USER MOD reduce.3.24.130724 H: found=0, std=0, add=375, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 373 hydrogens (0 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 1 SER N :NH3+ 176:sc= -0.13 (180deg=-0.146) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HD1:sc= 0.419 K(o=0.42,f=-2.5!) USER MOD Single : A 6 HIS : no HD1:sc= -2 X(o=-2,f=-1.7) USER MOD Single : A 8 LYS NZ :NH3+ 144:sc= -0.104 (180deg=-0.954) USER MOD Single : A 14 MET CE :methyl -135:sc= -0.311 (180deg=-1.78!) USER MOD Single : A 16 TYR OH : rot 52:sc= 1.26 USER MOD Single : A 18 LYS NZ :NH3+ -114:sc= -0.0755 (180deg=-1.56!) USER MOD Single : A 19 LYS NZ :NH3+ 161:sc= 0.339 (180deg=-0.232) USER MOD Single : A 20 GLN : amide:sc= -4.13! C(o=-4.1!,f=-4.1!) USER MOD Single : B 1 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 1 DT O5' : rot -27:sc= 0.00177 USER MOD Single : B 2 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 6 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 10 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 14 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 18 DT C7 :methyl 150:sc= -0.177 (180deg=-0.177) USER MOD Single : B 18 DT O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 5.774 -33.241 24.503 1.00 0.38 N ATOM 2 CA SER A 1 6.142 -34.611 24.958 1.00 0.39 C ATOM 3 C SER A 1 5.866 -35.608 23.838 1.00 0.46 C ATOM 4 O SER A 1 6.117 -36.805 23.984 1.00 1.00 O ATOM 5 CB SER A 1 5.318 -34.973 26.195 1.00 0.27 C ATOM 6 OG SER A 1 3.944 -34.707 25.937 1.00 0.61 O ATOM 0 H1 SER A 1 5.898 -32.570 25.288 1.00 0.38 H new ATOM 0 H2 SER A 1 6.386 -32.963 23.710 1.00 0.38 H new ATOM 0 H3 SER A 1 4.781 -33.233 24.194 1.00 0.38 H new ATOM 0 HA SER A 1 7.202 -34.643 25.212 1.00 0.39 H new ATOM 0 HB2 SER A 1 5.456 -36.025 26.444 1.00 0.27 H new ATOM 0 HB3 SER A 1 5.657 -34.395 27.055 1.00 0.27 H new ATOM 0 HG SER A 1 3.412 -34.939 26.727 1.00 0.61 H new ATOM 14 N MET A 2 5.350 -35.108 22.720 1.00 0.31 N ATOM 15 CA MET A 2 5.045 -35.965 21.580 1.00 0.22 C ATOM 16 C MET A 2 5.491 -35.306 20.279 1.00 0.21 C ATOM 17 O MET A 2 5.866 -35.985 19.323 1.00 0.38 O ATOM 18 CB MET A 2 3.542 -36.245 21.524 1.00 0.15 C ATOM 19 CG MET A 2 3.190 -36.875 20.175 1.00 0.24 C ATOM 20 SD MET A 2 4.236 -38.327 19.896 1.00 0.55 S ATOM 21 CE MET A 2 3.856 -38.549 18.140 1.00 0.81 C ATOM 0 H MET A 2 5.135 -34.121 22.579 1.00 0.31 H new ATOM 0 HA MET A 2 5.585 -36.904 21.701 1.00 0.22 H new ATOM 0 HB2 MET A 2 3.255 -36.914 22.336 1.00 0.15 H new ATOM 0 HB3 MET A 2 2.983 -35.319 21.662 1.00 0.15 H new ATOM 0 HG2 MET A 2 2.139 -37.162 20.159 1.00 0.24 H new ATOM 0 HG3 MET A 2 3.335 -36.150 19.374 1.00 0.24 H new ATOM 0 HE1 MET A 2 4.405 -39.408 17.755 1.00 0.81 H new ATOM 0 HE2 MET A 2 2.786 -38.718 18.018 1.00 0.81 H new ATOM 0 HE3 MET A 2 4.147 -37.655 17.589 1.00 0.81 H new ATOM 31 N HIS A 3 5.447 -33.978 20.249 1.00 0.21 N ATOM 32 CA HIS A 3 5.849 -33.236 19.060 1.00 0.17 C ATOM 33 C HIS A 3 7.174 -32.520 19.300 1.00 0.18 C ATOM 34 O HIS A 3 7.525 -32.203 20.437 1.00 0.27 O ATOM 35 CB HIS A 3 4.772 -32.213 18.695 1.00 0.20 C ATOM 36 CG HIS A 3 3.903 -31.949 19.893 1.00 0.31 C ATOM 37 ND1 HIS A 3 4.420 -31.489 21.094 1.00 0.22 N ATOM 38 CD2 HIS A 3 2.550 -32.075 20.092 1.00 0.76 C ATOM 39 CE1 HIS A 3 3.393 -31.356 21.954 1.00 0.38 C ATOM 40 NE2 HIS A 3 2.231 -31.700 21.394 1.00 0.77 N ATOM 0 H HIS A 3 5.139 -33.397 21.029 1.00 0.21 H new ATOM 0 HA HIS A 3 5.973 -33.941 18.238 1.00 0.17 H new ATOM 0 HB2 HIS A 3 5.236 -31.286 18.358 1.00 0.20 H new ATOM 0 HB3 HIS A 3 4.167 -32.586 17.869 1.00 0.20 H new ATOM 0 HD2 HIS A 3 1.841 -32.414 19.351 1.00 0.76 H new ATOM 0 HE1 HIS A 3 3.496 -31.013 22.973 1.00 0.38 H new ATOM 0 HE2 HIS A 3 1.308 -31.690 21.827 1.00 0.77 H new ATOM 48 N PRO A 4 7.908 -32.264 18.251 1.00 0.13 N ATOM 49 CA PRO A 4 9.226 -31.571 18.338 1.00 0.17 C ATOM 50 C PRO A 4 9.097 -30.164 18.918 1.00 0.19 C ATOM 51 O PRO A 4 9.493 -29.914 20.057 1.00 0.35 O ATOM 52 CB PRO A 4 9.724 -31.520 16.888 1.00 0.20 C ATOM 53 CG PRO A 4 8.525 -31.774 16.032 1.00 0.26 C ATOM 54 CD PRO A 4 7.559 -32.609 16.868 1.00 0.18 C ATOM 0 HA PRO A 4 9.913 -32.094 19.004 1.00 0.17 H new ATOM 0 HB2 PRO A 4 10.167 -30.550 16.661 1.00 0.20 H new ATOM 0 HB3 PRO A 4 10.494 -32.271 16.713 1.00 0.20 H new ATOM 0 HG2 PRO A 4 8.062 -30.836 15.727 1.00 0.26 H new ATOM 0 HG3 PRO A 4 8.805 -32.303 15.121 1.00 0.26 H new ATOM 0 HD2 PRO A 4 6.521 -32.364 16.644 1.00 0.18 H new ATOM 0 HD3 PRO A 4 7.683 -33.675 16.678 1.00 0.18 H new ATOM 62 N GLY A 5 8.539 -29.252 18.129 1.00 0.17 N ATOM 63 CA GLY A 5 8.363 -27.875 18.576 1.00 0.19 C ATOM 64 C GLY A 5 9.676 -27.104 18.500 1.00 0.23 C ATOM 65 O GLY A 5 9.690 -25.912 18.192 1.00 0.35 O ATOM 0 H GLY A 5 8.203 -29.439 17.184 1.00 0.17 H new ATOM 0 HA2 GLY A 5 7.611 -27.382 17.959 1.00 0.19 H new ATOM 0 HA3 GLY A 5 7.991 -27.866 19.600 1.00 0.19 H new ATOM 69 N HIS A 6 10.779 -27.791 18.782 1.00 0.20 N ATOM 70 CA HIS A 6 12.092 -27.158 18.741 1.00 0.25 C ATOM 71 C HIS A 6 12.597 -27.063 17.305 1.00 0.26 C ATOM 72 O HIS A 6 13.644 -26.472 17.042 1.00 0.33 O ATOM 73 CB HIS A 6 13.086 -27.963 19.581 1.00 0.29 C ATOM 74 CG HIS A 6 12.342 -28.738 20.634 1.00 0.23 C ATOM 75 ND1 HIS A 6 12.292 -30.123 20.634 1.00 0.36 N ATOM 76 CD2 HIS A 6 11.613 -28.337 21.726 1.00 0.31 C ATOM 77 CE1 HIS A 6 11.556 -30.503 21.694 1.00 0.34 C ATOM 78 NE2 HIS A 6 11.118 -29.453 22.394 1.00 0.34 N ATOM 0 H HIS A 6 10.790 -28.778 19.039 1.00 0.20 H new ATOM 0 HA HIS A 6 12.002 -26.151 19.150 1.00 0.25 H new ATOM 0 HB2 HIS A 6 13.649 -28.644 18.943 1.00 0.29 H new ATOM 0 HB3 HIS A 6 13.808 -27.294 20.049 1.00 0.29 H new ATOM 0 HD2 HIS A 6 11.449 -27.311 22.022 1.00 0.31 H new ATOM 0 HE1 HIS A 6 11.345 -31.531 21.948 1.00 0.34 H new ATOM 0 HE2 HIS A 6 10.544 -29.466 23.237 1.00 0.34 H new ATOM 86 N LEU A 7 11.844 -27.650 16.379 1.00 0.21 N ATOM 87 CA LEU A 7 12.224 -27.625 14.972 1.00 0.24 C ATOM 88 C LEU A 7 11.826 -26.300 14.332 1.00 0.29 C ATOM 89 O LEU A 7 10.839 -25.679 14.728 1.00 0.63 O ATOM 90 CB LEU A 7 11.547 -28.778 14.228 1.00 0.23 C ATOM 91 CG LEU A 7 12.452 -30.010 14.263 1.00 0.21 C ATOM 92 CD1 LEU A 7 12.959 -30.232 15.689 1.00 0.21 C ATOM 93 CD2 LEU A 7 11.659 -31.237 13.809 1.00 0.21 C ATOM 0 H LEU A 7 10.974 -28.145 16.576 1.00 0.21 H new ATOM 0 HA LEU A 7 13.306 -27.736 14.906 1.00 0.24 H new ATOM 0 HB2 LEU A 7 10.586 -29.007 14.688 1.00 0.23 H new ATOM 0 HB3 