USER MOD reduce.3.24.130724 H: found=0, std=0, add=242, rem=0, adj=2 USER MOD reduce.3.24.130724 removed 244 hydrogens (244 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 12 GF2 O3' : rot 25:sc= -0.128 USER MOD Single : B 24 GF2 O3' : rot 29:sc= -0.0432 USER MOD ----------------------------------------------------------------- HETATM 1 N1 CFZ A 1 0.553 -17.225 -2.846 1.00 0.00 N HETATM 2 C2 CFZ A 1 -0.308 -17.653 -1.813 1.00 0.00 C HETATM 3 O2 CFZ A 1 -1.042 -18.635 -1.972 1.00 0.00 O HETATM 4 N3 CFZ A 1 -0.297 -16.958 -0.619 1.00 0.00 N HETATM 5 C4 CFZ A 1 0.548 -15.928 -0.445 1.00 0.00 C HETATM 6 N4 CFZ A 1 0.598 -15.308 0.718 1.00 0.00 N HETATM 7 C5 CFZ A 1 1.435 -15.512 -1.481 1.00 0.00 C HETATM 8 C6 CFZ A 1 1.395 -16.165 -2.660 1.00 0.00 C HETATM 9 C1' CFZ A 1 0.567 -17.918 -4.160 1.00 0.00 C HETATM 10 C2' CFZ A 1 -0.398 -17.297 -5.170 1.00 0.00 C HETATM 11 F2' CFZ A 1 -1.445 -18.194 -5.093 1.00 0.00 F HETATM 12 C3' CFZ A 1 0.469 -17.177 -6.433 1.00 0.00 C HETATM 13 O3' CFZ A 1 -0.212 -17.322 -7.671 1.00 0.00 O HETATM 14 C4' CFZ A 1 1.553 -18.210 -6.159 1.00 0.00 C HETATM 15 O4' CFZ A 1 1.840 -17.949 -4.786 1.00 0.00 O HETATM 16 C5' CFZ A 1 2.800 -18.064 -7.039 1.00 0.00 C HETATM 17 O5' CFZ A 1 3.489 -16.863 -6.749 1.00 0.00 O HETATM 0 HN4A CFZ A 1 1.239 -14.526 0.852 1.00 0.00 H new HETATM 0 H5'A CFZ A 1 3.463 -18.915 -6.880 1.00 0.00 H new HETATM 0 HN4 CFZ A 1 -0.004 -15.611 1.484 1.00 0.00 H new HETATM 0 H6 CFZ A 1 2.043 -15.843 -3.475 1.00 0.00 H new HETATM 0 H5' CFZ A 1 2.511 -18.077 -8.090 1.00 0.00 H new HETATM 0 H5 CFZ A 1 2.129 -14.686 -1.324 1.00 0.00 H new HETATM 0 H4' CFZ A 1 1.231 -19.228 -6.381 1.00 0.00 H new HETATM 0 H3' CFZ A 1 0.858 -16.170 -6.586 1.00 0.00 H new HETATM 0 H2' CFZ A 1 -0.841 -16.307 -5.063 1.00 0.00 H new HETATM 0 H1' CFZ A 1 0.261 -18.932 -3.901 1.00 0.00 H new HETATM 29 F GF2 A 2 -7.012 -15.396 -4.954 1.00 0.00 F HETATM 30 P GF2 A 2 -1.127 -16.134 -8.251 1.00 0.00 P HETATM 31 N1 GF2 A 2 -5.438 -14.929 0.621 1.00 0.00 N HETATM 32 C2 GF2 A 2 -6.324 -15.520 -0.229 1.00 0.00 C HETATM 33 N2 GF2 A 2 -7.511 -15.815 0.238 1.00 0.00 N HETATM 34 N3 GF2 A 2 -6.069 -15.803 -1.505 1.00 0.00 N HETATM 35 C4 GF2 A 2 -4.813 -15.431 -1.882 1.00 0.00 C HETATM 36 C5 GF2 A 2 -3.840 -14.843 -1.102 1.00 0.00 C HETATM 37 C6 GF2 A 2 -4.151 -14.561 0.274 1.00 0.00 C HETATM 38 O6 GF2 A 2 -3.450 -14.067 1.154 1.00 0.00 O HETATM 39 N7 GF2 A 2 -2.682 -14.642 -1.862 1.00 0.00 N HETATM 40 C8 GF2 A 2 -3.005 -15.074 -3.050 1.00 0.00 C HETATM 41 N9 GF2 A 2 -4.280 -15.575 -3.136 1.00 0.00 N HETATM 42 C1' GF2 A 2 -4.988 -16.144 -4.302 1.00 0.00 C HETATM 43 OP2 GF2 A 2 -0.499 -14.816 -8.061 1.00 0.00 O HETATM 44 C2' GF2 A 2 -5.684 -15.080 -5.138 1.00 0.00 C HETATM 45 OP1 GF2 A 2 -1.634 -16.419 -9.608 1.00 0.00 O HETATM 46 C3' GF2 A 2 -5.069 -15.237 -6.526 1.00 0.00 C HETATM 47 O3' GF2 A 2 -5.937 -14.898 -7.603 1.00 0.00 O HETATM 48 C4' GF2 A 2 -4.578 -16.681 -6.463 1.00 0.00 C HETATM 49 O4' GF2 A 2 -4.052 -16.778 -5.147 1.00 0.00 O HETATM 50 C5' GF2 A 2 -3.489 -16.998 -7.485 1.00 0.00 C HETATM 51 O5' GF2 A 2 -2.420 -16.082 -7.329 1.00 0.00 O HETATM 0 HN2A GF2 A 2 -8.202 -16.258 -0.368 1.00 0.00 H new HETATM 0 H5'A GF2 A 2 -3.132 -18.019 -7.348 1.00 0.00 H new HETATM 0 HN2 GF2 A 2 -7.745 -15.602 1.208 1.00 0.00 H new HETATM 0 HN1 GF2 A 2 -5.744 -14.746 1.577 1.00 0.00 H new HETATM 0 H8 GF2 A 2 -2.323 -15.040 -3.899 1.00 0.00 H new HETATM 0 H5' GF2 A 2 -3.893 -16.935 -8.495 1.00 0.00 H new HETATM 0 H4' GF2 A 2 -5.379 -17.385 -6.690 1.00 0.00 H new HETATM 0 H3' GF2 A 2 -4.267 -14.534 -6.752 1.00 0.00 H new HETATM 0 H2' GF2 A 2 -5.577 -14.020 -4.905 1.00 0.00 H new HETATM 0 H1' GF2 A 2 -5.734 -16.836 -3.911 1.00 0.00 H new HETATM 62 P CFZ A 3 -6.275 -13.363 -7.969 1.00 0.00 P HETATM 63 N1 CFZ A 3 -6.967 -12.082 -2.289 1.00 0.00 N HETATM 64 C2 CFZ A 3 -6.931 -11.877 -0.911 1.00 0.00 C HETATM 65 O2 CFZ A 3 -7.959 -11.922 -0.242 1.00 0.00 O HETATM 66 N3 CFZ A 3 -5.760 -11.581 -0.298 1.00 0.00 N HETATM 67 C4 CFZ A 3 -4.653 -11.493 -1.016 1.00 0.00 C HETATM 68 N4 CFZ A 3 -3.551 -11.220 -0.363 1.00 0.00 N HETATM 69 C5 CFZ A 3 -4.635 -11.708 -2.432 1.00 0.00 C HETATM 70 C6 CFZ A 3 -5.820 -11.989 -3.032 1.00 0.00 C HETATM 71 C1' CFZ A 3 -8.286 -12.212 -2.960 1.00 0.00 C HETATM 72 O1P CFZ A 3 -7.181 -13.282 -9.124 1.00 0.00 O HETATM 73 C2' CFZ A 3 -8.792 -10.865 -3.409 1.00 0.00 C HETATM 74 F2' CFZ A 3 -10.026 -10.740 -2.815 1.00 0.00 F HETATM 75 O2P CFZ A 3 -5.032 -12.564 -8.025 1.00 0.00 O HETATM 76 C3' CFZ A 3 -8.722 -10.927 -4.940 1.00 0.00 C HETATM 77 O3' CFZ A 3 -9.630 -10.042 -5.596 1.00 0.00 O HETATM 78 C4' CFZ A 3 -8.911 -12.426 -5.155 1.00 0.00 C HETATM 79 O4' CFZ A 3 -8.131 -13.003 -4.122 1.00 0.00 O HETATM 80 C5' CFZ A 3 -8.457 -12.975 -6.516 1.00 0.00 C HETATM 81 O5' CFZ A 3 -7.078 -12.709 -6.738 1.00 0.00 O HETATM 0 HN4A CFZ A 3 -2.667 -11.140 -0.865 1.00 0.00 H new HETATM 0 H5'A CFZ A 3 -8.635 -14.050 -6.556 1.00 0.00 H new HETATM 0 HN4 CFZ A 3 -3.577 -11.087 0.648 1.00 0.00 H new HETATM 0 H6 CFZ A 3 -5.859 -12.141 -4.111 1.00 0.00 H new HETATM 0 H5' CFZ A 3 -9.051 -12.523 -7.311 1.00 0.00 H new HETATM 0 H5 CFZ A 3 -3.709 -11.649 -3.004 1.00 0.00 H new HETATM 0 H4' CFZ A 3 -9.974 -12.665 -5.137 1.00 0.00 H new HETATM 0 H3' CFZ A 3 -7.802 -10.559 -5.394 1.00 0.00 H new HETATM 