USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 460 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 G O2' : rot 52:sc= -6.41! USER MOD Single : A 2 C O2' : rot -65:sc= 0.195 USER MOD Single : A 3 C O2' : rot 50:sc= -5.69! USER MOD Single : A 4 C O2' : rot -1:sc= -0.33 USER MOD Single : A 5 U O2' : rot -16:sc= -0.377 USER MOD Single : A 6 G O2' : rot -101:sc= 0.534 USER MOD Single : A 7 A O2' : rot -127:sc= -3.88! USER MOD Single : A 8 A O2' : rot 48:sc= -2.85! USER MOD Single : A 9 A O2' : rot -15:sc= 0.123 USER MOD Single : A 10 A O2' : rot -22:sc= 0.12 USER MOD Single : A 11 A O2' : rot -85:sc= -0.223! USER MOD Single : A 12 G O2' : rot -17:sc= 0.145 USER MOD Single : A 13 G O2' : rot 57:sc= -3.87! USER MOD Single : A 14 G O2' : rot 180:sc= -2.01! USER MOD Single : A 15 C O2' : rot -16:sc= 0.175 USER MOD Single : A 15 C O3' : rot 180:sc= 0.149 USER MOD Single : B 4 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.067) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 GLN : amide:sc= -4.81! C(o=-4.8!,f=-3.4!) USER MOD Single : B 17 GLN : amide:sc= -1.39 X(o=-1.4,f=-1.7) USER MOD Single : B 19 LYS NZ :NH3+ -127:sc= -0.568 (180deg=-1.11) USER MOD Single : B 22 ASN : amide:sc= -5.93! C(o=-5.9!,f=-5.3!) USER MOD Single : B 29 SER OG : rot 180:sc= -0.667 USER MOD Single : B 31 LYS NZ :NH3+ -136:sc= 0 (180deg=-0.142) USER MOD Single : B 34 ASN : amide:sc= -1.37 K(o=-1.4,f=-3.6) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 10.660 -13.122 0.360 1.00 0.76 N ATOM 2 CA ASP B 2 9.902 -11.994 0.980 1.00 0.88 C ATOM 3 C ASP B 2 8.411 -12.318 1.022 1.00 0.68 C ATOM 4 O ASP B 2 8.005 -13.459 0.921 1.00 0.66 O ATOM 5 CB ASP B 2 10.153 -10.781 0.079 1.00 1.25 C ATOM 6 CG ASP B 2 11.654 -10.623 -0.182 1.00 1.88 C ATOM 7 OD1 ASP B 2 12.377 -10.380 0.769 1.00 2.37 O ATOM 8 OD2 ASP B 2 12.050 -10.750 -1.328 1.00 2.35 O ATOM 0 HA ASP B 2 10.223 -11.810 2.005 1.00 0.88 H new ATOM 0 HB2 ASP B 2 9.622 -10.903 -0.865 1.00 1.25 H new ATOM 0 HB3 ASP B 2 9.761 -9.880 0.551 1.00 1.25 H new ATOM 15 N ALA B 3 7.596 -11.313 1.172 1.00 0.63 N ATOM 16 CA ALA B 3 6.118 -11.535 1.221 1.00 0.58 C ATOM 17 C ALA B 3 5.384 -10.198 1.316 1.00 0.63 C ATOM 18 O ALA B 3 4.305 -10.035 0.780 1.00 0.61 O ATOM 19 CB ALA B 3 5.875 -12.368 2.479 1.00 0.75 C ATOM 0 H ALA B 3 7.888 -10.340 1.264 1.00 0.63 H new ATOM 0 HA ALA B 3 5.751 -12.037 0.326 1.00 0.58 H new ATOM 0 HB1 ALA B 3 4.809 -12.571 2.581 1.00 0.75 H new ATOM 0 HB2 ALA B 3 6.418 -13.310 2.402 1.00 0.75 H new ATOM 0 HB3 ALA B 3 6.225 -11.818 3.353 1.00 0.75 H new ATOM 25 N GLN B 4 5.960 -9.240 1.986 1.00 0.75 N ATOM 26 CA GLN B 4 5.293 -7.912 2.105 1.00 0.89 C ATOM 27 C GLN B 4 5.334 -7.215 0.757 1.00 0.79 C ATOM 28 O GLN B 4 4.308 -6.895 0.187 1.00 0.81 O ATOM 29 CB GLN B 4 6.105 -7.147 3.152 1.00 1.09 C ATOM 30 CG GLN B 4 5.358 -5.879 3.572 1.00 1.29 C ATOM 31 CD GLN B 4 6.077 -4.651 3.011 