LEU A 7 11.346 -28.491 13.196 1.00 0.23 H new ATOM 0 HG LEU A 7 13.300 -29.856 13.596 1.00 0.21 H new ATOM 0 HD11 LEU A 7 13.604 -31.110 15.713 1.00 0.21 H new ATOM 0 HD12 LEU A 7 13.523 -29.358 16.015 1.00 0.21 H new ATOM 0 HD13 LEU A 7 12.111 -30.386 16.357 1.00 0.21 H new ATOM 0 HD21 LEU A 7 12.303 -32.116 13.833 1.00 0.21 H new ATOM 0 HD22 LEU A 7 10.811 -31.390 14.477 1.00 0.21 H new ATOM 0 HD23 LEU A 7 11.297 -31.081 12.793 1.00 0.21 H new ATOM 105 N LYS A 8 12.600 -25.871 13.340 1.00 0.17 N ATOM 106 CA LYS A 8 12.318 -24.616 12.652 1.00 0.15 C ATOM 107 C LYS A 8 12.380 -24.812 11.139 1.00 0.14 C ATOM 108 O LYS A 8 13.411 -25.211 10.597 1.00 0.19 O ATOM 109 CB LYS A 8 13.328 -23.547 13.090 1.00 0.19 C ATOM 110 CG LYS A 8 13.641 -22.601 11.924 1.00 0.24 C ATOM 111 CD LYS A 8 12.337 -22.039 11.353 1.00 0.29 C ATOM 112 CE LYS A 8 12.427 -20.513 11.277 1.00 0.33 C ATOM 113 NZ LYS A 8 13.650 -20.124 10.519 1.00 0.67 N ATOM 0 H LYS A 8 13.421 -26.369 12.997 1.00 0.17 H new ATOM 0 HA LYS A 8 11.313 -24.287 12.915 1.00 0.15 H new ATOM 0 HB2 LYS A 8 12.926 -22.980 13.930 1.00 0.19 H new ATOM 0 HB3 LYS A 8 14.245 -24.024 13.437 1.00 0.19 H new ATOM 0 HG2 LYS A 8 14.281 -21.787 12.265 1.00 0.24 H new ATOM 0 HG3 LYS A 8 14.190 -23.134 11.148 1.00 0.24 H new ATOM 0 HD2 LYS A 8 12.154 -22.453 10.361 1.00 0.29 H new ATOM 0 HD3 LYS A 8 11.496 -22.333 11.981 1.00 0.29 H new ATOM 0 HE2 LYS A 8 11.540 -20.110 10.789 1.00 0.33 H new ATOM 0 HE3 LYS A 8 12.458 -20.090 12.281 1.00 0.33 H new ATOM 0 HZ1 LYS A 8 13.452 -19.274 9.953 1.00 0.67 H new ATOM 0 HZ2 LYS A 8 14.423 -19.923 11.186 1.00 0.67 H new ATOM 0 HZ3 LYS A 8 13.930 -20.902 9.889 1.00 0.67 H new ATOM 127 N GLY A 9 11.270 -24.530 10.465 1.00 0.15 N ATOM 128 CA GLY A 9 11.209 -24.679 9.016 1.00 0.17 C ATOM 129 C GLY A 9 10.555 -26.001 8.632 1.00 0.21 C ATOM 130 O GLY A 9 10.081 -26.743 9.493 1.00 0.45 O ATOM 0 H GLY A 9 10.406 -24.199 10.895 1.00 0.15 H new ATOM 0 HA2 GLY A 9 10.646 -23.851 8.585 1.00 0.17 H new ATOM 0 HA3 GLY A 9 12.215 -24.632 8.599 1.00 0.17 H new ATOM 134 N ARG A 10 10.532 -26.291 7.335 1.00 0.25 N ATOM 135 CA ARG A 10 9.932 -27.529 6.850 1.00 0.25 C ATOM 136 C ARG A 10 10.307 -28.696 7.756 1.00 0.27 C ATOM 137 O ARG A 10 9.710 -29.770 7.681 1.00 0.51 O ATOM 138 CB ARG A 10 10.408 -27.817 5.424 1.00 0.27 C ATOM 139 CG ARG A 10 10.227 -26.568 4.559 1.00 0.62 C ATOM 140 CD ARG A 10 9.968 -26.985 3.109 1.00 0.46 C ATOM 141 NE ARG A 10 10.923 -28.008 2.699 1.00 0.59 N ATOM 142 CZ ARG A 10 10.947 -28.467 1.452 1.00 0.76 C ATOM 143 NH1 ARG A 10 10.107 -28.000 0.568 1.00 0.95 N ATOM 144 NH2 ARG A 10 11.810 -29.384 1.110 1.00 1.01 N ATOM 0 H ARG A 10 10.918 -25.691 6.606 1.00 0.25 H new ATOM 0 HA ARG A 10 8.848 -27.411 6.855 1.00 0.25 H new ATOM 0 HB2 ARG A 10 11.456 -28.116 5.433 1.00 0.27 H new ATOM 0 HB3 ARG A 10 9.843 -28.648 5.002 1.00 0.27 H new ATOM 0 HG2 ARG A 10 9.394 -25.972 4.932 1.00 0.62 H new ATOM 0 HG3 ARG A 10 11.117 -25.942 4.615 1.00 0.62 H new ATOM 0 HD2 ARG A 10 8.952 -27.366 3.009 1.00 0.46 H new ATOM 0 HD3 ARG A 10 10.050 -26.118 2.454 1.00 0.46 H new ATOM 0 HE ARG A 10 11.584 -28.378 3.382 1.00 0.59 H new ATOM 0 HH11 ARG A 10 9.432 -27.283 0.835 1.00 0.95 H new ATOM 0 HH12 ARG A 10 10.126 -28.352 -0.389 1.00 0.95 H new ATOM 0 HH21 ARG A 10 12.467 -29.749 1.800 1.00 1.01 H new ATOM 0 HH22 ARG A 10 11.828 -29.736 0.153 1.00 1.01 H new ATOM 158 N GLU A 11 11.300 -28.479 8.613 1.00 0.09 N ATOM 159 CA GLU A 11 11.746 -29.522 9.529 1.00 0.16 C ATOM 160 C GLU A 11 10.570 -30.074 10.327 1.00 0.19 C ATOM 161 O GLU A 11 10.399 -31.287 10.439 1.00 0.29 O ATOM 162 CB GLU A 11 12.797 -28.961 10.489 1.00 0.21 C ATOM 163 CG GLU A 11 14.049 -28.565 9.704 1.00 0.40 C ATOM 164 CD GLU A 11 14.933 -27.661 10.556 1.00 0.34 C ATOM 165 OE1 GLU A 11 14.835 -27.742 11.770 1.00 0.85 O ATOM 166 OE2 GLU A 11 15.697 -26.902 9.983 1.00 0.52 O ATOM 0 H GLU A 11 11.807 -27.598 8.692 1.00 0.09 H new ATOM 0 HA GLU A 11 12.184 -30.330 8.943 1.00 0.16 H new ATOM 0 HB2 GLU A 11 12.397 -28.095 11.017 1.00 0.21 H new ATOM 0 HB3 GLU A 11 13.049 -29.706 11.244 1.00 0.21 H new ATOM 0 HG2 GLU A 11 14.602 -29.457 9.411 1.00 0.40 H new ATOM 0 HG3 GLU A 11 13.765 -28.050 8.786 1.00 0.40 H new ATOM 173 N ILE A 12 9.763 -29.174 10.882 1.00 0.14 N ATOM 174 CA ILE A 12 8.606 -29.583 11.670 1.00 0.17 C ATOM 175 C ILE A 12 7.415 -29.880 10.764 1.00 0.18 C ATOM 176 O ILE A 12 6.583 -30.732 11.076 1.00 0.28 O ATOM 177 CB ILE A 12 8.233 -28.479 12.660 1.00 0.15 C ATOM 178 CG1 ILE A 12 7.103 -28.969 13.567 1.00 0.15 C ATOM 179 CG2 ILE A 12 7.766 -27.241 11.893 1.00 0.16 C ATOM 180 CD1 ILE A 12 7.022 -28.078 14.808 1.00 0.20 C ATOM 0 H ILE A 12 9.888 -28.165 10.801 1.00 0.14 H new ATOM 0 HA ILE A 12 8.866 -30.490 12.216 1.00 0.17 H new ATOM 0 HB ILE A 12 9.104 -28.226 13.265 1.00 0.15 H new ATOM 0 HG12 ILE A 12 6.155 -28.948 13.029 1.00 0.15 H new ATOM 0 HG13 ILE A 12 7.280 -30.004 13.860 1.00 0.15 H new ATOM 0 HG21 ILE A 12 7.500 -26.454 12.599 1.00 0.16 H new ATOM 0 HG22 ILE A 12 8.569 -26.890 11.244 1.00 0.16 H new ATOM 0 HG23 ILE A 12 6.896 -27.495 11.288 1.00 0.16 H new ATOM 0 HD11 ILE A 12 6.217 -28.427 15.455 1.00 0.20 H new ATOM 0 HD12 ILE A 12 7.967 -28.122 15.350 1.00 0.20 H new ATOM 0 HD13 ILE A 12 6.824 -27.050 14.505 1.00 0.20 H new ATOM 192 N GLY A 13 7.338 -29.169 9.644 1.00 0.14 N ATOM 193 CA GLY A 13 6.243 -29.363 8.701 1.00 0.18 C ATOM 194 C GLY A 13 6.317 -30.739 8.049 1.00 0.23 C ATOM 195 O GLY A 13 5.297 -31.307 7.657 1.00 0.50 O ATOM 0 H GLY A 13 8.016 -28.458 9.368 1.00 0.14 H new ATOM 0 HA2 GLY A 13 5.290 -29.253 9.218 1.00 0.18 H new ATOM 0 HA3 GLY A 13 6.280 -28.591 7.933 1.00 0.18 H new ATOM 199 N MET A 14 7.530 -31.271 7.933 1.00 0.10 N ATOM 200 CA MET A 14 7.723 -32.581 7.323 1.00 0.11 C ATOM 201 C MET A 14 7.927 -33.649 8.393 1.00 0.13 C ATOM 202 O MET A 14 8.177 -34.814 8.081 1.00 0.27 O ATOM 203 CB MET A 14 8.936 -32.551 6.391 1.00 0.15 C ATOM 204 CG MET A 14 8.749 -31.450 5.345 1.00 0.27 C ATOM 205 SD MET A 14 7.281 -31.808 4.348 1.00 0.36 S ATOM 206 CE MET A 14 6.429 -30.235 4.625 1.00 0.45 C ATOM 0 H MET A 14 8.387 -30.819 8.251 1.00 0.10 H new ATOM 0 HA MET A 14 6.830 -32.826 6.749 1.00 0.11 H new ATOM 0 HB2 MET A 14 9.845 -32.371 6.965 1.00 0.15 H new ATOM 0 HB3 MET A 14 9.055 -33.517 5.900 1.00 0.15 H new ATOM 0 HG2 MET A 14 8.642 -30.482 5.835 1.00 0.27 H new ATOM 0 HG3 MET A 14 9.630 -31.388 4.706 1.00 