0 H2' CFZ A 3 -8.243 -9.968 -3.123 1.00 0.00 H new HETATM 0 H1' CFZ A 3 -8.986 -12.658 -2.254 1.00 0.00 H new HETATM 92 F GF2 A 4 -10.686 -6.015 0.686 1.00 0.00 F HETATM 93 P GF2 A 4 -9.324 -8.459 -5.679 1.00 0.00 P HETATM 94 N1 GF2 A 4 -5.716 -7.049 3.158 1.00 0.00 N HETATM 95 C2 GF2 A 4 -7.066 -6.996 3.330 1.00 0.00 C HETATM 96 N2 GF2 A 4 -7.518 -6.668 4.516 1.00 0.00 N HETATM 97 N3 GF2 A 4 -7.959 -7.235 2.372 1.00 0.00 N HETATM 98 C4 GF2 A 4 -7.382 -7.589 1.188 1.00 0.00 C HETATM 99 C5 GF2 A 4 -6.035 -7.668 0.902 1.00 0.00 C HETATM 100 C6 GF2 A 4 -5.101 -7.348 1.954 1.00 0.00 C HETATM 101 O6 GF2 A 4 -3.872 -7.297 1.935 1.00 0.00 O HETATM 102 N7 GF2 A 4 -5.855 -8.057 -0.433 1.00 0.00 N HETATM 103 C8 GF2 A 4 -7.071 -8.208 -0.882 1.00 0.00 C HETATM 104 N9 GF2 A 4 -8.049 -7.896 0.027 1.00 0.00 N HETATM 105 C1' GF2 A 4 -9.499 -7.717 -0.217 1.00 0.00 C HETATM 106 OP2 GF2 A 4 -7.888 -8.322 -6.003 1.00 0.00 O HETATM 107 C2' GF2 A 4 -9.822 -6.238 -0.360 1.00 0.00 C HETATM 108 OP1 GF2 A 4 -10.322 -7.787 -6.542 1.00 0.00 O HETATM 109 C3' GF2 A 4 -10.315 -6.092 -1.799 1.00 0.00 C HETATM 110 O3' GF2 A 4 -11.156 -4.958 -2.020 1.00 0.00 O HETATM 111 C4' GF2 A 4 -10.817 -7.503 -2.095 1.00 0.00 C HETATM 112 O4' GF2 A 4 -9.818 -8.297 -1.468 1.00 0.00 O HETATM 113 C5' GF2 A 4 -10.875 -7.862 -3.589 1.00 0.00 C HETATM 114 O5' GF2 A 4 -9.581 -7.836 -4.205 1.00 0.00 O HETATM 0 HN2A GF2 A 4 -8.523 -6.618 4.683 1.00 0.00 H new HETATM 0 H5'A GF2 A 4 -11.311 -8.854 -3.705 1.00 0.00 H new HETATM 0 HN2 GF2 A 4 -6.865 -6.463 5.272 1.00 0.00 H new HETATM 0 HN1 GF2 A 4 -5.122 -6.857 3.965 1.00 0.00 H new HETATM 0 H8 GF2 A 4 -7.290 -8.552 -1.893 1.00 0.00 H new HETATM 0 H5' GF2 A 4 -11.534 -7.162 -4.103 1.00 0.00 H new HETATM 0 H4' GF2 A 4 -11.841 -7.639 -1.748 1.00 0.00 H new HETATM 0 H3' GF2 A 4 -9.570 -5.808 -2.542 1.00 0.00 H new HETATM 0 H2' GF2 A 4 -9.042 -5.483 -0.268 1.00 0.00 H new HETATM 0 H1' GF2 A 4 -10.049 -8.166 0.610 1.00 0.00 H new HETATM 125 F AF2 A 5 -9.215 -1.679 4.437 1.00 0.00 F HETATM 126 P AF2 A 5 -10.520 -3.460 -2.041 1.00 0.00 P HETATM 127 N1 AF2 A 5 -3.644 -3.604 3.997 1.00 0.00 N HETATM 128 C2 AF2 A 5 -4.680 -3.266 4.761 1.00 0.00 C HETATM 129 N3 AF2 A 5 -5.961 -3.205 4.402 1.00 0.00 N HETATM 130 C4 AF2 A 5 -6.143 -3.546 3.095 1.00 0.00 C HETATM 131 C5 AF2 A 5 -5.178 -3.910 2.191 1.00 0.00 C HETATM 132 C6 AF2 A 5 -3.868 -3.944 2.722 1.00 0.00 C HETATM 133 N6 AF2 A 5 -2.796 -4.313 2.034 1.00 0.00 N HETATM 134 N7 AF2 A 5 -5.737 -4.161 0.927 1.00 0.00 N HETATM 135 C8 AF2 A 5 -7.007 -3.938 1.126 1.00 0.00 C HETATM 136 N9 AF2 A 5 -7.336 -3.584 2.410 1.00 0.00 N HETATM 137 C1' AF2 A 5 -8.683 -3.280 2.951 1.00 0.00 C HETATM 138 OP2 AF2 A 5 -9.180 -3.589 -2.681 1.00 0.00 O HETATM 139 C2' AF2 A 5 -8.894 -1.785 3.100 1.00 0.00 C HETATM 140 OP1 AF2 A 5 -11.492 -2.486 -2.569 1.00 0.00 O HETATM 141 C3' AF2 A 5 -9.940 -1.444 2.045 1.00 0.00 C HETATM 142 O3' AF2 A 5 -10.696 -0.251 2.294 1.00 0.00 O HETATM 143 C4' AF2 A 5 -10.677 -2.769 1.864 1.00 0.00 C HETATM 144 O4' AF2 A 5 -9.628 -3.722 1.990 1.00 0.00 O HETATM 145 C5' AF2 A 5 -11.304 -2.947 0.467 1.00 0.00 C HETATM 146 O5' AF2 A 5 -10.265 -2.988 -0.519 1.00 0.00 O HETATM 0 HN6A AF2 A 5 -2.887 -4.586 1.056 1.00 0.00 H new HETATM 0 H5'A AF2 A 5 -11.889 -3.866 0.433 1.00 0.00 H new HETATM 0 HN6 AF2 A 5 -1.880 -4.323 2.483 1.00 0.00 H new HETATM 0 H8 AF2 A 5 -7.750 -4.026 0.333 1.00 0.00 H new HETATM 0 H5' AF2 A 5 -11.989 -2.125 0.256 1.00 0.00 H new HETATM 0 H4' AF2 A 5 -11.501 -2.853 2.573 1.00 0.00 H new HETATM 0 H3' AF2 A 5 -9.527 -1.113 1.092 1.00 0.00 H new HETATM 0 H2' AF2 A 5 -8.087 -1.076 2.915 1.00 0.00 H new HETATM 0 H2 AF2 A 5 -4.455 -3.011 5.796 1.00 0.00 H new HETATM 0 H1' AF2 A 5 -8.789 -3.762 3.923 1.00 0.00 H new HETATM 157 F AF2 A 6 -5.288 1.639 7.108 1.00 0.00 F HETATM 158 P AF2 A 6 -10.017 1.197 2.029 1.00 0.00 P HETATM 159 N1 AF2 A 6 -0.863 -0.684 4.182 1.00 0.00 N HETATM 160 C2 AF2 A 6 -1.431 -0.300 5.321 1.00 0.00 C HETATM 161 N3 AF2 A 6 -2.716 -0.030 5.539 1.00 0.00 N HETATM 162 C4 AF2 A 6 -3.470 -0.190 4.418 1.00 0.00 C HETATM 163 C5 AF2 A 6 -3.027 -0.557 3.174 1.00 0.00 C HETATM 164 C6 AF2 A 6 -1.644 -0.832 3.106 1.00 0.00 C HETATM 165 N6 AF2 A 6 -1.025 -1.244 2.011 1.00 0.00 N HETATM 166 N7 AF2 A 6 -4.075 -0.556 2.243 1.00 0.00 N HETATM 167 C8 AF2 A 6 -5.101 -0.201 2.966 1.00 0.00 C HETATM 168 N9 AF2 A 6 -4.832 -0.021 4.298 1.00 0.00 N HETATM 169 C1' AF2 A 6 -5.796 0.317 5.375 1.00 0.00 C HETATM 170 OP2 AF2 A 6 -9.453 1.085 0.662 1.00 0.00 O HETATM 171 C2' AF2 A 6 -5.648 1.765 5.786 1.00 0.00 C HETATM 172 OP1 AF2 A 6 -10.918 2.323 2.343 1.00 0.00 O HETATM 173 C3' AF2 A 6 -6.971 2.429 5.396 1.00 0.00 C HETATM 174 O3' AF2 A 6 -7.346 3.569 6.176 1.00 0.00 O HETATM 175 C4' AF2 A 6 -7.910 1.229 5.403 1.00 0.00 C HETATM 176 O4' AF2 A 6 -7.100 0.206 4.844 1.00 0.00 O HETATM 177 C5' AF2 A 6 -9.160 1.387 4.528 1.00 0.00 C HETATM 178 O5' AF2 A 6 -8.847 1.376 3.125 1.00 0.00 O HETATM 0 HN6A AF2 A 6 -1.552 -1.381 1.148 1.00 0.00 H new HETATM 0 H5'A AF2 A 6 -9.860 0.581 4.749 1.00 0.00 H new HETATM 0 HN6 AF2 A 6 -0.021 -1.424 2.030 1.00 0.00 H new HETATM 0 H8 AF2 A 6 -6.096 -0.058 2.544 1.00 0.00 H new HETATM 0 H5' AF2 A 6 -9.661 2.322 4.779 1.00 0.00 H new HETATM 0 H4' AF2 A 6 -8.296 1.053 6.407 1.00 0.00 H new HETATM 0 H3' AF2 A 6 -6.954 