1.00 0.85 C ATOM 32 OE1 GLN B 4 7.215 -4.390 3.350 1.00 1.14 O ATOM 33 NE2 GLN B 4 5.457 -3.879 2.161 1.00 0.94 N ATOM 0 H GLN B 4 6.862 -9.318 2.456 1.00 0.75 H new ATOM 0 HA GLN B 4 4.246 -7.983 2.400 1.00 0.89 H new ATOM 0 HB2 GLN B 4 6.280 -7.780 4.022 1.00 1.09 H new ATOM 0 HB3 GLN B 4 7.082 -6.885 2.746 1.00 1.09 H new ATOM 0 HG2 GLN B 4 4.332 -5.911 3.206 1.00 1.29 H new ATOM 0 HG3 GLN B 4 5.307 -5.818 4.659 1.00 1.29 H new ATOM 0 HE21 GLN B 4 4.502 -4.097 1.876 1.00 0.94 H new ATOM 0 HE22 GLN B 4 5.927 -3.057 1.781 1.00 0.94 H new ATOM 42 N THR B 5 6.504 -7.013 0.221 1.00 0.76 N ATOM 43 CA THR B 5 6.592 -6.379 -1.126 1.00 0.79 C ATOM 44 C THR B 5 5.678 -7.167 -2.060 1.00 0.59 C ATOM 45 O THR B 5 5.089 -6.636 -2.982 1.00 0.57 O ATOM 46 CB THR B 5 8.056 -6.514 -1.546 1.00 0.94 C ATOM 47 OG1 THR B 5 8.870 -5.733 -0.683 1.00 1.26 O ATOM 48 CG2 THR B 5 8.223 -6.028 -2.986 1.00 0.94 C ATOM 0 H THR B 5 7.396 -7.256 0.651 1.00 0.76 H new ATOM 0 HA THR B 5 6.288 -5.332 -1.143 1.00 0.79 H new ATOM 0 HB THR B 5 8.357 -7.560 -1.481 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.809 -5.821 -0.951 1.00 1.26 H new ATOM 0 HG21 THR B 5 9.267 -6.125 -3.284 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.600 -6.629 -3.648 1.00 0.94 H new ATOM 0 HG23 THR B 5 7.922 -4.983 -3.054 1.00 0.94 H new ATOM 56 N ARG B 6 5.534 -8.436 -1.784 1.00 0.48 N ATOM 57 CA ARG B 6 4.634 -9.286 -2.598 1.00 0.46 C ATOM 58 C ARG B 6 3.198 -8.932 -2.282 1.00 0.43 C ATOM 59 O ARG B 6 2.376 -8.770 -3.162 1.00 0.45 O ATOM 60 CB ARG B 6 4.888 -10.715 -2.136 1.00 0.56 C ATOM 61 CG ARG B 6 5.587 -11.509 -3.246 1.00 0.78 C ATOM 62 CD ARG B 6 6.947 -12.005 -2.747 1.00 1.03 C ATOM 63 NE ARG B 6 6.649 -13.263 -2.003 1.00 0.88 N ATOM 64 CZ ARG B 6 7.609 -14.103 -1.699 1.00 0.73 C ATOM 65 NH1 ARG B 6 8.847 -13.856 -2.041 1.00 1.26 N ATOM 66 NH2 ARG B 6 7.326 -15.198 -1.048 1.00 1.43 N ATOM 0 H ARG B 6 6.008 -8.919 -1.021 1.00 0.48 H new ATOM 0 HA ARG B 6 4.810 -9.155 -3.666 1.00 0.46 H new ATOM 0 HB2 ARG B 6 5.504 -10.711 -1.237 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.945 -11.194 -1.874 1.00 0.56 H new ATOM 0 HG2 ARG B 6 4.968 -12.355 -3.546 1.00 0.78 H new ATOM 0 HG3 ARG B 6 5.719 -10.882 -4.128 1.00 0.78 H new ATOM 0 HD2 ARG B 6 7.629 -12.189 -3.577 1.00 1.03 H new ATOM 0 HD3 ARG B 6 7.423 -11.268 -2.101 1.00 1.03 H new ATOM 0 HE ARG B 6 5.689 -13.472 -1.728 1.00 0.88 H new ATOM 0 HH11 ARG B 6 9.075 -13.002 -2.550 1.00 1.26 H new ATOM 0 HH12 ARG B 6 9.585 -14.517 -1.799 1.00 1.26 H new ATOM 0 HH21 ARG B 6 6.362 -15.397 -0.779 1.00 1.43 H new ATOM 0 HH22 ARG B 6 8.068 -15.855 -0.809 1.00 1.43 H new ATOM 80 N ARG B 7 2.882 -8.826 -1.018 1.00 0.61 N ATOM 81 CA ARG B 7 1.486 -8.499 -0.657 1.00 0.80 C ATOM 82 C ARG B 7 1.111 -7.157 -1.282 1.00 0.65 C ATOM 83 O ARG B 7 -0.014 -6.935 -1.681 1.00 0.56 O ATOM 84 CB ARG B 7 1.453 -8.426 0.870 1.00 1.16 C ATOM 85 