0.27 H new ATOM 0 HE1 MET A 14 5.379 -30.424 4.848 1.00 0.45 H new ATOM 0 HE2 MET A 14 6.890 -29.715 5.465 1.00 0.45 H new ATOM 0 HE3 MET A 14 6.505 -29.618 3.730 1.00 0.45 H new ATOM 216 N TRP A 15 7.819 -33.247 9.655 1.00 0.10 N ATOM 217 CA TRP A 15 7.994 -34.182 10.761 1.00 0.09 C ATOM 218 C TRP A 15 6.668 -34.846 11.115 1.00 0.11 C ATOM 219 O TRP A 15 6.625 -36.034 11.437 1.00 0.21 O ATOM 220 CB TRP A 15 8.541 -33.448 11.986 1.00 0.09 C ATOM 221 CG TRP A 15 9.436 -34.366 12.755 1.00 0.15 C ATOM 222 CD1 TRP A 15 10.742 -34.589 12.479 1.00 0.26 C ATOM 223 CD2 TRP A 15 9.118 -35.186 13.917 1.00 0.16 C ATOM 224 NE1 TRP A 15 11.245 -35.493 13.397 1.00 0.30 N ATOM 225 CE2 TRP A 15 10.282 -35.890 14.304 1.00 0.23 C ATOM 226 CE3 TRP A 15 7.943 -35.384 14.665 1.00 0.22 C ATOM 227 CZ2 TRP A 15 10.281 -36.761 15.394 1.00 0.27 C ATOM 228 CZ3 TRP A 15 7.939 -36.260 15.763 1.00 0.31 C ATOM 229 CH2 TRP A 15 9.106 -36.947 16.127 1.00 0.31 C ATOM 0 H TRP A 15 7.613 -32.288 9.936 1.00 0.10 H new ATOM 0 HA TRP A 15 8.703 -34.951 10.453 1.00 0.09 H new ATOM 0 HB2 TRP A 15 9.092 -32.560 11.676 1.00 0.09 H new ATOM 0 HB3 TRP A 15 7.720 -33.109 12.618 1.00 0.09 H new ATOM 0 HD1 TRP A 15 11.300 -34.135 11.674 1.00 0.26 H new ATOM 0 HE1 TRP A 15 12.209 -35.826 13.403 1.00 0.30 H new ATOM 0 HE3 TRP A 15 7.039 -34.859 14.393 1.00 0.22 H new ATOM 0 HZ2 TRP A 15 11.183 -37.288 15.669 1.00 0.27 H new ATOM 0 HZ3 TRP A 15 7.032 -36.405 16.330 1.00 0.31 H new ATOM 0 HH2 TRP A 15 9.097 -37.619 16.973 1.00 0.31 H new ATOM 240 N TYR A 16 5.589 -34.073 11.056 1.00 0.19 N ATOM 241 CA TYR A 16 4.268 -34.599 11.375 1.00 0.21 C ATOM 242 C TYR A 16 3.187 -33.568 11.067 1.00 0.18 C ATOM 243 O TYR A 16 2.279 -33.347 11.869 1.00 0.27 O ATOM 244 CB TYR A 16 4.205 -34.987 12.855 1.00 0.25 C ATOM 245 CG TYR A 16 3.878 -33.769 13.689 1.00 0.24 C ATOM 246 CD1 TYR A 16 4.391 -32.515 13.334 1.00 0.24 C ATOM 247 CD2 TYR A 16 3.062 -33.896 14.820 1.00 0.31 C ATOM 248 CE1 TYR A 16 4.088 -31.390 14.109 1.00 0.29 C ATOM 249 CE2 TYR A 16 2.759 -32.770 15.595 1.00 0.37 C ATOM 250 CZ TYR A 16 3.272 -31.517 15.239 1.00 0.36 C ATOM 251 OH TYR A 16 2.973 -30.408 16.003 1.00 0.44 O ATOM 0 H TYR A 16 5.603 -33.088 10.792 1.00 0.19 H new ATOM 0 HA TYR A 16 4.092 -35.482 10.760 1.00 0.21 H new ATOM 0 HB2 TYR A 16 3.449 -35.757 13.007 1.00 0.25 H new ATOM 0 HB3 TYR A 16 5.159 -35.410 13.171 1.00 0.25 H new ATOM 0 HD1 TYR A 16 5.021 -32.416 12.462 1.00 0.24 H new ATOM 0 HD2 TYR A 16 2.666 -34.863 15.094 1.00 0.31 H new ATOM 0 HE1 TYR A 16 4.484 -30.423 13.835 1.00 0.29 H new ATOM 0 HE2 TYR A 16 2.130 -32.868 16.467 1.00 0.37 H new ATOM 0 HH TYR A 16 2.631 -29.695 15.424 1.00 0.44 H new ATOM 261 N ALA A 17 3.286 -32.942 9.897 1.00 0.18 N ATOM 262 CA ALA A 17 2.306 -31.940 9.495 1.00 0.21 C ATOM 263 C ALA A 17 0.893 -32.435 9.783 1.00 0.21 C ATOM 264 O ALA A 17 -0.057 -31.652 9.816 1.00 0.31 O ATOM 265 CB ALA A 17 2.450 -31.637 8.002 1.00 0.28 C ATOM 0 H ALA A 17 4.028 -33.109 9.217 1.00 0.18 H new ATOM 0 HA ALA A 17 2.486 -31.030 10.067 1.00 0.21 H new ATOM 0 HB1 ALA A 17 1.714 -30.888 7.710 1.00 0.28 H new ATOM 0 HB2 ALA A 17 3.452 -31.258 7.803 1.00 0.28 H new ATOM 0 HB3 ALA A 17 2.286 -32.549 7.428 1.00 0.28 H new ATOM 271 N LYS A 18 0.766 -33.740 9.994 1.00 0.15 N ATOM 272 CA LYS A 18 -0.533 -34.338 10.282 1.00 0.15 C ATOM 273 C LYS A 18 -1.053 -33.864 11.635 1.00 0.12 C ATOM 274 O LYS A 18 -1.971 -34.458 12.199 1.00 0.13 O ATOM 275 CB LYS A 18 -0.417 -35.865 10.289 1.00 0.16 C ATOM 276 CG LYS A 18 0.910 -36.279 10.936 1.00 0.14 C ATOM 277 CD LYS A 18 0.647 -37.284 12.061 1.00 0.17 C ATOM 278 CE LYS A 18 0.276 -36.533 13.342 1.00 0.19 C ATOM 279 NZ LYS A 18 -0.252 -37.498 14.347 1.00 0.77 N ATOM 0 H LYS A 18 1.542 -34.402 9.971 1.00 0.15 H new ATOM 0 HA LYS A 18 -1.232 -34.029 9.505 1.00 0.15 H new ATOM 0 HB2 LYS A 18 -1.252 -36.300 10.838 1.00 0.16 H new ATOM 0 HB3 LYS A 18 -0.471 -36.248 9.270 1.00 0.16 H new ATOM 0 HG2 LYS A 18 1.568 -36.721 10.188 1.00 0.14 H new ATOM 0 HG3 LYS A 18 1.422 -35.402 11.332 1.00 0.14 H new ATOM 0 HD2 LYS A 18 -0.159 -37.960 11.777 1.00 0.17 H new ATOM 0 HD3 LYS A 18 1.533 -37.897 12.230 1.00 0.17 H new ATOM 0 HE2 LYS A 18 1.150 -36.018 13.741 1.00 0.19 H new ATOM 0 HE3 LYS A 18 -0.472 -35.771 13.126 1.00 0.19 H new ATOM 0 HZ1 LYS A 18 -1.257 -37.298 14.526 1.00 0.77 H new ATOM 0 HZ2 LYS A 18 -0.151 -38.467 13.984 1.00 0.77 H new ATOM 0 HZ3 LYS A 18 0.283 -37.403 15.234 1.00 0.77 H new ATOM 293 N LYS A 19 -0.456 -32.794 12.151 1.00 0.13 N ATOM 294 CA LYS A 19 -0.864 -32.250 13.441 1.00 0.16 C ATOM 295 C LYS A 19 -0.625 -33.270 14.548 1.00 0.16 C ATOM 296 O LYS A 19 0.514 -33.522 14.937 1.00 0.22 O ATOM 297 CB LYS A 19 -2.346 -31.871 13.409 1.00 0.20 C ATOM 298 CG LYS A 19 -2.496 -30.428 12.929 1.00 0.14 C ATOM 299 CD LYS A 19 -3.982 -30.072 12.850 1.00 0.20 C ATOM 300 CE LYS A 19 -4.397 -29.935 11.384 1.00 0.30 C ATOM 301 NZ LYS A 19 -5.882 -29.840 11.295 1.00 0.52 N ATOM 0 H LYS A 19 0.307 -32.290 11.699 1.00 0.13 H new ATOM 0 HA LYS A 19 -0.268 -31.360 13.642 1.00 0.16 H new ATOM 0 HB2 LYS A 19 -2.890 -32.544 12.746 1.00 0.20 H new ATOM 0 HB3 LYS A 19 -2.782 -31.982 14.402 1.00 0.20 H new ATOM 0 HG2 LYS A 19 -1.984 -29.750 13.612 1.00 0.14 H new ATOM 0 HG3 LYS A 19 -2.029 -30.308 11.951 1.00 0.14 H new ATOM 0 HD2 LYS A 19 -4.578 -30.844 13.337 1.00 0.20 H new ATOM 0 HD3 LYS A 19 -4.172 -29.140 13.381 1.00 0.20 H new ATOM 0 HE2 LYS A 19 -3.938 -29.048 10.946 1.00 0.30 H new ATOM 0 HE3 LYS A 19 -4.042 -30.793 10.813 1.00 0.30 H new ATOM 0 HZ1 LYS A 19 -6.149 -29.433 10.376 1.00 0.52 H new ATOM 0 HZ2 LYS A 19 -6.297 -30.789 11.387 1.00 0.52 H new ATOM 0 HZ3 LYS A 19 -6.237 -29.231 12.060 1.00 0.52 H new ATOM 315 N GLN A 20 -1.707 -33.855 15.050 1.00 0.19 N ATOM 316 CA GLN A 20 -1.600 -34.848 16.110 1.00 0.18 C ATOM 317 C GLN A 20 -2.816 -35.769 16.109 1.00 0.22 C ATOM 318 O GLN A 20 -3.866 -35.330 15.670 1.00 0.25 O ATOM 319 CB GLN A 20 -1.483 -34.155 17.468 1.00 0.22 C ATOM 320 CG GLN A 20 -2.549 -33.063 17.578 1.00 0.16 C ATOM 321 CD GLN A 20 -2.658 -32.584 19.021 1.00 0.24 C ATOM 322 OE1 GLN A 20 -3.721 -32.689 19.633 1.00 0.76 O ATOM 323 NE2 GLN A 20 -1.614 -32.063 19.607 1.00 0.53 N ATOM 324 OXT GLN A 20 -2.679 -36.899 16.548 1.00 0.30 O ATOM 0 H GLN A 20 -2.660 -33.660 14.743 1.00 0.19 H new ATOM 0 HA GLN A 20 -0.706 -35.446 15.930 1.00 0.18 H new ATOM 0 HB2 GLN A 20 -1.608 -34.882 