2.938 4.432 1.00 0.00 H new HETATM 0 H2' AF2 A 6 -4.906 2.417 5.326 1.00 0.00 H new HETATM 0 H2 AF2 A 6 -0.766 -0.194 6.178 1.00 0.00 H new HETATM 0 H1' AF2 A 6 -5.617 -0.347 6.221 1.00 0.00 H new HETATM 189 P TAF A 7 -6.621 4.999 5.951 1.00 0.00 P HETATM 190 OP1 TAF A 7 -7.208 6.023 6.853 1.00 0.00 O HETATM 191 OP2 TAF A 7 -6.602 5.226 4.490 1.00 0.00 O HETATM 192 O5' TAF A 7 -5.124 4.774 6.495 1.00 0.00 O HETATM 193 N1 TAF A 7 -1.367 3.295 5.572 1.00 0.00 N HETATM 194 C6 TAF A 7 -2.368 3.296 4.622 1.00 0.00 C HETATM 195 C2 TAF A 7 -0.063 2.918 5.243 1.00 0.00 C HETATM 196 O2 TAF A 7 0.876 2.965 6.032 1.00 0.00 O HETATM 197 N3 TAF A 7 0.152 2.520 3.946 1.00 0.00 N HETATM 198 C4 TAF A 7 -0.784 2.511 2.934 1.00 0.00 C HETATM 199 O4 TAF A 7 -0.435 2.165 1.810 1.00 0.00 O HETATM 200 C5 TAF A 7 -2.120 2.940 3.336 1.00 0.00 C HETATM 201 C5M TAF A 7 -3.243 3.017 2.318 1.00 0.00 C HETATM 202 F2' TAF A 7 -2.264 5.906 5.757 1.00 0.00 F HETATM 203 C2' TAF A 7 -1.709 5.383 6.916 1.00 0.00 C HETATM 204 C5' TAF A 7 -4.895 4.534 7.884 1.00 0.00 C HETATM 205 C4' TAF A 7 -3.418 4.366 8.264 1.00 0.00 C HETATM 206 O4' TAF A 7 -2.810 3.353 7.478 1.00 0.00 O HETATM 207 C1' TAF A 7 -1.605 3.854 6.929 1.00 0.00 C HETATM 208 C3' TAF A 7 -2.645 5.677 8.074 1.00 0.00 C HETATM 209 O3' TAF A 7 -1.995 6.165 9.257 1.00 0.00 O HETATM 0 H5'' TAF A 7 -5.313 5.362 8.457 1.00 0.00 H new HETATM 0 H73 TAF A 7 -4.060 2.365 2.627 1.00 0.00 H new HETATM 0 H72 TAF A 7 -3.603 4.043 2.251 1.00 0.00 H new HETATM 0 H71 TAF A 7 -2.873 2.698 1.344 1.00 0.00 H new HETATM 0 H6 TAF A 7 -3.378 3.588 4.910 1.00 0.00 H new HETATM 0 H5' TAF A 7 -5.438 3.636 8.179 1.00 0.00 H new HETATM 0 H4' TAF A 7 -3.384 4.081 9.316 1.00 0.00 H new HETATM 0 H3' TAF A 7 -3.311 6.512 7.856 1.00 0.00 H new HETATM 0 H3 TAF A 7 1.092 2.201 3.710 1.00 0.00 H new HETATM 0 H2' TAF A 7 -0.717 5.829 6.983 1.00 0.00 H new HETATM 0 H1' TAF A 7 -0.748 3.552 7.531 1.00 0.00 H new HETATM 221 P UFT A 8 -1.378 7.668 9.326 1.00 0.00 P HETATM 222 OP1 UFT A 8 -1.188 8.100 10.720 1.00 0.00 O HETATM 223 OP2 UFT A 8 -2.164 8.506 8.385 1.00 0.00 O HETATM 224 O5' UFT A 8 0.089 7.539 8.693 1.00 0.00 O HETATM 225 N1 UFT A 8 2.219 5.718 4.739 1.00 0.00 N HETATM 226 C6 UFT A 8 0.932 6.026 4.346 1.00 0.00 C HETATM 227 C2 UFT A 8 3.144 5.230 3.816 1.00 0.00 C HETATM 228 O2 UFT A 8 4.306 4.966 4.097 1.00 0.00 O HETATM 229 N3 UFT A 8 2.702 5.070 2.527 1.00 0.00 N HETATM 230 C4 UFT A 8 1.450 5.364 2.048 1.00 0.00 C HETATM 231 O4 UFT A 8 1.217 5.236 0.851 1.00 0.00 O HETATM 232 C5 UFT A 8 0.533 5.856 3.058 1.00 0.00 C HETATM 233 F2' UFT A 8 4.567 7.198 5.990 1.00 0.00 F HETATM 234 C2' UFT A 8 3.236 7.395 6.268 1.00 0.00 C HETATM 235 C5' UFT A 8 1.075 6.685 9.263 1.00 0.00 C HETATM 236 C4' UFT A 8 2.199 6.436 8.248 1.00 0.00 C HETATM 237 O4' UFT A 8 1.692 5.814 7.082 1.00 0.00 O HETATM 238 C1' UFT A 8 2.709 5.974 6.117 1.00 0.00 C HETATM 239 C3' UFT A 8 2.806 7.724 7.698 1.00 0.00 C HETATM 240 O3' UFT A 8 3.779 8.328 8.534 1.00 0.00 O HETATM 0 H5'A UFT A 8 1.483 7.138 10.167 1.00 0.00 H new HETATM 0 HN3 UFT A 8 3.372 4.694 1.856 1.00 0.00 H new HETATM 0 H6 UFT A 8 0.225 6.412 5.080 1.00 0.00 H new HETATM 0 H5' UFT A 8 0.622 5.738 9.557 1.00 0.00 H new HETATM 0 H5 UFT A 8 -0.494 6.093 2.779 1.00 0.00 H new HETATM 0 H4' UFT A 8 2.928 5.840 8.798 1.00 0.00 H new HETATM 0 H3' UFT A 8 2.077 8.534 7.679 1.00 0.00 H new HETATM 0 H2' UFT A 8 2.904 8.231 5.653 1.00 0.00 H new HETATM 0 H1' UFT A 8 3.503 5.245 6.280 1.00 0.00 H new HETATM 250 P CFL A 9 4.241 9.854 8.340 1.00 0.00 P HETATM 251 O1P CFL A 9 5.024 10.193 9.537 1.00 0.00 O HETATM 252 O2P CFL A 9 2.964 10.571 8.104 1.00 0.00 O HETATM 253 O5' CFL A 9 5.206 9.883 7.037 1.00 0.00 O HETATM 254 C5' CFL A 9 6.517 9.310 7.111 1.00 0.00 C HETATM 255 C4' CFL A 9 7.401 9.371 5.846 1.00 0.00 C HETATM 256 O4' CFL A 9 6.925 8.544 4.789 1.00 0.00 O HETATM 257 C3' CFL A 9 7.674 10.767 5.270 1.00 0.00 C HETATM 258 O3' CFL A 9 9.094 10.999 5.203 1.00 0.00 O HETATM 259 C2' CFL A 9 6.961 10.737 3.918 1.00 0.00 C HETATM 260 C1' CFL A 9 7.018 9.251 3.558 1.00 0.00 C HETATM 261 N1 CFL A 9 5.946 8.759 2.633 1.00 0.00 N HETATM 262 C2 CFL A 9 6.272 8.299 1.347 1.00 0.00 C HETATM 263 O2 CFL A 9 7.434 8.245 0.948 1.00 0.00 O HETATM 264 N3 CFL A 9 5.293 7.906 0.489 1.00 0.00 N HETATM 265 C4 CFL A 9 4.032 7.941 0.892 1.00 0.00 C HETATM 266 N4 CFL A 9 3.128 7.555 0.019 1.00 0.00 N HETATM 267 C5 CFL A 9 3.648 8.337 2.211 1.00 0.00 C HETATM 268 C6 CFL A 9 4.639 8.736 3.050 1.00 0.00 C HETATM 269 F CFL A 9 5.650 11.122 4.048 1.00 0.00 F HETATM 0 HN42 CFL A 9 2.140 7.560 0.272 1.00 0.00 H new HETATM 0 HN41 CFL A 9 3.415 7.250 -0.911 1.00 0.00 H new HETATM 0 H5'2 CFL A 9 7.054 9.806 7.919 1.00 0.00 H new HETATM 0 H5'1 CFL A 9 6.410 8.263 7.395 1.00 0.00 H new HETATM 0 H6 CFL A 9 4.393 9.042 4.067 1.00 0.00 H new HETATM 0 H5 CFL A 9 2.606 8.320 2.529 1.00 0.00 H new HETATM 0 H4' CFL A 9 8.348 8.995 6.234 1.00 0.00 H new HETATM 0 H3' CFL A 9 7.305 11.598 5.871 1.00 0.00 H new HETATM 0 H2' CFL A 9 7.409 11.403 3.180 1.00 0.00 H new HETATM 0 H1' CFL A 9 7.945 9.085 3.010 1.00 0.00 H new HETATM 280 F GF2 A 10 9.027 12.973 -1.946 1.00 0.00 F HETATM 281 P GF2 A 10 9.751 12.447 4.856 1.00 0.00 P HETATM 282 N1 GF2 A 10 5.328 10.104 -4.348 1.00 0.00 N HETATM 283 C2 GF2 A 10 6.675 