 900 O HOH E1530 79.736 106.977 104.652 0.82 18.44 O HETATM 901 O HOH E1534 70.566 105.119 101.338 0.66 31.91 O HETATM 902 O HOH E1535 90.032 118.833 116.031 1.01 37.27 O HETATM 903 O HOH E1540 90.094 108.212 109.680 1.10 45.46 O HETATM 904 O HOH E1552 79.704 138.576 101.036 1.06 43.73 O HETATM 905 O HOH E1553 86.621 125.776 99.887 0.90 37.52 O HETATM 906 O HOH E1556 87.471 116.853 117.123 0.75 31.10 O HETATM 907 O HOH E1572 91.706 110.529 115.122 0.91 30.56 O HETATM 908 O HOH E1574 87.491 115.958 93.615 1.01 45.64 O HETATM 909 O HOH E1585 73.441 135.843 95.710 0.94 44.92 O HETATM 910 O HOH E1587 80.270 118.436 110.164 0.79 23.44 O HETATM 911 O HOH E1588 72.824 120.888 96.568 0.81 32.42 O HETATM 912 O HOH E1601 92.014 143.146 104.802 0.85 49.32 O HETATM 913 O HOH E1607 73.822 103.337 102.172 0.84 37.93 O HETATM 914 O HOH E1609 93.127 118.691 99.197 0.95 33.58 O HETATM 915 O HOH E1611 92.627 134.441 99.529 0.91 52.08 O HETATM 916 O HOH E1613 86.360 138.601 105.417 0.95 43.93 O HETATM 917 O HOH E1614 72.574 111.810 121.810 1.01 42.14 O HETATM 918 O HOH E1615 91.957 112.467 120.797 1.10 43.67 O HETATM 919 O HOH E1617 68.689 99.035 97.419 1.11 42.99 O HETATM 920 O HOH E1618 84.495 107.232 117.923 0.76 32.23 O HETATM 921 O HOH E1625 95.562 133.668 102.394 1.00 49.35 O HETATM 922 O HOH E1631 72.442 115.036 120.420 0.90 40.23 O HETATM 923 O HOH E1639 73.563 105.643 105.818 0.78 47.49 O HETATM 924 O HOH E1655 81.968 112.693 98.289 0.61 51.51 O HETATM 925 O HOH E1665 91.221 122.183 94.023 0.84 49.08 O HETATM 926 O HOH E1682 78.208 111.093 95.910 1.00 44.60 O HETATM 927 O HOH E1685 76.449 118.642 105.888 0.81 36.58 O HETATM 928 O HOH E1686 72.159 104.031 104.510 0.98 42.27 O HETATM 929 O HOH E1691 80.409 108.822 97.055 0.89 42.58 O HETATM 930 O HOH E1695 85.597 126.668 103.999 0.85 48.32 O HETATM 931 O HOH E1712 83.542 119.537 90.615 0.96 48.94 O HETATM 932 O HOH E1718 72.638 126.417 105.864 0.92 47.85 O HETATM 933 O HOH E1719 92.511 115.171 122.151 0.84 47.62 O HETATM 934 O HOH E1720 88.929 123.366 98.039 0.86 38.94 O HETATM 935 O HOH E1723 68.171 112.705 103.016 0.97 44.62 O HETATM 936 O HOH E1731 86.534 122.980 99.084 0.77 40.64 O HETATM 937 O HOH E1735 72.097 106.871 107.448 0.91 40.02 O HETATM 938 O HOH E1740 68.658 96.154 102.696 0.99 45.80 O HETATM 939 O HOH E1744 68.182 114.723 106.812 0.99 37.62 O HETATM 940 O HOH E1745 84.141 114.576 109.745 0.61 48.93 O HETATM 941 O HOH E1754 81.072 130.510 92.994 1.02 47.42 O HETATM 942 O HOH E1759 71.502 122.319 94.762 0.52 54.70 O HETATM 943 O HOH E1762 67.257 92.204 101.651 0.98 38.72 O HETATM 944 O HOH E1773 74.698 114.031 106.129 0.86 43.16 O HETATM 945 O HOH E1778 77.846 138.320 98.686 0.71 48.63 O HETATM 946 O HOH E1782 97.803 139.152 109.524 1.11 44.35 O HETATM 947 O HOH E1784 87.074 106.922 102.549 1.13 45.32 O HETATM 948 O HOH E1785 88.435 121.808 108.546 0.99 43.15 O HETATM 949 O HOH E1793 90.144 110.066 113.156 0.92 46.17 O HETATM 950 O HOH E1797 73.983 116.187 110.900 0.99 37.59 O HETATM 951 O HOH E1811 82.730 118.898 118.750 0.99 45.52 O HETATM 952 O HOH E1812 74.172 89.616 98.520 0.90 39.58 O HETATM 953 O HOH E1816 77.555 134.652 108.509 0.92 48.98 O ENDMDL MASTER 0 0 0 0 0 0 26 6 952 1 0 15 END