18.271 1.00 0.22 H new ATOM 0 HB3 GLN A 20 -0.490 -33.721 17.582 1.00 0.22 H new ATOM 0 HG2 GLN A 20 -2.293 -32.227 16.927 1.00 0.16 H new ATOM 0 HG3 GLN A 20 -3.511 -33.447 17.240 1.00 0.16 H new ATOM 0 HE21 GLN A 20 -0.734 -31.977 19.099 1.00 0.53 H new ATOM 0 HE22 GLN A 20 -1.678 -31.742 20.573 1.00 0.53 H new TER 333 GLN A 20 ATOM 334 O5' DT B 1 17.093 -10.658 7.801 1.00 0.74 O ATOM 335 C5' DT B 1 17.321 -11.945 7.224 1.00 0.64 C ATOM 336 C4' DT B 1 16.861 -11.991 5.768 1.00 0.49 C ATOM 337 O4' DT B 1 17.578 -11.016 5.007 1.00 0.38 O ATOM 338 C3' DT B 1 17.080 -13.348 5.089 1.00 0.43 C ATOM 339 O3' DT B 1 15.853 -13.787 4.499 1.00 0.41 O ATOM 340 C2' DT B 1 18.107 -13.071 3.995 1.00 0.33 C ATOM 341 C1' DT B 1 17.894 -11.590 3.743 1.00 0.26 C ATOM 342 N1 DT B 1 19.077 -10.888 3.210 1.00 0.21 N ATOM 343 C2 DT B 1 18.928 -10.204 2.018 1.00 0.24 C ATOM 344 O2 DT B 1 17.859 -10.172 1.412 1.00 0.30 O ATOM 345 N3 DT B 1 20.054 -9.555 1.546 1.00 0.27 N ATOM 346 C4 DT B 1 21.297 -9.533 2.154 1.00 0.26 C ATOM 347 O4 DT B 1 22.234 -8.922 1.644 1.00 0.34 O ATOM 348 C5 DT B 1 21.357 -10.274 3.394 1.00 0.20 C ATOM 349 C7 DT B 1 22.669 -10.332 4.171 1.00 0.25 C ATOM 350 C6 DT B 1 20.273 -10.915 3.875 1.00 0.20 C ATOM 0 H5' DT B 1 16.790 -12.703 7.799 1.00 0.64 H new ATOM 0 H5'' DT B 1 18.382 -12.188 7.280 1.00 0.64 H new ATOM 0 H4' DT B 1 15.789 -11.795 5.793 1.00 0.49 H new ATOM 0 H3' DT B 1 17.412 -14.118 5.785 1.00 0.43 H new ATOM 0 H2' DT B 1 19.123 -13.289 4.323 1.00 0.33 H new ATOM 0 H2'' DT B 1 17.925 -13.669 3.102 1.00 0.33 H new ATOM 0 HO5' DT B 1 17.103 -9.977 7.096 1.00 0.74 H new ATOM 0 H1' DT B 1 17.112 -11.485 2.991 1.00 0.26 H new ATOM 0 H3 DT B 1 19.960 -9.045 0.668 1.00 0.27 H new ATOM 0 H71 DT B 1 22.457 -10.428 5.236 1.00 0.25 H new ATOM 0 H72 DT B 1 23.251 -11.191 3.838 1.00 0.25 H new ATOM 0 H73 DT B 1 23.237 -9.418 3.995 1.00 0.25 H new ATOM 0 H6 DT B 1 20.350 -11.461 4.804 1.00 0.20 H new ATOM 364 P DT B 2 14.665 -14.364 5.420 1.00 0.35 P ATOM 365 OP1 DT B 2 13.422 -14.380 4.617 1.00 0.34 O ATOM 366 OP2 DT B 2 14.698 -13.652 6.717 1.00 0.44 O ATOM 367 O5' DT B 2 15.124 -15.888 5.670 1.00 0.32 O ATOM 368 C5' DT B 2 14.930 -16.879 4.656 1.00 0.31 C ATOM 369 C4' DT B 2 15.598 -18.200 5.026 1.00 0.34 C ATOM 370 O4' DT B 2 17.011 -18.013 5.128 1.00 0.46 O ATOM 371 C3' DT B 2 15.122 -18.786 6.361 1.00 0.31 C ATOM 372 O3' DT B 2 14.607 -20.104 6.146 1.00 0.42 O ATOM 373 C2' DT B 2 16.378 -18.856 7.228 1.00 0.36 C ATOM 374 C1' DT B 2 17.483 -18.834 6.188 1.00 0.44 C ATOM 375 N1 DT B 2 18.757 -18.266 6.669 1.00 0.63 N ATOM 376 C2 DT B 2 19.883 -19.063 6.586 1.00 0.76 C ATOM 377 O2 DT B 2 19.843 -20.206 6.135 1.00 0.73 O ATOM 378 N3 DT B 2 21.060 -18.500 7.043 1.00 0.96 N ATOM 379 C4 DT B 2 21.206 -17.227 7.567 1.00 1.07 C ATOM 380 O4 DT B 2 22.305 -16.826 7.945 1.00 1.28 O ATOM 381 C5 DT B 2 19.976 -16.468 7.614 1.00 0.96 C ATOM 382 C7 DT B 2 19.993 -15.046 8.167 1.00 1.11 C ATOM 383 C6 DT B 2 18.816 -16.995 7.175 1.00 0.75 C ATOM 0 H5' DT B 2 15.336 -16.518 3.711 1.00 0.31 H new ATOM 0 H5'' DT B 2 13.863 -17.040 4.504 1.00 0.31 H new ATOM 0 H4' DT B 2 15.325 -18.897 4.233 1.00 0.34 H new ATOM 0 H3' DT B 2 14.335 -18.190 6.823 1.00 0.31 H new ATOM 0 H2' DT B 2 16.447 -18.012 7.914 1.00 0.36 H new ATOM 0 H2'' DT B 2 16.406 -19.762 7.833 1.00 0.36 H new ATOM 0 H1' DT B 2 17.697 -19.863 5.900 1.00 0.44 H new ATOM 0 H3 DT B 2 21.900 -19.077 6.989 1.00 0.96 H new ATOM 0 H71 DT B 2 19.217 -14.457 7.679 1.00 1.11 H new ATOM 0 H72 DT B 2 19.808 -15.071 9.241 1.00 1.11 H new ATOM 0 H73 DT B 2 20.966 -14.593 7.977 1.00 1.11 H new ATOM 0 H6 DT B 2 17.914 -16.403 7.223 1.00 0.75 H new ATOM 396 P DG B 3 13.085 -20.315 5.666 1.00 0.44 P ATOM 397 OP1 DG B 3 12.225 -19.391 6.438 1.00 0.53 O ATOM 398 OP2 DG B 3 12.794 -21.766 5.667 1.00 0.53 O ATOM 399 O5' DG B 3 13.120 -19.811 4.138 1.00 0.43 O ATOM 400 C5' DG B 3 13.465 -20.711 3.081 1.00 0.41 C ATOM 401 C4' DG B 3 12.244 -21.464 2.560 1.00 0.34 C ATOM 402 O4' DG B 3 11.687 -22.259 3.606 1.00 0.27 O ATOM 403 C3' DG B 3 11.129 -20.550 2.040 1.00 0.38 C ATOM 404 O3' DG B 3 10.857 -20.860 0.670 1.00 0.40 O ATOM 405 C2' DG B 3 9.909 -20.889 2.897 1.00 0.41 C ATOM 406 C1' DG B 3 10.273 -22.254 3.455 1.00 0.34 C ATOM 407 N9 DG B 3 9.684 -22.542 4.775 1.00 0.34 N ATOM 408 C8 DG B 3 10.021 -22.012 5.991 1.00 0.39 C ATOM 409 N7 DG B 3 9.314 -22.473 6.984 1.00 0.37 N ATOM 410 C5 DG B 3 8.443 -23.376 6.384 1.00 0.30 C ATOM 411 C6 DG B 3 7.432 -24.188 6.966 1.00 0.27 C ATOM 412 O6 DG B 3 7.106 -24.269 8.148 1.00 0.29 O ATOM 413 N1 DG B 3 6.782 -24.955 6.009 1.00 0.23 N ATOM 414 C2 DG B 3 7.065 -24.944 4.660 1.00 0.23 C ATOM 415 N2 DG B 3 6.330 -25.752 3.896 1.00 0.22 N ATOM 416 N3 DG B 3 8.016 -24.181 4.110 1.00 0.25 N ATOM 417 C4 DG B 3 8.661 -23.425 5.030 1.00 0.29 C ATOM 0 H5' DG B 3 14.207 -21.425 3.438 1.00 0.41 H new ATOM 0 H5'' DG B 3 13.925 -20.154 2.265 1.00 0.41 H new ATOM 0 H4' DG B 3 12.604 -22.068 1.727 1.00 0.34 H new ATOM 0 H3' DG B 3 11.395 -19.495 2.099 1.00 0.38 H new ATOM 0 H2' DG B 3 9.751 -20.156 3.688 1.00 0.41 H new ATOM 0 H2'' DG B 3 8.994 -20.922 2.306 1.00 0.41 H new ATOM 0 H1' DG B 3 9.889 -23.010 2.770 1.00 0.34 H new ATOM 0 H8 DG B 3 10.803 -21.278 6.116 1.00 0.39 H new ATOM 0 H1 DG B 3 6.037 -25.575 6.329 1.00 0.23 H new ATOM 0 H21 DG B 3 6.492 -25.789 2.890 1.00 0.22 H new ATOM 0 H22 DG B 3 5.606 -26.334 4.318 1.00 0.22 H new ATOM 429 P DG B 4 9.780 -19.998 -0.162 1.00 0.42 P ATOM 430 OP1 DG B 4 10.008 -20.238 -1.605 1.00 0.49 O ATOM 431 OP2 DG B 4 9.788 -18.615 0.365 1.00 0.48 O ATOM 432 O5' DG B 4 8.383 -20.685 0.248 1.00 0.32 O ATOM 433 C5' DG B 4 7.998 -21.939 -0.321 1.00 0.30 C ATOM 434 C4' DG B 4 6.590 -22.344 0.108 1.00 0.21 C ATOM 435 O4' DG B 4 6.554 -22.551 1.517 1.00 0.21 O ATOM 436 C3' DG B 4 5.516 -21.299 -0.214 1.00 0.18 C ATOM 437 O3' DG B 4 4.624 -21.826 -1.202 1.00 0.18 O ATOM 438 C2' DG B 4 4.764 -21.082 1.103 1.00 0.22 C ATOM 439 C1' DG B 4 5.235 -22.254 1.951 1.00 0.22 C ATOM 440 N9 DG B 4 5.286 -21.975 3.399 1.00 0.25 N ATOM 441 C8 DG B 4 6.096 -21.101 4.076 1.00 0.30 C ATOM 442 N7 DG B 4 5.905 -21.090 5.365 1.00 0.33 N ATOM 443 C5 DG B 4 4.893 -22.025 5.561 1.00 0.28 C ATOM 444 C6 DG B 4 4.263 -22.444 6.764 1.00 0.29 C ATOM 445 O6 DG B 4 4.482 -22.064 7.912 1.00 0.35 O ATOM 446 N1 DG B 4 3.291 -23.405 6.521 1.00 0.25 N ATOM 447 C2 DG B 4 2.964 -23.903 5.277 1.00 0.21 C ATOM 448 N2 DG B 4 