10.271 -4.248 1.00 0.00 C HETATM 284 N2 GF2 A 10 7.403 10.168 -5.331 1.00 0.00 N HETATM 285 N3 GF2 A 10 7.310 10.585 -3.130 1.00 0.00 N HETATM 286 C4 GF2 A 10 6.466 10.783 -2.079 1.00 0.00 C HETATM 287 C5 GF2 A 10 5.095 10.661 -2.066 1.00 0.00 C HETATM 288 C6 GF2 A 10 4.446 10.260 -3.292 1.00 0.00 C HETATM 289 O6 GF2 A 10 3.254 10.067 -3.536 1.00 0.00 O HETATM 290 N7 GF2 A 10 4.608 11.005 -0.797 1.00 0.00 N HETATM 291 C8 GF2 A 10 5.682 11.309 -0.112 1.00 0.00 C HETATM 292 N9 GF2 A 10 6.847 11.194 -0.830 1.00 0.00 N HETATM 293 C1' GF2 A 10 8.251 11.483 -0.464 1.00 0.00 C HETATM 294 OP2 GF2 A 10 8.883 13.505 5.410 1.00 0.00 O HETATM 295 C2' GF2 A 10 8.655 12.943 -0.621 1.00 0.00 C HETATM 296 OP1 GF2 A 10 11.197 12.433 5.165 1.00 0.00 O HETATM 297 C3' GF2 A 10 9.754 13.058 0.434 1.00 0.00 C HETATM 298 O3' GF2 A 10 10.955 13.686 0.005 1.00 0.00 O HETATM 299 C4' GF2 A 10 9.903 11.645 0.994 1.00 0.00 C HETATM 300 O4' GF2 A 10 8.593 11.112 0.853 1.00 0.00 O HETATM 301 C5' GF2 A 10 10.398 11.625 2.443 1.00 0.00 C HETATM 302 O5' GF2 A 10 9.622 12.484 3.260 1.00 0.00 O HETATM 0 HN2A GF2 A 10 8.414 10.289 -5.279 1.00 0.00 H new HETATM 0 H5'A GF2 A 10 10.351 10.608 2.832 1.00 0.00 H new HETATM 0 HN2 GF2 A 10 6.959 9.966 -6.227 1.00 0.00 H new HETATM 0 HN1 GF2 A 10 4.944 9.848 -5.258 1.00 0.00 H new HETATM 0 H8 GF2 A 10 5.654 11.624 0.931 1.00 0.00 H new HETATM 0 H5' GF2 A 10 11.443 11.932 2.478 1.00 0.00 H new HETATM 0 H4' GF2 A 10 10.660 11.061 0.471 1.00 0.00 H new HETATM 0 H3' GF2 A 10 9.474 13.760 1.220 1.00 0.00 H new HETATM 0 H2' GF2 A 10 7.961 13.768 -0.459 1.00 0.00 H new HETATM 0 H1' GF2 A 10 8.794 10.868 -1.182 1.00 0.00 H new HETATM 313 P CFL A 11 11.074 15.279 -0.153 1.00 0.00 P HETATM 314 O1P CFL A 11 12.513 15.575 -0.068 1.00 0.00 O HETATM 315 O2P CFL A 11 10.233 15.839 0.929 1.00 0.00 O HETATM 316 O5' CFL A 11 10.483 15.671 -1.604 1.00 0.00 O HETATM 317 C5' CFL A 11 11.181 15.356 -2.808 1.00 0.00 C HETATM 318 C4' CFL A 11 10.448 15.726 -4.116 1.00 0.00 C HETATM 319 O4' CFL A 11 9.353 14.860 -4.378 1.00 0.00 O HETATM 320 C3' CFL A 11 9.905 17.158 -4.238 1.00 0.00 C HETATM 321 O3' CFL A 11 10.223 17.667 -5.551 1.00 0.00 O HETATM 322 C2' CFL A 11 8.409 17.005 -4.007 1.00 0.00 C HETATM 323 C1' CFL A 11 8.232 15.665 -4.725 1.00 0.00 C HETATM 324 N1 CFL A 11 6.976 14.940 -4.411 1.00 0.00 N HETATM 325 C2 CFL A 11 6.114 14.589 -5.453 1.00 0.00 C HETATM 326 O2 CFL A 11 6.399 14.812 -6.627 1.00 0.00 O HETATM 327 N3 CFL A 11 4.929 13.986 -5.187 1.00 0.00 N HETATM 328 C4 CFL A 11 4.616 13.719 -3.932 1.00 0.00 C HETATM 329 N4 CFL A 11 3.450 13.149 -3.754 1.00 0.00 N HETATM 330 C5 CFL A 11 5.494 13.982 -2.836 1.00 0.00 C HETATM 331 C6 CFL A 11 6.669 14.600 -3.123 1.00 0.00 C HETATM 332 F CFL A 11 8.071 16.973 -2.668 1.00 0.00 F HETATM 0 HN42 CFL A 11 3.137 12.912 -2.813 1.00 0.00 H new HETATM 0 HN41 CFL A 11 2.855 12.943 -4.557 1.00 0.00 H new HETATM 0 H5'2 CFL A 11 12.144 15.867 -2.794 1.00 0.00 H new HETATM 0 H5'1 CFL A 11 11.388 14.286 -2.818 1.00 0.00 H new HETATM 0 H6 CFL A 11 7.372 14.826 -2.321 1.00 0.00 H new HETATM 0 H5 CFL A 11 5.233 13.700 -1.816 1.00 0.00 H new HETATM 0 H4' CFL A 11 11.256 15.623 -4.841 1.00 0.00 H new HETATM 0 H3' CFL A 11 10.333 17.868 -3.530 1.00 0.00 H new HETATM 0 H2' CFL A 11 7.775 17.818 -4.362 1.00 0.00 H new HETATM 0 H1' CFL A 11 8.166 15.872 -5.793 1.00 0.00 H new HETATM 343 F GF2 A 12 4.629 20.663 -4.485 1.00 0.00 F HETATM 344 P GF2 A 12 9.780 19.136 -6.088 1.00 0.00 P HETATM 345 N1 GF2 A 12 0.934 15.533 -6.366 1.00 0.00 N HETATM 346 C2 GF2 A 12 1.694 16.103 -7.322 1.00 0.00 C HETATM 347 N2 GF2 A 12 1.321 15.863 -8.552 1.00 0.00 N HETATM 348 N3 GF2 A 12 2.774 16.832 -7.101 1.00 0.00 N HETATM 349 C4 GF2 A 12 3.104 16.887 -5.775 1.00 0.00 C HETATM 350 C5 GF2 A 12 2.440 16.297 -4.721 1.00 0.00 C HETATM 351 C6 GF2 A 12 1.239 15.547 -5.017 1.00 0.00 C HETATM 352 O6 GF2 A 12 0.441 14.962 -4.285 1.00 0.00 O HETATM 353 N7 GF2 A 12 3.096 16.615 -3.526 1.00 0.00 N HETATM 354 C8 GF2 A 12 4.075 17.403 -3.894 1.00 0.00 C HETATM 355 N9 GF2 A 12 4.109 17.658 -5.248 1.00 0.00 N HETATM 356 C1' GF2 A 12 4.681 18.777 -6.039 1.00 0.00 C HETATM 357 OP2 GF2 A 12 9.827 20.061 -4.937 1.00 0.00 O HETATM 358 C2' GF2 A 12 5.411 19.927 -5.355 1.00 0.00 C HETATM 359 OP1 GF2 A 12 10.546 19.425 -7.319 1.00 0.00 O HETATM 360 C3' GF2 A 12 5.714 20.697 -6.643 1.00 0.00 C HETATM 361 O3' GF2 A 12 4.484 21.208 -7.140 1.00 0.00 O HETATM 362 C4' GF2 A 12 6.158 19.567 -7.601 1.00 0.00 C HETATM 363 O4' GF2 A 12 5.558 18.381 -7.081 1.00 0.00 O HETATM 364 C5' GF2 A 12 7.681 19.373 -7.712 1.00 0.00 C HETATM 365 O5' GF2 A 12 8.231 18.924 -6.484 1.00 0.00 O HETATM 0 HO3' GF2 A 12 3.847 21.302 -6.401 1.00 0.00 H new HETATM 0 HN2A GF2 A 12 1.846 16.260 -9.331 1.00 0.00 H new HETATM 0 H5'A GF2 A 12 7.902 18.651 -8.498 1.00 0.00 H new HETATM 0 HN2 GF2 A 12 0.505 15.279 -8.733 1.00 0.00 H new HETATM 0 HN1 GF2 A 12 0.078 15.060 -6.656 1.00 0.00 H new HETATM 0 H8 GF2 A 12 4.798 17.820 -3.193 1.00 0.00 H new HETATM 0 H5' GF2 A 12 8.150 20.313 -8.002 1.00 0.00 H new HETATM 0 H4' GF2 A 12 5.845 19.819 -8.614 1.00 0.00 H new HETATM 0 H3' GF2 A 12 6.433 21.507 -6.525 1.00 0.00 H new HETATM 0 H2' GF2 A 12 6.242 19.651 -4.706 1.00 0.00 H new HETATM 0 H1' GF2 A 12 3.715 19.155 -6.374 1.00 0.00 H new TER 377 GF2 A 12 HETATM 