2.000 -24.824 5.243 1.00 0.22 N ATOM 449 N3 DG B 4 3.556 -23.510 4.144 1.00 0.21 N ATOM 450 C4 DG B 4 4.507 -22.572 4.362 1.00 0.23 C ATOM 0 H5' DG B 4 8.707 -22.709 -0.018 1.00 0.30 H new ATOM 0 H5'' DG B 4 8.043 -21.875 -1.408 1.00 0.30 H new ATOM 0 H4' DG B 4 6.368 -23.251 -0.455 1.00 0.21 H new ATOM 0 H3' DG B 4 5.938 -20.372 -0.602 1.00 0.18 H new ATOM 0 H2' DG B 4 5.015 -20.125 1.560 1.00 0.22 H new ATOM 0 H2'' DG B 4 3.684 -21.094 0.960 1.00 0.22 H new ATOM 0 H1' DG B 4 4.524 -23.070 1.822 1.00 0.22 H new ATOM 0 H8 DG B 4 6.828 -20.477 3.585 1.00 0.30 H new ATOM 0 H1 DG B 4 2.779 -23.771 7.324 1.00 0.25 H new ATOM 0 H21 DG B 4 1.714 -25.230 4.352 1.00 0.22 H new ATOM 0 H22 DG B 4 1.549 -25.122 6.108 1.00 0.22 H new ATOM 462 P DG B 5 3.267 -21.046 -1.582 1.00 0.20 P ATOM 463 OP1 DG B 5 2.921 -21.371 -2.984 1.00 0.28 O ATOM 464 OP2 DG B 5 3.414 -19.633 -1.167 1.00 0.22 O ATOM 465 O5' DG B 5 2.181 -21.744 -0.619 1.00 0.21 O ATOM 466 C5' DG B 5 1.906 -23.142 -0.734 1.00 0.23 C ATOM 467 C4' DG B 5 0.758 -23.568 0.177 1.00 0.29 C ATOM 468 O4' DG B 5 1.075 -23.239 1.534 1.00 0.31 O ATOM 469 C3' DG B 5 -0.579 -22.897 -0.152 1.00 0.33 C ATOM 470 O3' DG B 5 -1.606 -23.892 -0.201 1.00 0.35 O ATOM 471 C2' DG B 5 -0.829 -21.955 1.020 1.00 0.37 C ATOM 472 C1' DG B 5 -0.080 -22.660 2.135 1.00 0.34 C ATOM 473 N9 DG B 5 0.376 -21.773 3.221 1.00 0.34 N ATOM 474 C8 DG B 5 1.246 -20.716 3.158 1.00 0.35 C ATOM 475 N7 DG B 5 1.467 -20.143 4.307 1.00 0.34 N ATOM 476 C5 DG B 5 0.687 -20.871 5.200 1.00 0.34 C ATOM 477 C6 DG B 5 0.520 -20.711 6.602 1.00 0.34 C ATOM 478 O6 DG B 5 1.043 -19.880 7.342 1.00 0.34 O ATOM 479 N1 DG B 5 -0.358 -21.654 7.121 1.00 0.34 N ATOM 480 C2 DG B 5 -0.996 -22.630 6.383 1.00 0.35 C ATOM 481 N2 DG B 5 -1.806 -23.447 7.057 1.00 0.37 N ATOM 482 N3 DG B 5 -0.838 -22.782 5.065 1.00 0.35 N ATOM 483 C4 DG B 5 0.015 -21.870 4.543 1.00 0.34 C ATOM 0 H5' DG B 5 2.801 -23.711 -0.482 1.00 0.23 H new ATOM 0 H5'' DG B 5 1.658 -23.380 -1.768 1.00 0.23 H new ATOM 0 H4' DG B 5 0.644 -24.641 0.023 1.00 0.29 H new ATOM 0 H3' DG B 5 -0.570 -22.377 -1.110 1.00 0.33 H new ATOM 0 H2' DG B 5 -0.440 -20.954 0.833 1.00 0.37 H new ATOM 0 H2'' DG B 5 -1.891 -21.848 1.242 1.00 0.37 H new ATOM 0 H1' DG B 5 -0.761 -23.378 2.592 1.00 0.34 H new ATOM 0 H8 DG B 5 1.707 -20.387 2.238 1.00 0.35 H new ATOM 0 H1 DG B 5 -0.545 -21.623 8.123 1.00 0.34 H new ATOM 0 H21 DG B 5 -2.306 -24.189 6.566 1.00 0.37 H new ATOM 0 H22 DG B 5 -1.926 -23.330 8.063 1.00 0.37 H new ATOM 495 P DT B 6 -1.537 -25.083 -1.284 1.00 0.40 P ATOM 496 OP1 DT B 6 -1.522 -24.480 -2.635 1.00 0.49 O ATOM 497 OP2 DT B 6 -2.568 -26.087 -0.935 1.00 0.62 O ATOM 498 O5' DT B 6 -0.089 -25.729 -1.003 1.00 0.35 O ATOM 499 C5' DT B 6 0.845 -25.907 -2.073 1.00 0.28 C ATOM 500 C4' DT B 6 0.648 -27.249 -2.775 1.00 0.28 C ATOM 501 O4' DT B 6 1.516 -27.330 -3.906 1.00 0.35 O ATOM 502 C3' DT B 6 0.949 -28.465 -1.888 1.00 0.23 C ATOM 503 O3' DT B 6 -0.211 -29.303 -1.822 1.00 0.30 O ATOM 504 C2' DT B 6 2.078 -29.203 -2.608 1.00 0.37 C ATOM 505 C1' DT B 6 1.942 -28.680 -4.027 1.00 0.43 C ATOM 506 N1 DT B 6 3.197 -28.696 -4.803 1.00 0.51 N ATOM 507 C2 DT B 6 3.193 -29.379 -6.005 1.00 0.70 C ATOM 508 O2 DT B 6 2.194 -29.957 -6.425 1.00 0.80 O ATOM 509 N3 DT B 6 4.384 -29.376 -6.707 1.00 0.80 N ATOM 510 C4 DT B 6 5.560 -28.757 -6.317 1.00 0.77 C ATOM 511 O4 DT B 6 6.565 -28.819 -7.022 1.00 0.88 O ATOM 512 C5 DT B 6 5.467 -28.068 -5.050 1.00 0.61 C ATOM 513 C7 DT B 6 6.691 -27.342 -4.500 1.00 0.66 C ATOM 514 C6 DT B 6 4.318 -28.056 -4.346 1.00 0.48 C ATOM 0 H5' DT B 6 1.861 -25.845 -1.684 1.00 0.28 H new ATOM 0 H5'' DT B 6 0.731 -25.098 -2.795 1.00 0.28 H new ATOM 0 H4' DT B 6 -0.406 -27.283 -3.052 1.00 0.28 H new ATOM 0 H3' DT B 6 1.220 -28.185 -0.870 1.00 0.23 H new ATOM 0 H2' DT B 6 3.054 -28.973 -2.180 1.00 0.37 H new ATOM 0 H2'' DT B 6 1.955 -30.285 -2.558 1.00 0.37 H new ATOM 0 H1' DT B 6 1.247 -29.326 -4.563 1.00 0.43 H new ATOM 0 H3 DT B 6 4.398 -29.877 -7.596 1.00 0.80 H new ATOM 0 H71 DT B 6 6.370 -26.492 -3.898 1.00 0.66 H new ATOM 0 H72 DT B 6 7.272 -28.026 -3.882 1.00 0.66 H new ATOM 0 H73 DT B 6 7.307 -26.989 -5.327 1.00 0.66 H new ATOM 0 H6 DT B 6 4.281 -27.531 -3.403 1.00 0.48 H new ATOM 527 P DG B 7 -0.184 -30.685 -0.991 1.00 0.26 P ATOM 528 OP1 DG B 7 1.172 -31.266 -1.099 1.00 0.30 O ATOM 529 OP2 DG B 7 -1.362 -31.488 -1.388 1.00 0.33 O ATOM 530 O5' DG B 7 -0.399 -30.196 0.529 1.00 0.23 O ATOM 531 C5' DG B 7 0.718 -29.799 1.331 1.00 0.19 C ATOM 532 C4' DG B 7 0.455 -30.038 2.814 1.00 0.16 C ATOM 533 O4' DG B 7 1.632 -29.740 3.558 1.00 0.16 O ATOM 534 C3' DG B 7 -0.673 -29.177 3.391 1.00 0.17 C ATOM 535 O3' DG B 7 -1.750 -30.023 3.807 1.00 0.22 O ATOM 536 C2' DG B 7 -0.061 -28.481 4.610 1.00 0.15 C ATOM 537 C1' DG B 7 1.230 -29.257 4.830 1.00 0.15 C ATOM 538 N9 DG B 7 2.339 -28.446 5.365 1.00 0.15 N ATOM 539 C8 DG B 7 3.342 -27.813 4.680 1.00 0.19 C ATOM 540 N7 DG B 7 4.179 -27.168 5.444 1.00 0.20 N ATOM 541 C5 DG B 7 3.697 -27.391 6.730 1.00 0.16 C ATOM 542 C6 DG B 7 4.197 -26.938 7.981 1.00 0.17 C ATOM 543 O6 DG B 7 5.183 -26.237 8.200 1.00 0.21 O ATOM 544 N1 DG B 7 3.414 -27.389 9.036 1.00 0.16 N ATOM 545 C2 DG B 7 2.290 -28.177 8.906 1.00 0.16 C ATOM 546 N2 DG B 7 1.668 -28.510 10.037 1.00 0.21 N ATOM 547 N3 DG B 7 1.818 -28.604 7.731 1.00 0.14 N ATOM 548 C4 DG B 7 2.570 -28.174 6.691 1.00 0.13 C ATOM 0 H5' DG B 7 0.930 -28.743 1.164 1.00 0.19 H new ATOM 0 H5'' DG B 7 1.604 -30.355 1.023 1.00 0.19 H new ATOM 0 H4' DG B 7 0.159 -31.084 2.897 1.00 0.16 H new ATOM 0 H3' DG B 7 -1.065 -28.464 2.666 1.00 0.17 H new ATOM 0 H2' DG B 7 0.130 -27.425 4.419 1.00 0.15 H new ATOM 0 H2'' DG B 7 -0.718 -28.535 5.478 1.00 0.15 H new ATOM 0 H1' DG B 7 1.027 -30.036 5.565 1.00 0.15 H new ATOM 0 H8 DG B 7 3.432 -27.845 3.604 1.00 0.19 H new ATOM 0 H1 DG B 7 3.692 -27.116 9.979 1.00 0.16 H new ATOM 0 H21 DG B 7 0.831 -29.091 10.006 1.00 0.21 H new ATOM 0 H22 DG B 7 2.030 -28.183 10.933 1.00 0.21 H new ATOM 560 P DG B 8 -3.231 -29.419 4.001 1.00 0.31 P ATOM 561 OP1 DG B 8 -4.198 -30.537 3.945 1.00 0.39 O ATOM 562 OP2 DG B 8 -3.383 -28.267 3.084 1.00 0.34 O ATOM 563 O5' DG B 8 -3.193 -28.860 5.510 1.00 0.31 O ATOM 564 C5' DG B 8 -3.501 -29.721 6.610 1.00 0.32 C ATOM 565 C4' DG B 8 -3.531 -28.956 7.930 1.00 0.31 C ATOM 566 O4' DG B 8 -2.244 -28.397 8.192 1.00 0.29 O ATOM 567 C3' DG B 8 -4.538 -27.800 7.956 1.00 0.30 C ATOM 568 O3' DG B 8 -5.483 -28.015 9.009 1.00 0.37 O ATOM 569 C2' DG B 8 -3.702 -26.556 8.259 1.00 0.27 C ATOM 570 C1' DG B 8 -2.443 -27.157 8.857 1.00 0.25 C ATOM 571 N9 DG B 8 -1.230 -26.340 8.667 1.00 0.20 N ATOM 572 C8 DG B 8 -0.607 -25.985 7.499 1.00 0.19 C ATOM 573 N7 DG B 8 0.456 -25.250 7.668 1.00 0.23 N ATOM 574 C5 DG B 8 0.546 -25.104 9.049 1.00 0.23 C ATOM 575 C6 DG B 8 1.504 -24.402 9.830 1.00 0.29 C ATOM 576 O6 DG B 8 2.479 -23.759 9.445 1.00 0.37 O ATOM 577 N1 DG B 8 1.229 -24.508 11.188 1.00 0.28 N ATOM 578 C2 DG B 8 0.166 -25.201 11.728 1.00 0.26 C ATOM 579 N2 DG B 8 0.064 -25.190 13.057 1.00 0.31 N ATOM 580 N3 DG B 8 -0.735 -25.861 10.995 1.00 0.25 N ATOM 581 C4 DG B 8 -0.482 -25.769 9.669 1.00 0.21 C ATOM 0 H5' DG B 8 -2.760 -30.518 6.667 1.00 0.32 H new ATOM 0 H5'' DG B 8 -4.468 -30.196 6.442 1.00 0.32 H new ATOM 0 H4' DG B 8 -3.831 -29.685 8.682 1.00 0.31 H new ATOM 0 H3' DG B 8 -5.091 -27.708 7.022 1.00 0.30 H new ATOM 0 H2' DG B 8 -3.490 -25.978 7.359 1.00 0.27 H new ATOM 0 H2'' DG B 8 -4.205 -25.887 8.957 1.00 0.27 H new ATOM 0 H1' DG B 8 -2.588 -27.241 9.934 1.00 0.25 H new ATOM 0 H8 DG B 8 -0.965 -26.287 6.526 1.00 0.19 H new ATOM 0 H1 DG B 8 1.862 -24.037 11.835 1.00 0.28 H new ATOM 0 H21 DG B 8 -0.702 -25.685 13.514 1.00 0.31 H new ATOM 0 H22 DG B 8 0.752 -24.686 13.617 1.00 0.31 H new ATOM 593 P DG B 9 -6.617 -26.917 9.327 1.00 0.42 P ATOM 594 OP1 DG B 9 -7.774 -27.609 9.937 1.00 0.52 O ATOM 595 OP2 DG B 9 -6.808 -26.086 8.117 1.00 0.47 O ATOM 596 O5' DG B 9 -5.921 -26.006 10.458 1.00 0.39 O ATOM 597 C5' DG B 9 -5.760 -26.502 11.790 1.00 0.33 C ATOM 598 C4' DG B 9 -5.297 -25.408 12.747 1.00 0.31 C ATOM 599 O4' DG B 9 -4.028 -24.900 12.321 1.00 0.32 O ATOM 600 C3' DG B 9 -6.256 -24.211 12.834 1.00 0.34 C ATOM 601 O3' DG B 9 -6.538 -23.920 14.207 1.00 0.37 O ATOM 602 C2' DG B 9 -5.477 -23.056 12.216 1.00 0.33 C ATOM 603 C1' DG B 9 -4.046 -23.486 12.480 1.00 0.29 C ATOM 604 N9 DG B 9 -3.054 -22.907 11.552 1.00 0.30 N ATOM 605 C8 DG B 9 -3.017 -22.968 10.181 1.00 0.36 C ATOM 606 N7 DG B 9 -2.000 -22.346 9.653 1.00 0.39 N ATOM 607 C5 DG B 9 -1.312 -21.835 10.749 1.00 0.35 C ATOM 608 C6 DG B 9 -0.118 -21.064 10.796 1.00 0.37 C ATOM 609 O6 DG B 9 0.575 -20.675 9.859 1.00 0.43 O ATOM 610 N1 DG B 9 0.237 -20.755 12.103 1.00 0.33 N ATOM 611 C2 DG B 9 -0.468 -21.139 13.226 1.00 0.29 C ATOM 612 N2 DG B 9 0.028 -20.748 14.399 1.00 0.30 N ATOM 613 N3 DG B 9 -1.590 -21.864 13.182 1.00 0.27 N ATOM 614 C4 DG B 9 -1.950 -22.174 11.916 1.00 0.30 C ATOM 0 H5' DG B 9 -5.035 -27.316 11.790 1.00 0.33 H new ATOM 0 H5'' DG B 9 -6.705 -26.916 12.141 1.00 0.33 H new ATOM 0 H4' DG B 9 -5.250 -25.879 13.729 1.00 0.31 H new ATOM 0 H3' DG B 9 -7.205 -24.395 12.331 1.00 0.34 H new ATOM 0 H2' DG B 9 -5.683 -22.945 11.151 1.00 0.33 H new ATOM 0 H2'' DG B 9 -5.713 -22.102 12.688 1.00 0.33 H new ATOM 0 H1' DG B 9 -3.765 -23.140 13.475 1.00 0.29 H new ATOM 0 H8 DG B 9 -3.762 -23.484 9.594 1.00 0.36 H new ATOM 0 H1 DG B 9 1.083 -20.202 12.244 1.00 0.33 H new ATOM 0 H21 DG B 9 -0.449 -21.001 15.264 1.00 0.30 H new ATOM 0 H22 DG B 9 0.885 -20.195 14.432 1.00 0.30 H new ATOM 626 P DT B 10 -7.069 -25.074 15.194 1.00 0.40 P ATOM 627 OP1 DT B 10 -8.236 -25.728 14.560 1.00 0.48 O ATOM 628 OP2 DT B 10 -7.191 -24.501 16.554 1.00 0.48 O ATOM 629 O5' DT B 10 -5.842 -26.115 15.191 1.00 0.42 O ATOM 630 C5' DT B 10 -6.032 -27.466 15.616 1.00 0.39 C ATOM 631 C4' DT B 10 -6.189 -27.563 17.130 1.00 0.36 C ATOM 632 O4' DT B 10 -7.327 -26.807 17.546 1.00 0.34 O ATOM 633 C3' DT B 10 -6.386 -28.995 17.637 1.00 0.38 C ATOM 634 O3' DT B 10 -5.403 -29.287 18.635 1.00 0.41 O ATOM 635 C2' DT B 10 -7.776 -28.996 18.267 1.00 0.42 C ATOM 636 C1' DT B 10 -7.968 -27.526 18.592 1.00 0.38 C ATOM 637 N1 DT B 10 -9.378 -27.092 18.646 1.00 0.38 N ATOM 638 C2 DT B 10 -9.813 -26.487 19.810 1.00 0.40 C ATOM 639 O2 DT B 10 -9.070 -26.312 20.773 1.00 0.42 O ATOM 640 N3 DT B 10 -11.137 -26.090 19.829 1.00 0.44 N ATOM 641 C4 DT B 10 -12.049 -26.244 18.799 1.00 0.44 C ATOM 642 O4 DT B 10 -13.207 -25.853 18.923 1.00 0.48 O ATOM 643 C5 DT B 10 -11.504 -26.886 17.624 1.00 0.42 C ATOM 644 C7 DT B 10 -12.401 -27.118 16.412 1.00 0.46 C ATOM 645 C6 DT B 10 -10.216 -27.282 17.581 1.00 0.41 C ATOM 0 H5' DT B 10 -5.182 -28.071 15.299 1.00 0.39 H new ATOM 0 H5'' DT B 10 -6.916 -27.879 15.131 1.00 0.39 H new ATOM 0 H4' DT B 10 -5.260 -27.177 17.549 1.00 0.36 H new ATOM 0 H3' DT B 10 -6.289 -29.737 16.845 1.00 0.38 H new ATOM 0 H2' DT B 10 -8.537 -29.366 17.579 1.00 0.42 H new ATOM 0 H2'' DT B 10 -7.821 -29.622 19.159 1.00 0.42 H new ATOM 0 H1' DT B 10 -7.557 -27.342 19.585 1.00 0.38 H new ATOM 0 H3 DT B 10 -11.473 -25.642 20.681 1.00 0.44 H new ATOM 0 H71 DT B 10 -11.799 -27.092 15.504 1.00 0.46 H new ATOM 0 H72 DT B 10 -12.885 -28.091 16.499 1.00 0.46 H new ATOM 0 H73 DT B 10 -13.160 -26.337 16.367 1.00 0.46 H new ATOM 0 H6 DT B 10 -9.838 -27.759 16.688 1.00 0.41 H new ATOM 658 P DG B 11 -3.956 -29.855 18.213 1.00 0.38 P ATOM 659 OP1 DG B 11 -4.153 -31.119 17.470 1.00 0.41 O ATOM 660 OP2 DG B 11 -3.081 -29.828 19.407 1.00 0.47 O ATOM 661 O5' DG B 11 -3.432 -28.739 17.178 1.00 0.34 O ATOM 662 C5' DG B 11 -2.326 -29.013 16.315 1.00 0.33 C ATOM 663 C4' DG B 11 -0.999 -28.613 16.953 1.00 0.30 C ATOM 664 O4' DG B 11 0.066 -28.932 16.060 1.00 0.30 O ATOM 665 C3' DG B 11 -0.893 -27.118 17.274 1.00 0.31 C ATOM 666 O3' DG B 11 -0.655 -26.944 18.676 1.00 0.35 O ATOM 667 C2' DG B 11 0.317 -26.626 16.483 1.00 0.25 C ATOM 668 C1' DG B 11 1.055 -27.917 16.167 1.00 0.25 C ATOM 669 N9 DG B 11 1.797 -27.883 14.897 1.00 0.22 N ATOM 670 C8 DG B 11 1.599 -28.634 13.769 1.00 0.22 C ATOM 671 N7 DG B 11 2.414 -28.347 12.792 1.00 0.22 N ATOM 672 C5 DG B 11 3.212 -27.332 13.312 1.00 0.21 C ATOM 673 C6 DG B 11 4.283 -26.617 12.710 1.00 0.21 C ATOM 674 O6 DG B 11 4.741 -26.741 11.576 1.00 0.24 O ATOM 675 N1 DG B 11 4.820 -25.678 13.581 1.00 0.20 N ATOM 676 C2 DG B 11 4.383 -25.453 14.869 1.00 0.19 C ATOM 677 N2 DG B 11 5.025 -24.508 15.555 1.00 0.20 N ATOM 678 N3 DG B 11 3.377 -26.123 15.435 1.00 0.21 N ATOM 679 C4 DG B 11 2.841 -27.044 14.601 1.00 0.20 C ATOM 0 H5' DG B 11 -2.455 -28.475 15.376 1.00 0.33 H new ATOM 0 H5'' DG B 11 -2.308 -30.076 16.073 1.00 0.33 H new ATOM 0 H4' DG B 11 -0.939 -29.163 17.892 1.00 0.30 H new ATOM 0 H3' DG B 11 -1.802 -26.574 17.017 1.00 0.31 H new ATOM 0 H2' DG B 11 0.021 -26.096 15.577 1.00 0.25 H new ATOM 0 H2'' DG B 11 0.931 -25.941 17.067 