378 N1 CFZ B 13 -2.987 14.208 -9.583 1.00 0.00 N HETATM 379 C2 CFZ B 13 -1.869 14.945 -9.142 1.00 0.00 C HETATM 380 O2 CFZ B 13 -1.330 15.772 -9.886 1.00 0.00 O HETATM 381 N3 CFZ B 13 -1.407 14.728 -7.857 1.00 0.00 N HETATM 382 C4 CFZ B 13 -2.037 13.857 -7.054 1.00 0.00 C HETATM 383 N4 CFZ B 13 -1.624 13.689 -5.812 1.00 0.00 N HETATM 384 C5 CFZ B 13 -3.182 13.130 -7.496 1.00 0.00 C HETATM 385 C6 CFZ B 13 -3.616 13.322 -8.756 1.00 0.00 C HETATM 386 C1' CFZ B 13 -3.487 14.353 -10.972 1.00 0.00 C HETATM 387 C2' CFZ B 13 -2.917 13.302 -11.921 1.00 0.00 C HETATM 388 F2' CFZ B 13 -1.897 14.022 -12.510 1.00 0.00 F HETATM 389 C3' CFZ B 13 -4.161 12.869 -12.708 1.00 0.00 C HETATM 390 O3' CFZ B 13 -3.920 12.488 -14.054 1.00 0.00 O HETATM 391 C4' CFZ B 13 -5.114 14.038 -12.487 1.00 0.00 C HETATM 392 O4' CFZ B 13 -4.900 14.307 -11.102 1.00 0.00 O HETATM 393 C5' CFZ B 13 -6.585 13.719 -12.785 1.00 0.00 C HETATM 394 O5' CFZ B 13 -7.103 12.751 -11.892 1.00 0.00 O HETATM 0 HN4A CFZ B 13 -2.102 13.027 -5.201 1.00 0.00 H new HETATM 0 H5'A CFZ B 13 -7.177 14.632 -12.715 1.00 0.00 H new HETATM 0 HN4 CFZ B 13 -0.827 14.221 -5.463 1.00 0.00 H new HETATM 0 H6 CFZ B 13 -4.479 12.764 -9.120 1.00 0.00 H new HETATM 0 H5' CFZ B 13 -6.678 13.356 -13.809 1.00 0.00 H new HETATM 0 H5 CFZ B 13 -3.693 12.436 -6.829 1.00 0.00 H new HETATM 0 H4' CFZ B 13 -4.919 14.874 -13.158 1.00 0.00 H new HETATM 0 H3' CFZ B 13 -4.589 11.929 -12.359 1.00 0.00 H new HETATM 0 H2' CFZ B 13 -2.466 12.363 -11.599 1.00 0.00 H new HETATM 0 H1' CFZ B 13 -3.140 15.350 -11.244 1.00 0.00 H new HETATM 406 F GF2 B 14 3.364 10.953 -12.993 1.00 0.00 F HETATM 407 P GF2 B 14 -3.274 11.056 -14.397 1.00 0.00 P HETATM 408 N1 GF2 B 14 3.622 13.243 -7.602 1.00 0.00 N HETATM 409 C2 GF2 B 14 4.131 13.419 -8.853 1.00 0.00 C HETATM 410 N2 GF2 B 14 5.317 13.962 -8.960 1.00 0.00 N HETATM 411 N3 GF2 B 14 3.489 13.104 -9.977 1.00 0.00 N HETATM 412 C4 GF2 B 14 2.245 12.597 -9.749 1.00 0.00 C HETATM 413 C5 GF2 B 14 1.635 12.386 -8.529 1.00 0.00 C HETATM 414 C6 GF2 B 14 2.370 12.718 -7.336 1.00 0.00 C HETATM 415 O6 GF2 B 14 2.039 12.618 -6.156 1.00 0.00 O HETATM 416 N7 GF2 B 14 0.350 11.869 -8.725 1.00 0.00 N HETATM 417 C8 GF2 B 14 0.239 11.780 -10.023 1.00 0.00 C HETATM 418 N9 GF2 B 14 1.354 12.192 -10.710 1.00 0.00 N HETATM 419 C1' GF2 B 14 1.645 12.115 -12.160 1.00 0.00 C HETATM 420 OP2 GF2 B 14 -3.843 9.989 -13.553 1.00 0.00 O HETATM 421 C2' GF2 B 14 2.081 10.714 -12.557 1.00 0.00 C HETATM 422 OP1 GF2 B 14 -3.294 10.784 -15.847 1.00 0.00 O HETATM 423 C3' GF2 B 14 1.038 10.221 -13.567 1.00 0.00 C HETATM 424 O3' GF2 B 14 1.504 9.190 -14.465 1.00 0.00 O HETATM 425 C4' GF2 B 14 0.599 11.595 -14.103 1.00 0.00 C HETATM 426 O4' GF2 B 14 0.480 12.364 -12.908 1.00 0.00 O HETATM 427 C5' GF2 B 14 -0.746 11.643 -14.824 1.00 0.00 C HETATM 428 O5' GF2 B 14 -1.743 11.112 -13.974 1.00 0.00 O HETATM 0 HN2A GF2 B 14 5.729 14.109 -9.881 1.00 0.00 H new HETATM 0 H5'A GF2 B 14 -0.991 12.670 -15.096 1.00 0.00 H new HETATM 0 HN2 GF2 B 14 5.829 14.238 -8.122 1.00 0.00 H new HETATM 0 HN1 GF2 B 14 4.202 13.516 -6.809 1.00 0.00 H new HETATM 0 H8 GF2 B 14 -0.660 11.411 -10.517 1.00 0.00 H new HETATM 0 H5' GF2 B 14 -0.697 11.071 -15.750 1.00 0.00 H new HETATM 0 H4' GF2 B 14 1.313 11.934 -14.854 1.00 0.00 H new HETATM 0 H3' GF2 B 14 0.196 9.633 -13.202 1.00 0.00 H new HETATM 0 H2' GF2 B 14 2.117 9.914 -11.818 1.00 0.00 H new HETATM 0 H1' GF2 B 14 2.427 12.849 -12.357 1.00 0.00 H new HETATM 439 P CFZ B 15 1.824 7.671 -13.934 1.00 0.00 P HETATM 440 N1 CFZ B 15 4.589 9.260 -9.197 1.00 0.00 N HETATM 441 C2 CFZ B 15 5.018 9.661 -7.934 1.00 0.00 C HETATM 442 O2 CFZ B 15 6.192 9.944 -7.735 1.00 0.00 O HETATM 443 N3 CFZ B 15 4.149 9.691 -6.894 1.00 0.00 N HETATM 444 C4 CFZ B 15 2.886 9.360 -7.097 1.00 0.00 C HETATM 445 N4 CFZ B 15 2.103 9.407 -6.046 1.00 0.00 N HETATM 446 C5 CFZ B 15 2.389 8.957 -8.377 1.00 0.00 C HETATM 447 C6 CFZ B 15 3.281 8.906 -9.402 1.00 0.00 C HETATM 448 C1' CFZ B 15 5.610 9.050 -10.256 1.00 0.00 C HETATM 449 O1P CFZ B 15 2.316 6.757 -14.989 1.00 0.00 O HETATM 450 C2' CFZ B 15 6.090 7.619 -10.271 1.00 0.00 C HETATM 451 F2' CFZ B 15 7.460 7.701 -10.235 1.00 0.00 F HETATM 452 O2P CFZ B 15 0.717 7.209 -13.064 1.00 0.00 O HETATM 453 C3' CFZ B 15 5.443 7.038 -11.530 1.00 0.00 C HETATM 454 O3' CFZ B 15 6.107 5.935 -12.131 1.00 0.00 O HETATM 455 C4' CFZ B 15 5.382 8.285 -12.400 1.00 0.00 C HETATM 456 O4' CFZ B 15 5.009 9.317 -11.508 1.00 0.00 O HETATM 457 C5' CFZ B 15 4.368 8.154 -13.532 1.00 0.00 C HETATM 458 O5' CFZ B 15 3.093 7.828 -12.990 1.00 0.00 O HETATM 0 HN4A CFZ B 15 1.116 9.164 -6.134 1.00 0.00 H new HETATM 0 H5'A CFZ B 15 4.309 9.087 -14.092 1.00 0.00 H new HETATM 0 HN4 CFZ B 15 2.481 9.687 -5.141 1.00 0.00 H new HETATM 0 H6 CFZ B 15 2.955 8.582 -10.390 1.00 0.00 H new HETATM 0 H5' CFZ B 15 4.686 7.381 -14.232 1.00 0.00 H new HETATM 0 H5 CFZ B 15 1.340 8.702 -8.524 1.00 0.00 H new HETATM 0 H4' CFZ B 15 6.335 8.473 -12.894 1.00 0.00 H new HETATM 0 H3' CFZ B 15 4.483 6.560 -11.336 1.00 0.00 H new HETATM 0 H2' CFZ B 15 5.820 6.960 -9.446 1.00 0.00 H new HETATM 0 H1' CFZ B 15 6.456 9.709 -10.061 1.00 0.00 H new HETATM 469 F GF2 B 16 9.914 5.110 -5.648 1.00 0.00 F HETATM 470 P GF2 B 16 5.995 4.457 -11.507 1.00 0.00 P HETATM 471 N1 GF2 B 16 5.991 7.195 -2.183 1.00 0.00 N HETATM 