1.00 0.25 H new ATOM 0 H1' DG B 11 1.787 -28.088 16.957 1.00 0.25 H new ATOM 0 H8 DG B 11 0.837 -29.395 13.695 1.00 0.22 H new ATOM 0 H1 DG B 11 5.597 -25.111 13.242 1.00 0.20 H new ATOM 0 H21 DG B 11 4.747 -24.296 16.513 1.00 0.20 H new ATOM 0 H22 DG B 11 5.794 -23.997 15.122 1.00 0.20 H new ATOM 691 P DG B 12 -1.026 -25.553 19.399 1.00 0.39 P ATOM 692 OP1 DG B 12 -0.929 -25.751 20.862 1.00 0.48 O ATOM 693 OP2 DG B 12 -2.284 -25.046 18.807 1.00 0.47 O ATOM 694 O5' DG B 12 0.173 -24.577 18.943 1.00 0.34 O ATOM 695 C5' DG B 12 1.326 -24.405 19.772 1.00 0.29 C ATOM 696 C4' DG B 12 2.187 -23.233 19.305 1.00 0.24 C ATOM 697 O4' DG B 12 2.624 -23.459 17.965 1.00 0.23 O ATOM 698 C3' DG B 12 1.458 -21.883 19.320 1.00 0.20 C ATOM 699 O3' DG B 12 2.159 -20.974 20.176 1.00 0.25 O ATOM 700 C2' DG B 12 1.522 -21.386 17.876 1.00 0.22 C ATOM 701 C1' DG B 12 2.673 -22.199 17.309 1.00 0.22 C ATOM 702 N9 DG B 12 2.588 -22.441 15.854 1.00 0.22 N ATOM 703 C8 DG B 12 1.674 -23.194 15.159 1.00 0.26 C ATOM 704 N7 DG B 12 1.876 -23.212 13.872 1.00 0.26 N ATOM 705 C5 DG B 12 3.003 -22.415 13.696 1.00 0.24 C ATOM 706 C6 DG B 12 3.693 -22.066 12.503 1.00 0.25 C ATOM 707 O6 DG B 12 3.437 -22.402 11.349 1.00 0.26 O ATOM 708 N1 DG B 12 4.778 -21.242 12.766 1.00 0.31 N ATOM 709 C2 DG B 12 5.156 -20.806 14.020 1.00 0.33 C ATOM 710 N2 DG B 12 6.229 -20.017 14.073 1.00 0.40 N ATOM 711 N3 DG B 12 4.508 -21.134 15.142 1.00 0.27 N ATOM 712 C4 DG B 12 3.446 -21.938 14.905 1.00 0.24 C ATOM 0 H5' DG B 12 1.920 -25.319 19.764 1.00 0.29 H new ATOM 0 H5'' DG B 12 1.012 -24.238 20.802 1.00 0.29 H new ATOM 0 H4' DG B 12 3.016 -23.181 20.010 1.00 0.24 H new ATOM 0 H3' DG B 12 0.433 -21.965 19.683 1.00 0.20 H new ATOM 0 H2' DG B 12 0.591 -21.570 17.340 1.00 0.22 H new ATOM 0 H2'' DG B 12 1.715 -20.315 17.822 1.00 0.22 H new ATOM 0 H1' DG B 12 3.595 -21.640 17.472 1.00 0.22 H new ATOM 0 H8 DG B 12 0.862 -23.723 15.636 1.00 0.26 H new ATOM 0 H1 DG B 12 5.339 -20.935 11.972 1.00 0.31 H new ATOM 0 H21 DG B 12 6.558 -19.663 14.971 1.00 0.40 H new ATOM 0 H22 DG B 12 6.722 -19.768 13.215 1.00 0.40 H new ATOM 724 P DG B 13 1.649 -19.456 20.348 1.00 0.27 P ATOM 725 OP1 DG B 13 1.979 -19.008 21.719 1.00 0.32 O ATOM 726 OP2 DG B 13 0.253 -19.378 19.862 1.00 0.27 O ATOM 727 O5' DG B 13 2.586 -18.647 19.316 1.00 0.28 O ATOM 728 C5' DG B 13 3.959 -18.393 19.629 1.00 0.27 C ATOM 729 C4' DG B 13 4.586 -17.410 18.644 1.00 0.28 C ATOM 730 O4' DG B 13 4.534 -17.954 17.321 1.00 0.29 O ATOM 731 C3' DG B 13 3.889 -16.046 18.601 1.00 0.30 C ATOM 732 O3' DG B 13 4.867 -15.004 18.691 1.00 0.36 O ATOM 733 C2' DG B 13 3.220 -16.005 17.233 1.00 0.27 C ATOM 734 C1' DG B 13 4.123 -16.921 16.430 1.00 0.26 C ATOM 735 N9 DG B 13 3.467 -17.556 15.272 1.00 0.24 N ATOM 736 C8 DG B 13 2.350 -18.350 15.249 1.00 0.22 C ATOM 737 N7 DG B 13 2.020 -18.764 14.058 1.00 0.22 N ATOM 738 C5 DG B 13 2.987 -18.206 13.229 1.00 0.24 C ATOM 739 C6 DG B 13 3.144 -18.309 11.821 1.00 0.27 C ATOM 740 O6 DG B 13 2.446 -18.927 11.019 1.00 0.26 O ATOM 741 N1 DG B 13 4.250 -17.593 11.379 1.00 0.31 N ATOM 742 C2 DG B 13 5.098 -16.868 12.191 1.00 0.33 C ATOM 743 N2 DG B 13 6.108 -16.244 11.584 1.00 0.39 N ATOM 744 N3 DG B 13 4.951 -16.772 13.516 1.00 0.31 N ATOM 745 C4 DG B 13 3.878 -17.464 13.963 1.00 0.26 C ATOM 0 H5' DG B 13 4.516 -19.330 19.614 1.00 0.27 H new ATOM 0 H5'' DG B 13 4.035 -17.994 20.640 1.00 0.27 H new ATOM 0 H4' DG B 13 5.608 -17.258 18.992 1.00 0.28 H new ATOM 0 H3' DG B 13 3.181 -15.909 19.419 1.00 0.30 H new ATOM 0 H2' DG B 13 2.193 -16.368 17.267 1.00 0.27 H new ATOM 0 H2'' DG B 13 3.188 -14.996 16.822 1.00 0.27 H new ATOM 0 H1' DG B 13 4.940 -16.322 16.028 1.00 0.26 H new ATOM 0 H8 DG B 13 1.794 -18.609 16.138 1.00 0.22 H new ATOM 0 H1 DG B 13 4.450 -17.604 10.379 1.00 0.31 H new ATOM 0 H21 DG B 13 6.769 -15.692 12.131 1.00 0.39 H new ATOM 0 H22 DG B 13 6.220 -16.319 10.573 1.00 0.39 H new ATOM 757 P DT B 14 5.449 -14.546 20.121 1.00 0.43 P ATOM 758 OP1 DT B 14 4.365 -14.668 21.121 1.00 0.58 O ATOM 759 OP2 DT B 14 6.146 -13.253 19.943 1.00 0.59 O ATOM 760 O5' DT B 14 6.554 -15.674 20.436 1.00 0.28 O ATOM 761 C5' DT B 14 7.274 -15.651 21.673 1.00 0.26 C ATOM 762 C4' DT B 14 8.360 -16.723 21.718 1.00 0.24 C ATOM 763 O4' DT B 14 9.028 -16.666 22.981 1.00 0.35 O ATOM 764 C3' DT B 14 7.830 -18.150 21.543 1.00 0.30 C ATOM 765 O3' DT B 14 8.553 -18.802 20.490 1.00 0.33 O ATOM 766 C2' DT B 14 8.118 -18.839 22.874 1.00 0.37 C ATOM 767 C1' DT B 14 9.253 -17.997 23.433 1.00 0.38 C ATOM 768 N1 DT B 14 9.315 -17.966 24.907 1.00 0.44 N ATOM 769 C2 DT B 14 10.442 -18.493 25.508 1.00 0.63 C ATOM 770 O2 DT B 14 11.365 -18.977 24.857 1.00 0.76 O ATOM 771 N3 DT B 14 10.471 -18.445 26.890 1.00 0.70 N ATOM 772 C4 DT B 14 9.485 -17.922 27.708 1.00 0.60 C ATOM 773 O4 DT B 14 9.615 -17.931 28.930 1.00 0.70 O ATOM 774 C5 DT B 14 8.346 -17.394 26.991 1.00 0.47 C ATOM 775 C7 DT B 14 7.186 -16.785 27.771 1.00 0.52 C ATOM 776 C6 DT B 14 8.294 -17.430 25.644 1.00 0.40 C ATOM 0 H5' DT B 14 6.580 -15.802 22.500 1.00 0.26 H new ATOM 0 H5'' DT B 14 7.727 -14.669 21.812 1.00 0.26 H new ATOM 0 H4' DT B 14 9.027 -16.509 20.883 1.00 0.24 H new ATOM 0 H3' DT B 14 6.771 -18.176 21.286 1.00 0.30 H new ATOM 0 H2' DT B 14 7.248 -18.836 23.530 1.00 0.37 H new ATOM 0 H2'' DT B 14 8.412 -19.880 22.738 1.00 0.37 H new ATOM 0 H1' DT B 14 10.191 -18.434 23.092 1.00 0.38 H new ATOM 0 H3 DT B 14 11.296 -18.831 27.349 1.00 0.70 H new ATOM 0 H71 DT B 14 6.713 -16.007 27.172 1.00 0.52 H new ATOM 0 H72 DT B 14 6.455 -17.560 28.001 1.00 0.52 H new ATOM 0 H73 DT B 14 7.559 -16.352 28.699 1.00 0.52 H new ATOM 0 H6 DT B 14 7.429 -17.028 25.137 1.00 0.40 H new ATOM 789 P DG B 15 10.116 -19.152 20.658 1.00 0.32 P ATOM 790 OP1 DG B 15 10.227 -20.532 21.182 1.00 0.42 O ATOM 791 OP2 DG B 15 10.767 -18.036 21.380 1.00 0.49 O ATOM 792 O5' DG B 15 10.647 -19.146 19.137 1.00 0.34 O ATOM 793 C5' DG B 15 10.350 -20.233 18.257 1.00 0.28 C ATOM 794 C4' DG B 15 10.762 -19.920 16.821 1.00 0.29 C ATOM 795 O4' DG B 15 10.461 -21.042 15.979 1.00 0.26 O ATOM 796 C3' DG B 15 10.042 -18.707 16.224 1.00 0.30 C ATOM 797 O3' DG B 15 10.965 -17.927 15.455 1.00 0.35 O ATOM 798 C2' DG B 15 9.005 -19.323 15.300 1.00 0.25 C ATOM 799 C1' DG B 15 9.739 -20.567 14.843 1.00 0.25 C ATOM 800 N9 DG B 15 8.860 -21.650 14.369 1.00 0.23 N ATOM 801 C8 DG B 15 8.024 -22.458 15.093 1.00 0.26 C ATOM 802 N7 DG B 15 7.368 -23.322 14.370 1.00 0.27 N ATOM 803 C5 DG B 15 7.800 -23.069 13.071 1.00 0.24 C ATOM 804 C6 DG B 15 7.432 -23.696 11.849 1.00 0.26 C ATOM 805 O6 DG B 15 6.636 -24.614 11.672 1.00 0.29 O ATOM 806 N1 DG B 15 8.103 -23.137 10.770 1.00 0.26 N ATOM 807 C2 DG B 15 9.013 -22.105 10.852 1.00 0.28 C ATOM 808 N2 DG B 15 9.555 -21.703 9.703 1.00 0.33 N ATOM 809 N3 DG B 15 9.358 -21.514 11.999 1.00 0.26 N ATOM 810 C4 DG B 15 8.714 -22.046 13.063 1.00 0.23 C ATOM 0 H5' DG B 15 9.282 -20.449 18.291 1.00 0.28 H new ATOM 0 H5'' DG B 15 10.867 -21.130 18.598 1.00 0.28 H new ATOM 0 H4' DG B 15 11.829 -19.701 16.861 1.00 0.29 H new ATOM 0 H3' DG B 15 9.609 -18.053 16.981 1.00 0.30 H new ATOM 0 H2' DG B 15 8.076 -19.558 15.819 1.00 0.25 H new ATOM 0 H2'' DG B 15 8.748 -18.665 14.469 1.00 0.25 H new ATOM 0 H1' DG B 15 10.368 -20.297 13.995 1.00 0.25 H new ATOM 0 H8 DG B 15 7.918 -22.386 16.165 1.00 0.26 H new ATOM 0 H1 DG B 15 7.908 -23.520 9.845 1.00 0.26 H new ATOM 0 H21 DG B 15 10.235 -20.943 9.698 1.00 0.33 H new ATOM 0 H22 DG B 15 9.289 -22.155 8.828 1.00 0.33 H new ATOM 822 P DG B 16 10.471 -17.189 14.111 1.00 0.39 P ATOM 823 OP1 DG B 16 9.280 -16.377 14.445 1.00 0.43 O ATOM 824 OP2 DG B 16 10.390 -18.202 13.037 1.00 0.44 O ATOM 825 O5' DG B 16 11.687 -16.184 13.779 1.00 0.40 O ATOM 826 C5' DG B 16 12.659 -16.494 12.772 1.00 0.34 C ATOM 827 C4' DG B 16 12.088 -16.353 11.360 1.00 0.26 C ATOM 828 O4' DG B 16 11.199 -17.436 11.081 1.00 0.26 O ATOM 829 C3' DG B 16 11.307 -15.054 11.132 1.00 0.25 C ATOM 830 O3' DG B 16 11.871 -14.350 10.021 1.00 0.24 O ATOM 831 C2' DG B 16 9.888 -15.505 10.791 1.00 0.28 C ATOM 832 C1' DG B 16 10.113 -16.929 10.314 1.00 0.26 C ATOM 833 N9 DG B 16 8.959 -17.827 10.518 1.00 0.29 N ATOM 834 C8 DG B 16 8.258 -18.073 11.670 1.00 0.29 C ATOM 835 N7 DG B 16 7.289 -18.931 11.527 1.00 0.33 N ATOM 836 C5 DG B 16 7.347 -19.282 10.183 1.00 0.35 C ATOM 837 C6 DG B 16 6.536 -20.185 9.443 1.00 0.40 C ATOM 838 O6 DG B 16 5.591 -20.863 9.843 1.00 0.43 O ATOM 839 N1 DG B 16 6.929 -20.248 8.113 1.00 0.41 N ATOM 840 C2 DG B 16 7.972 -19.534 7.561 1.00 0.38 C ATOM 841 N2 DG B 16 8.198 -19.728 6.262 1.00 0.41 N ATOM 842 N3 DG B 16 8.737 -18.686 8.256 1.00 0.34 N ATOM 843 C4 DG B 16 8.367 -18.611 9.556 1.00 0.33 C ATOM 0 H5' DG B 16 13.019 -17.513 12.917 1.00 0.34 H new ATOM 0 H5'' DG B 16 13.519 -15.833 12.883 1.00 0.34 H new ATOM 0 H4' DG B 16 12.954 -16.350 10.699 1.00 0.26 H new ATOM 0 H3' DG B 16 11.333 -14.392 11.998 1.00 0.25 H new ATOM 0 H2' DG B 16 9.228 -15.465 11.658 1.00 0.28 H new ATOM 0 H2'' DG B 16 9.437 -14.883 10.018 1.00 0.28 H new ATOM 0 H1' DG B 16 10.294 -16.900 9.239 1.00 0.26 H new ATOM 0 H8 DG B 16 8.489 -17.598 12.612 1.00 0.29 H new ATOM 0 H1 DG B 16 6.406 -20.870 7.497 1.00 0.41 H new ATOM 0 H21 DG B 16 8.956 -19.229 5.796 1.00 0.41 H new ATOM 0 H22 DG B 16 7.613 -20.376 5.734 1.00 0.41 H new ATOM 855 P DG B 17 11.090 -13.109 9.357 1.00 0.28 P ATOM 856 OP1 DG B 17 12.087 -12.221 8.718 1.00 0.39 O ATOM 857 OP2 DG B 17 10.152 -12.562 10.362 1.00 0.37 O ATOM 858 O5' DG B 17 10.228 -13.817 8.196 1.00 0.31 O ATOM 859 C5' DG B 17 10.878 -14.381 7.053 1.00 0.34 C ATOM 860 C4' DG B 17 9.874 -14.784 5.977 1.00 0.36 C ATOM 861 O4' DG B 17 8.982 -15.774 6.495 1.00 0.38 O ATOM 862 C3' DG B 17 9.014 -13.622 5.464 1.00 0.35 C ATOM 863 O3' DG B 17 9.100 -13.563 4.036 1.00 0.38 O ATOM 864 C2' DG B 17 7.592 -13.982 5.884 1.00 0.35 C ATOM 865 C1' DG B 17 7.678 -15.493 5.998 1.00 0.37 C ATOM 866 N9 DG B 17 6.698 -16.089 6.927 1.00 0.35 N ATOM 867 C8 DG B 17 6.582 -15.917 8.284 1.00 0.38 C ATOM 868 N7 DG B 17 5.607 -16.594 8.821 1.00 0.36 N ATOM 869 C5 DG B 17 5.032 -17.265 7.747 1.00 0.32 C ATOM 870 C6 DG B 17 3.926 -18.156 7.719 1.00 0.29 C ATOM 871 O6 DG B 17 3.227 -18.534 8.657 1.00 0.29 O ATOM 872 N1 DG B 17 3.671 -18.611 6.432 1.00 0.29 N ATOM 873 C2 DG B 17 4.390 -18.255 5.310 1.00 0.31 C ATOM 874 N2 DG B 17 3.994 -18.796 4.158 1.00 0.35 N ATOM 875 N3 DG B 17 5.431 -17.416 5.335 1.00 0.32 N ATOM 876 C4 DG B 17 5.693 -16.962 6.583 1.00 0.32 C ATOM 0 H5' DG B 17 11.457 -15.254 7.357 1.00 0.34 H new ATOM 0 H5'' DG B 17 11.583 -13.659 6.641 1.00 0.34 H new ATOM 0 H4' DG B 17 10.471 -15.157 5.145 1.00 0.36 H new ATOM 0 H3' DG B 17 9.330 -12.656 5.857 1.00 0.35 H new ATOM 0 H2' DG B 17 7.314 -13.515 6.829 1.00 0.35 H new ATOM 0 H2'' DG B 17 6.855 -13.669 5.145 1.00 0.35 H new ATOM 0 H1' DG B 17 7.466 -15.921 5.018 1.00 0.37 H new ATOM 0 H8 DG B 17 7.240 -15.278 8.855 1.00 0.38 H new ATOM 0 H1 DG B 17 2.892 -19.258 6.307 1.00 0.29 H new ATOM 0 H21 DG B 17 4.486 -18.571 3.293 1.00 0.35 H new ATOM 0 H22 DG B 17 3.199 -19.435 4.141 1.00 0.35 H new ATOM 888 P DT B 18 8.290 -12.442 3.210 1.00 0.35 P ATOM 889 OP1 DT B 18 9.106 -12.050 2.040 1.00 0.48 O ATOM 890 OP2 DT B 18 7.825 -11.411 4.164 1.00 0.44 O ATOM 891 O5' DT B 18 7.005 -13.255 2.679 1.00 0.28 O ATOM 892 C5' DT B 18 7.147 -14.241 1.653 1.00 0.41 C ATOM 893 C4' DT B 18 5.792 -14.708 1.126 1.00 0.52 C ATOM 894 O4' DT B 18 5.050 -15.326 2.185 1.00 0.44 O ATOM 895 C3' DT B 18 4.922 -13.580 0.561 1.00 0.64 C ATOM 896 O3' DT B 18 4.316 -13.966 -0.678 1.00 0.88 O ATOM 897 C2' DT B 18 3.874 -13.370 1.643 1.00 0.54 C ATOM 898 C1' DT B 18 3.735 -14.780 2.182 1.00 0.44 C ATOM 899 N1 DT B 18 3.199 -14.867 3.556 1.00 0.29 N ATOM 900 C2 DT B 18 2.092 -15.669 3.755 1.00 0.32 C ATOM 901 O2 DT B 18 1.558 -16.286 2.836 1.00 0.49 O ATOM 902 N3 DT B 18 1.616 -15.739 5.052 1.00 0.23 N ATOM 903 C4 DT B 18 2.146 -15.084 6.150 1.00 0.23 C ATOM 904 O4 DT B 18 1.642 -15.217 7.263 1.00 0.35 O ATOM 905 C5 DT B 18 3.301 -14.269 5.847 1.00 0.24 C ATOM 906 C7 DT B 18 3.986 -13.491 6.966 1.00 0.44 C ATOM 907 C6 DT B 18 3.783 -14.185 4.590 1.00 0.23 C ATOM 0 H5' DT B 18 7.700 -15.096 2.044 1.00 0.41 H new ATOM 0 H5'' DT B 18 7.735 -13.830 0.832 1.00 0.41 H new ATOM 0 H4' DT B 18 6.017 -15.401 0.315 1.00 0.52 H new ATOM 0 H3' DT B 18 5.489 -12.676 0.337 1.00 0.64 H new ATOM 0 H2' DT B 18 4.204 -12.666 2.407 1.00 0.54 H new ATOM 0 H2'' DT B 18 2.936 -12.987 1.241 1.00 0.54 H new ATOM 0 HO3' DT B 18 3.765 -13.229 -1.016 1.00 0.88 H new ATOM 0 H1' DT B 18 3.022 -15.313 1.552 1.00 0.44 H new ATOM 0 H3 DT B 18 0.799 -16.328 5.214 1.00 0.23 H new ATOM 0 H71 DT B 18 5.047 -13.387 6.740 1.00 0.44 H new ATOM 0 H72 DT B 18 3.535 -12.502 7.051 1.00 0.44 H new ATOM 0 H73 DT B 18 3.866 -14.027 7.908 1.00 0.44 H new ATOM 0 H6 DT B 18 4.647 -13.567 4.395 1.00 0.23 H new TER 921 DT B 18