472 C2 GF2 B 16 7.311 7.200 -2.526 1.00 0.00 C HETATM 473 N2 GF2 B 16 8.187 7.445 -1.579 1.00 0.00 N HETATM 474 N3 GF2 B 16 7.769 6.951 -3.753 1.00 0.00 N HETATM 475 C4 GF2 B 16 6.774 6.719 -4.659 1.00 0.00 C HETATM 476 C5 GF2 B 16 5.417 6.681 -4.415 1.00 0.00 C HETATM 477 C6 GF2 B 16 4.963 6.902 -3.070 1.00 0.00 C HETATM 478 O6 GF2 B 16 3.809 6.842 -2.640 1.00 0.00 O HETATM 479 N7 GF2 B 16 4.703 6.401 -5.594 1.00 0.00 N HETATM 480 C8 GF2 B 16 5.656 6.302 -6.491 1.00 0.00 C HETATM 481 N9 GF2 B 16 6.930 6.427 -5.993 1.00 0.00 N HETATM 482 C1' GF2 B 16 8.207 6.134 -6.690 1.00 0.00 C HETATM 483 OP2 GF2 B 16 4.540 4.286 -11.280 1.00 0.00 O HETATM 484 C2' GF2 B 16 8.742 4.767 -6.288 1.00 0.00 C HETATM 485 OP1 GF2 B 16 6.670 3.557 -12.456 1.00 0.00 O HETATM 486 C3' GF2 B 16 8.783 3.959 -7.591 1.00 0.00 C HETATM 487 O3' GF2 B 16 9.853 3.017 -7.624 1.00 0.00 O HETATM 488 C4' GF2 B 16 8.785 5.058 -8.654 1.00 0.00 C HETATM 489 O4' GF2 B 16 7.942 6.049 -8.075 1.00 0.00 O HETATM 490 C5' GF2 B 16 8.235 4.666 -10.046 1.00 0.00 C HETATM 491 O5' GF2 B 16 6.809 4.504 -10.093 1.00 0.00 O HETATM 0 HN2A GF2 B 16 9.183 7.457 -1.797 1.00 0.00 H new HETATM 0 H5'A GF2 B 16 8.526 5.430 -10.767 1.00 0.00 H new HETATM 0 HN2 GF2 B 16 7.871 7.623 -0.626 1.00 0.00 H new HETATM 0 HN1 GF2 B 16 5.744 7.419 -1.219 1.00 0.00 H new HETATM 0 H8 GF2 B 16 5.452 6.134 -7.549 1.00 0.00 H new HETATM 0 H5' GF2 B 16 8.705 3.734 -10.361 1.00 0.00 H new HETATM 0 H4' GF2 B 16 9.810 5.357 -8.872 1.00 0.00 H new HETATM 0 H3' GF2 B 16 7.943 3.281 -7.743 1.00 0.00 H new HETATM 0 H2' GF2 B 16 8.192 4.117 -5.608 1.00 0.00 H new HETATM 0 H1' GF2 B 16 8.923 6.916 -6.437 1.00 0.00 H new HETATM 502 F AF2 B 17 10.416 2.951 -0.023 1.00 0.00 F HETATM 503 P AF2 B 17 9.838 1.661 -6.732 1.00 0.00 P HETATM 504 N1 AF2 B 17 4.777 4.485 0.755 1.00 0.00 N HETATM 505 C2 AF2 B 17 6.034 4.512 1.178 1.00 0.00 C HETATM 506 N3 AF2 B 17 7.136 4.305 0.461 1.00 0.00 N HETATM 507 C4 AF2 B 17 6.849 4.038 -0.846 1.00 0.00 C HETATM 508 C5 AF2 B 17 5.603 3.967 -1.418 1.00 0.00 C HETATM 509 C6 AF2 B 17 4.537 4.224 -0.529 1.00 0.00 C HETATM 510 N6 AF2 B 17 3.257 4.241 -0.871 1.00 0.00 N HETATM 511 N7 AF2 B 17 5.683 3.651 -2.780 1.00 0.00 N HETATM 512 C8 AF2 B 17 6.969 3.529 -2.971 1.00 0.00 C HETATM 513 N9 AF2 B 17 7.743 3.777 -1.861 1.00 0.00 N HETATM 514 C1' AF2 B 17 9.224 3.741 -1.758 1.00 0.00 C HETATM 515 OP2 AF2 B 17 8.515 1.008 -6.786 1.00 0.00 O HETATM 516 C2' AF2 B 17 9.699 2.459 -1.094 1.00 0.00 C HETATM 517 OP1 AF2 B 17 11.012 0.818 -7.012 1.00 0.00 O HETATM 518 C3' AF2 B 17 10.440 1.710 -2.200 1.00 0.00 C HETATM 519 O3' AF2 B 17 11.422 0.785 -1.732 1.00 0.00 O HETATM 520 C4' AF2 B 17 10.887 2.856 -3.104 1.00 0.00 C HETATM 521 O4' AF2 B 17 9.751 3.718 -3.074 1.00 0.00 O HETATM 522 C5' AF2 B 17 11.162 2.440 -4.559 1.00 0.00 C HETATM 523 O5' AF2 B 17 9.951 2.017 -5.172 1.00 0.00 O HETATM 0 HN6A AF2 B 17 2.984 4.052 -1.835 1.00 0.00 H new HETATM 0 H5'A AF2 B 17 11.588 3.277 -5.112 1.00 0.00 H new HETATM 0 HN6 AF2 B 17 2.544 4.444 -0.170 1.00 0.00 H new HETATM 0 H8 AF2 B 17 7.396 3.252 -3.935 1.00 0.00 H new HETATM 0 H5' AF2 B 17 11.895 1.634 -4.585 1.00 0.00 H new HETATM 0 H4' AF2 B 17 11.828 3.287 -2.760 1.00 0.00 H new HETATM 0 H3' AF2 B 17 9.839 0.991 -2.757 1.00 0.00 H new HETATM 0 H2' AF2 B 17 8.989 1.732 -0.700 1.00 0.00 H new HETATM 0 H2 AF2 B 17 6.182 4.729 2.236 1.00 0.00 H new HETATM 0 H1' AF2 B 17 9.548 4.605 -1.178 1.00 0.00 H new HETATM 534 F AF2 B 18 8.222 0.925 4.964 1.00 0.00 F HETATM 535 P AF2 B 18 10.980 -0.674 -1.174 1.00 0.00 P HETATM 536 N1 AF2 B 18 2.818 1.876 3.199 1.00 0.00 N HETATM 537 C2 AF2 B 18 3.791 1.951 4.105 1.00 0.00 C HETATM 538 N3 AF2 B 18 5.095 1.791 3.909 1.00 0.00 N HETATM 539 C4 AF2 B 18 5.388 1.508 2.611 1.00 0.00 C HETATM 540 C5 AF2 B 18 4.503 1.369 1.578 1.00 0.00 C HETATM 541 C6 AF2 B 18 3.157 1.602 1.932 1.00 0.00 C HETATM 542 N6 AF2 B 18 2.158 1.546 1.067 1.00 0.00 N HETATM 543 N7 AF2 B 18 5.158 1.018 0.392 1.00 0.00 N HETATM 544 C8 AF2 B 18 6.411 0.973 0.755 1.00 0.00 C HETATM 545 N9 AF2 B 18 6.634 1.303 2.070 1.00 0.00 N HETATM 546 C1' AF2 B 18 7.924 1.447 2.784 1.00 0.00 C HETATM 547 OP2 AF2 B 18 9.922 -1.169 -2.089 1.00 0.00 O HETATM 548 C2' AF2 B 18 8.159 0.291 3.739 1.00 0.00 C HETATM 549 OP1 AF2 B 18 12.160 -1.514 -0.904 1.00 0.00 O HETATM 550 C3' AF2 B 18 9.393 -0.380 3.166 1.00 0.00 C HETATM 551 O3' AF2 B 18 10.159 -1.121 4.103 1.00 0.00 O HETATM 552 C4' AF2 B 18 10.086 0.742 2.419 1.00 0.00 C HETATM 553 O4' AF2 B 18 8.969 1.395 1.830 1.00 0.00 O HETATM 554 C5' AF2 B 18 11.039 0.221 1.329 1.00 0.00 C HETATM 555 O5' AF2 B 18 10.311 -0.423 0.279 1.00 0.00 O HETATM 0 HN6A AF2 B 18 2.344 1.342 0.085 1.00 0.00 H new HETATM 0 H5'A AF2 B 18 11.618 1.049 0.920 1.00 0.00 H new HETATM 0 HN6 AF2 B 18 1.201 1.707 1.382 1.00 0.00 H new HETATM 0 H8 AF2 B 18 7.214 0.697 0.072 1.00 0.00 H new HETATM 0 H5' AF2 B 18 11.750 -0.480 1.767 1.00 0.00 H new HETATM 0 H4' AF2 B 18 10.715 1.366 3.054 1.00 0.00 H new HETATM 0 H3' AF2 B 18 9.165 -1.202 2.488 1.00 0.00 H new HETATM 0 H2' AF2 B 18 7.432 -0.512 3.863 1.00 0.00 H new HETATM 0 H2 AF2 B 18 3.481 2.169 5.127 1.00 0.00 H new HETATM 0 H1' AF2 B 18 7.901 2.386 3.336 1.00 0.00 H new HETATM 566 P TAF B 19 9.676 -2.585 4.581 1.00 0.00 P HETATM 567 OP1 TAF B 19 10.709 -3.129 5.480 1.00 0.00 O HETATM 568 OP2 TAF B 19 9.353 -3.285 3.310 1.00 0.00 O HETATM 569 O5' TAF B 19 8.323 -2.328 5.439 1.00 0.00 O HETATM 570 N1 TAF B 19 4.047 -1.117 5.162 1.00 0.00 N HETATM 571 C6 TAF B 19 4.641 -1.596 4.014 1.00 0.00 C HETATM 572 C2 TAF B 19 2.669 -0.881 5.213 1.00 0.00 C HETATM 573 O2 TAF B 19 2.088 -0.483 6.218 1.00 0.00 O HETATM 574 N3 TAF B 19 1.954 -1.130 4.064 1.00 0.00 N HETATM 575 C4 TAF B 19 2.472 -1.600 2.875 1.00 0.00 C HETATM 576 O4 TAF B 19 1.707 -1.775 1.931 1.00 0.00 O HETATM 577 C5 TAF B 19 3.915 -1.842 2.892 1.00 0.00 C HETATM 578 C5M TAF B 19 4.613 -2.383 1.658 1.00 0.00 C HETATM 579 F2' TAF B 19 4.668 -3.429 6.310 1.00 0.00 F HETATM 580 C2' TAF B 19 4.816 -2.351 7.174 1.00 0.00 C HETATM 581 C5' TAF B 19 8.364 -1.650 6.698 1.00 0.00 C HETATM 582 C4' TAF B 19 6.976 -1.267 7.255 1.00 0.00 C HETATM 583 O4' TAF B 19 6.181 -0.693 6.221 1.00 0.00 O HETATM 584 C1' TAF B 19 4.820 -1.020 6.431 1.00 0.00 C HETATM 585 C3' TAF B 19 6.174 -2.424 7.881 1.00 0.00 C HETATM 586 O3' TAF B 19 6.056 -2.323 9.313 1.00 0.00 O HETATM 0 H5'' TAF B 19 8.872 -2.285 7.424 1.00 0.00 H new HETATM 0 H73 TAF B 19 5.378 -1.678 1.334 1.00 0.00 H new HETATM 0 H72 TAF B 19 5.078 -3.340 1.893 1.00 0.00 H new HETATM 0 H71 TAF B 19 3.885 -2.520 0.859 1.00 0.00 H new HETATM 0 H6 TAF B 19 5.715 -1.781 4.006 1.00 0.00 H new HETATM 0 H5' TAF B 19 8.963 -0.745 6.592 1.00 0.00 H new HETATM 0 H4' TAF B 19 7.188 -0.562 8.059 1.00 0.00 H new HETATM 0 H3' TAF B 19 6.669 -3.385 7.741 1.00 0.00 H new HETATM 0 H3 TAF B 19 0.950 -0.951 4.094 1.00 0.00 H new HETATM 0 H2' TAF B 19 3.978 -2.404 7.869 1.00 0.00 H new HETATM 0 H1' TAF B 19 4.330 -0.232 7.003 1.00 0.00 H new HETATM 598 P UFT B 20 5.537 -3.556 10.257 1.00 0.00 P HETATM 599 OP1 UFT B 20 5.824 -3.259 11.674 1.00 0.00 O HETATM 600 OP2 UFT B 20 5.984 -4.837 9.681 1.00 0.00 O HETATM 601 O5' UFT B 20 3.931 -3.575 10.139 1.00 0.00 O HETATM 602 N1 UFT B 20 0.334 -3.373 6.907 1.00 0.00 N HETATM 603 C6 UFT B 20 1.398 -3.958 6.251 1.00 0.00 C HETATM 604 C2 UFT B 20 -0.916 -3.288 6.294 1.00 0.00 C HETATM 605 O2 UFT B 20 -1.912 -2.840 6.849 1.00 0.00 O HETATM 606 N3 UFT B 20 -1.009 -3.747 5.005 1.00 0.00 N HETATM 607 C4 UFT B 20 0.005 -4.302 4.265 1.00 0.00 C HETATM 608 O4 UFT B 20 -0.226 -4.689 3.126 1.00 0.00 O HETATM 609 C5 UFT B 20 1.267 -4.403 4.971 1.00 0.00 C HETATM 610 F2' UFT B 20 -1.309 -3.770 9.502 1.00 0.00 F HETATM 611 C2' UFT B 20 0.011 -4.051 9.260 1.00 0.00 C HETATM 612 C5' UFT B 20 3.146 -2.522 10.676 1.00 0.00 C HETATM 613 C4' UFT B 20 1.719 -2.578 10.118 1.00 0.00 C HETATM 614 O4' UFT B 20 1.730 -2.555 8.699 1.00 0.00 O HETATM 615 C1' UFT B 20 0.422 -2.922 8.319 1.00 0.00 C HETATM 616 C3' UFT B 20 1.014 -3.897 10.395 1.00 0.00 C HETATM 617 O3' UFT B 20 0.506 -4.082 11.708 1.00 0.00 O HETATM 0 H5'A UFT B 20 3.121 -2.597 11.763 1.00 0.00 H new HETATM 0 HN3 UFT B 20 -1.920 -3.668 4.553 1.00 0.00 H new HETATM 0 H6 UFT B 20 2.354 -4.065 6.763 1.00 0.00 H new HETATM 0 H5' UFT B 20 3.600 -1.561 10.433 1.00 0.00 H new HETATM 0 H5 UFT B 20 2.127 -4.844 4.467 1.00 0.00 H new HETATM 0 H4' UFT B 20 1.224 -1.730 10.591 1.00 0.00 H new HETATM 0 H3' UFT B 20 1.729 -4.719 10.399 1.00 0.00 H new HETATM 0 H2' UFT B 20 0.046 -5.097 8.955 1.00 0.00 H new HETATM 0 H1' UFT B 20 -0.238 -2.058 8.391 1.00 0.00 H new HETATM 627 P CFL B 21 0.066 -5.536 12.240 1.00 0.00 P HETATM 628 O1P CFL B 21 -0.138 -5.423 13.695 1.00 0.00 O HETATM 629 O2P CFL B 21 1.129 -6.437 11.722 1.00 0.00 O HETATM 630 O5' CFL B 21 -1.377 -5.840 11.536 1.00 0.00 O HETATM 631 C5' CFL B 21 -2.529 -5.072 11.910 1.00 0.00 C HETATM 632 C4' CFL B 21 -3.859 -5.309 11.151 1.00 0.00 C HETATM 633 O4' CFL B 21 -3.758 -5.006 9.764 1.00 0.00 O HETATM 634 C3' CFL B 21 -4.528 -6.690 11.299 1.00 0.00 C HETATM 635 O3' CFL B 21 -5.853 -6.556 11.853 1.00 0.00 O HETATM 636 C2' CFL B 21 -4.501 -7.236 9.875 1.00 0.00 C HETATM 637 C1' CFL B 21 -4.442 -5.984 8.998 1.00 0.00 C HETATM 638 N1 CFL B 21 -3.761 -6.190 7.685 1.00 0.00 N HETATM 639 C2 CFL B 21 -4.531 -6.320 6.525 1.00 0.00 C HETATM 640 O2 CFL B 21 -5.757 -6.219 6.550 1.00 0.00 O HETATM 641 N3 CFL B 21 -3.938 -6.584 5.335 1.00 0.00 N HETATM 642 C4 CFL B 21 -2.621 -6.714 5.285 1.00 0.00 C HETATM 643 N4 CFL B 21 -2.116 -6.967 4.101 1.00 0.00 N HETATM 644 C5 CFL B 21 -1.781 -6.572 6.436 1.00 0.00 C HETATM 645 C6 CFL B 21 -2.397 -6.317 7.621 1.00 0.00 C HETATM 646 F CFL B 21 -3.354 -7.964 9.678 1.00 0.00 F HETATM 0 HN42 CFL B 21 -1.108 -7.079 3.990 1.00 0.00 H new HETATM 0 HN41 CFL B 21 -2.731 -7.051 3.292 1.00 0.00 H new HETATM 0 H5'2 CFL B 21 -2.716 -5.251 12.969 1.00 0.00 H new HETATM 0 H5'1 CFL B 21 -2.272 -4.018 11.805 1.00 0.00 H new HETATM 0 H6 CFL B 21 -1.802 -6.213 8.528 1.00 0.00 H new HETATM 0 H5 CFL B 21 -0.697 -6.664 6.365 1.00 0.00 H new HETATM 0 H4' CFL B 21 -4.515 -4.607 11.666 1.00 0.00 H new HETATM 0 H3' CFL B 21 -4.027 -7.367 11.991 1.00 0.00 H new HETATM 0 H2' CFL B 21 -5.354 -7.879 9.659 1.00 0.00 H new HETATM 0 H1' CFL B 21 -5.456 -5.683 8.734 1.00 0.00 H new HETATM 657 F GF2 B 22 -8.549 -11.497 6.895 1.00 0.00 F HETATM 658 P GF2 B 22 -6.805 -7.795 12.331 1.00 0.00 P HETATM 659 N1 GF2 B 22 -5.945 -10.716 2.397 1.00 0.00 N HETATM 660 C2 GF2 B 22 -7.169 -10.658 2.987 1.00 0.00 C HETATM 661 N2 GF2 B 22 -8.222 -11.003 2.292 1.00 0.00 N HETATM 662 N3 GF2 B 22 -7.371 -10.318 4.252 1.00 0.00 N HETATM 663 C4 GF2 B 22 -6.212 -10.101 4.933 1.00 0.00 C HETATM 664 C5 GF2 B 22 -4.925 -10.167 4.453 1.00 0.00 C HETATM 665 C6 GF2 B 22 -4.750 -10.468 3.052 1.00 0.00 C HETATM 666 O6 GF2 B 22 -3.723 -10.564 2.384 1.00 0.00 O HETATM 667 N7 GF2 B 22 -4.023 -9.953 5.505 1.00 0.00 N HETATM 668 C8 GF2 B 22 -4.786 -9.745 6.548 1.00 0.00 C HETATM 669 N9 GF2 B 22 -6.129 -9.803 6.266 1.00 0.00 N HETATM 670 C1' GF2 B 22 -7.320 -9.646 7.123 1.00 0.00 C HETATM 671 OP2 GF2 B 22 -6.032 -8.872 12.985 1.00 0.00 O HETATM 672 C2' GF2 B 22 -7.745 -10.913 7.844 1.00 0.00 C HETATM 673 OP1 GF2 B 22 -8.014 -7.270 12.990 1.00 0.00 O HETATM 674 C3' GF2 B 22 -8.408 -10.316 9.081 1.00 0.00 C HETATM 675 O3' GF2 B 22 -9.650 -10.886 9.467 1.00 0.00 O HETATM 676 C4' GF2 B 22 -8.384 -8.802 8.872 1.00 0.00 C HETATM 677 O4' GF2 B 22 -7.205 -8.633 8.097 1.00 0.00 O HETATM 678 C5' GF2 B 22 -8.329 -8.009 10.184 1.00 0.00 C HETATM 679 O5' GF2 B 22 -7.286 -8.515 10.993 1.00 0.00 O HETATM 0 HN2A GF2 B 22 -9.148 -10.966 2.717 1.00 0.00 H new HETATM 0 H5'A GF2 B 22 -8.163 -6.952 9.977 1.00 0.00 H new HETATM 0 HN2 GF2 B 22 -8.117 -11.309 1.325 1.00 0.00 H new HETATM 0 HN1 GF2 B 22 -5.904 -10.958 1.407 1.00 0.00 H new HETATM 0 H8 GF2 B 22 -4.393 -9.545 7.545 1.00 0.00 H new HETATM 0 H5' GF2 B 22 -9.281 -8.086 10.709 1.00 0.00 H new HETATM 0 H4' GF2 B 22 -9.289 -8.424 8.396 1.00 0.00 H new HETATM 0 H3' GF2 B 22 -7.846 -10.578 9.977 1.00 0.00 H new HETATM 0 H2' GF2 B 22 -7.042 -11.674 8.181 1.00 0.00 H new HETATM 0 H1' GF2 B 22 -8.080 -9.368 6.393 1.00 0.00 H new HETATM 690 P CFL B 23 -9.726 -12.334 10.165 1.00 0.00 P HETATM 691 O1P CFL B 23 -11.061 -12.458 10.781 1.00 0.00 O HETATM 692 O2P CFL B 23 -8.513 -12.401 11.028 1.00 0.00 O HETATM 693 O5' CFL B 23 -9.640 -13.377 8.912 1.00 0.00 O HETATM 694 C5' CFL B 23 -10.756 -13.508 8.018 1.00 0.00 C HETATM 695 C4' CFL B 23 -10.648 -14.402 6.754 1.00 0.00 C HETATM 696 O4' CFL B 23 -9.736 -13.890 5.790 1.00 0.00 O HETATM 697 C3' CFL B 23 -10.295 -15.890 6.912 1.00 0.00 C HETATM 698 O3' CFL B 23 -11.094 -16.670 5.989 1.00 0.00 O HETATM 699 C2' CFL B 23 -8.818 -15.927 6.580 1.00 0.00 C HETATM 700 C1' CFL B 23 -8.865 -14.947 5.406 1.00 0.00 C HETATM 701 N1 CFL B 23 -7.548 -14.406 5.006 1.00 0.00 N HETATM 702 C2 CFL B 23 -7.096 -14.606 3.700 1.00 0.00 C HETATM 703 O2 CFL B 23 -7.795 -15.149 2.847 1.00 0.00 O HETATM 704 N3 CFL B 23 -5.850 -14.213 3.348 1.00 0.00 N HETATM 705 C4 CFL B 23 -5.087 -13.611 4.245 1.00 0.00 C HETATM 706 N4 CFL B 23 -3.892 -13.275 3.833 1.00 0.00 N HETATM 707 C5 CFL B 23 -5.535 -13.306 5.568 1.00 0.00 C HETATM 708 C6 CFL B 23 -6.776 -13.734 5.911 1.00 0.00 C HETATM 709 F CFL B 23 -8.022 -15.532 7.637 1.00 0.00 F HETATM 0 HN42 CFL B 23 -3.246 -12.807 4.469 1.00 0.00 H new HETATM 0 HN41 CFL B 23 -3.606 -13.481 2.876 1.00 0.00 H new HETATM 0 H5'2 CFL B 23 -11.597 -13.879 8.604 1.00 0.00 H new HETATM 0 H5'1 CFL B 23 -11.019 -12.505 7.682 1.00 0.00 H new HETATM 0 H6 CFL B 23 -7.159 -13.541 6.913 1.00 0.00 H new HETATM 0 H5 CFL B 23 -4.908 -12.755 6.269 1.00 0.00 H new HETATM 0 H4' CFL B 23 -11.692 -14.361 6.442 1.00 0.00 H new HETATM 0 H3' CFL B 23 -10.495 -16.307 7.899 1.00 0.00 H new HETATM 0 H2' CFL B 23 -8.379 -16.899 6.358 1.00 0.00 H new HETATM 0 H1' CFL B 23 -9.219 -15.484 4.526 1.00 0.00 H new HETATM 720 F GF2 B 24 -5.553 -19.876 6.345 1.00 0.00 F HETATM 721 P GF2 B 24 -10.892 -18.264 5.710 1.00 0.00 P HETATM 722 N1 GF2 B 24 -2.108 -16.867 1.634 1.00 0.00 N HETATM 723 C2 GF2 B 24 -3.173 -17.600 1.241 1.00 0.00 C HETATM 724 N2 GF2 B 24 -3.193 -17.921 -0.028 1.00 0.00 N HETATM 725 N3 GF2 B 24 -4.205 -17.920 2.005 1.00 0.00 N HETATM 726 C4 GF2 B 24 -4.121 -17.367 3.253 1.00 0.00 C HETATM 727 C5 GF2 B 24 -3.107 -16.578 3.752 1.00 0.00 C HETATM 728 C6 GF2 B 24 -1.986 -16.294 2.887 1.00 0.00 C HETATM 729 O6 GF2 B 24 -0.949 -15.664 3.083 1.00 0.00 O HETATM 730 N7 GF2 B 24 -3.391 -16.247 5.082 1.00 0.00 N HETATM 731 C8 GF2 B 24 -4.526 -16.847 5.332 1.00 0.00 C HETATM 732 N9 GF2 B 24 -5.009 -17.592 4.277 1.00 0.00 N HETATM 733 C1' GF2 B 24 -5.950 -18.738 4.216 1.00 0.00 C HETATM 734 OP2 GF2 B 24 -10.561 -18.897 7.002 1.00 0.00 O HETATM 735 C2' GF2 B 24 -6.508 -19.354 5.492 1.00 0.00 C HETATM 736 OP1 GF2 B 24 -12.040 -18.741 4.910 1.00 0.00 O HETATM 737 C3' GF2 B 24 -7.311 -20.452 4.794 1.00 0.00 C HETATM 738 O3' GF2 B 24 -6.381 -21.394 4.278 1.00 0.00 O HETATM 739 C4' GF2 B 24 -7.922 -19.698 3.589 1.00 0.00 C HETATM 740 O4' GF2 B 24 -7.097 -18.545 3.407 1.00 0.00 O HETATM 741 C5' GF2 B 24 -9.396 -19.281 3.749 1.00 0.00 C HETATM 742 O5' GF2 B 24 -9.570 -18.319 4.778 1.00 0.00 O HETATM 0 HO3' GF2 B 24 -5.579 -21.404 4.841 1.00 0.00 H new HETATM 0 HN2A GF2 B 24 -3.964 -18.474 -0.402 1.00 0.00 H new HETATM 0 H5'A GF2 B 24 -9.761 -18.873 2.806 1.00 0.00 H new HETATM 0 HN2 GF2 B 24 -2.437 -17.618 -0.643 1.00 0.00 H new HETATM 0 HN1 GF2 B 24 -1.349 -16.728 0.967 1.00 0.00 H new HETATM 0 H8 GF2 B 24 -5.043 -16.765 6.288 1.00 0.00 H new HETATM 0 H5' GF2 B 24 -9.999 -20.161 3.971 1.00 0.00 H new HETATM 0 H4' GF2 B 24 -7.939 -20.369 2.730 1.00 0.00 H new HETATM 0 H3' GF2 B 24 -8.039 -20.955 5.430 1.00 0.00 H new HETATM 0 H2' GF2 B 24 -7.033 -18.672 6.161 1.00 0.00 H new HETATM 0 H1' GF2 B 24 -5.213 -19.423 3.797 1.00 0.00 H new TER 754 GF2 B 24