CG ARG B 7 0.086 -7.888 1.323 1.00 1.10 C ATOM 86 CD ARG B 7 0.136 -7.517 2.804 1.00 0.92 C ATOM 87 NE ARG B 7 -0.714 -6.297 2.931 1.00 0.41 N ATOM 88 CZ ARG B 7 -2.016 -6.376 2.890 1.00 0.93 C ATOM 89 NH1 ARG B 7 -2.616 -7.530 2.736 1.00 1.61 N ATOM 90 NH2 ARG B 7 -2.720 -5.285 3.006 1.00 1.08 N ATOM 0 H ARG B 7 3.525 -8.951 -0.236 1.00 0.61 H new ATOM 0 HA ARG B 7 0.774 -9.240 -1.020 1.00 0.80 H new ATOM 0 HB2 ARG B 7 1.628 -9.414 1.297 1.00 1.16 H new ATOM 0 HB3 ARG B 7 2.250 -7.777 1.232 1.00 1.16 H new ATOM 0 HG2 ARG B 7 -0.185 -7.015 0.730 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -0.684 -8.640 1.154 1.00 1.10 H new ATOM 0 HD2 ARG B 7 -0.243 -8.328 3.426 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.158 -7.320 3.126 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.270 -5.387 3.052 1.00 0.41 H new ATOM 0 HH11 ARG B 7 -2.065 -8.383 2.646 1.00 1.61 H new ATOM 0 HH12 ARG B 7 -3.635 -7.575 2.706 1.00 1.61 H new ATOM 0 HH21 ARG B 7 -2.252 -4.387 3.127 1.00 1.08 H new ATOM 0 HH22 ARG B 7 -3.739 -5.330 2.976 1.00 1.08 H new ATOM 104 N ARG B 8 2.061 -6.268 -1.382 1.00 0.68 N ATOM 105 CA ARG B 8 1.790 -4.934 -1.993 1.00 0.67 C ATOM 106 C ARG B 8 1.206 -5.131 -3.377 1.00 0.48 C ATOM 107 O ARG B 8 0.273 -4.459 -3.770 1.00 0.50 O ATOM 108 CB ARG B 8 3.162 -4.259 -2.075 1.00 0.77 C ATOM 109 CG ARG B 8 3.058 -2.779 -1.687 1.00 0.73 C ATOM 110 CD ARG B 8 2.373 -2.609 -0.319 1.00 0.73 C ATOM 111 NE ARG B 8 2.721 -3.827 0.481 1.00 0.85 N ATOM 112 CZ ARG B 8 2.020 -4.158 1.538 1.00 1.05 C ATOM 113 NH1 ARG B 8 1.002 -3.435 1.921 1.00 1.43 N ATOM 114 NH2 ARG B 8 2.344 -5.221 2.215 1.00 1.16 N ATOM 0 H ARG B 8 3.020 -6.409 -1.065 1.00 0.68 H new ATOM 0 HA ARG B 8 1.080 -4.336 -1.421 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.863 -4.766 -1.412 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.558 -4.349 -3.087 1.00 0.77 H new ATOM 0 HG2 ARG B 8 4.054 -2.338 -1.655 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.495 -2.239 -2.448 1.00 0.73 H new ATOM 0 HD2 ARG B 8 2.720 -1.704 0.180 1.00 0.73 H new ATOM 0 HD3 ARG B 8 1.293 -2.515 -0.434 1.00 0.73 H new ATOM 0 HE ARG B 8 3.513 -4.405 0.200 1.00 0.85 H new ATOM 0 HH11 ARG B 8 0.743 -2.600 1.395 1.00 1.43 H new ATOM 0 HH12 ARG B 8 0.466 -3.705 2.746 1.00 1.43 H new ATOM 0 HH21 ARG B 8 3.138 -5.790 1.922 1.00 1.16 H new ATOM 0 HH22 ARG B 8 1.804 -5.485 3.039 1.00 1.16 H new ATOM 128 N GLU B 9 1.716 -6.077 -4.106 1.00 0.38 N ATOM 129 CA GLU B 9 1.140 -6.342 -5.449 1.00 0.34 C ATOM 130 C GLU B 9 -0.317 -6.732 -5.246 1.00 0.31 C ATOM 131 O GLU B 9 -1.182 -6.419 -6.040 1.00 0.34 O ATOM 132 CB GLU B 9 1.954 -7.496 -6.038 1.00 0.40 C ATOM 133 CG GLU B 9 3.438 -7.116 -6.063 1.00 0.59 C ATOM 134 CD GLU B 9 4.074 -7.616 -7.362 1.00 1.24 C ATOM 135 OE1 GLU B 9 3.459 -7.447 -8.403 1.00 1.88 O ATOM 136 OE2 GLU B 9 5.164 -8.158 -7.294 1.00 1.73 O ATOM 0 H GLU B 9 2.498 -6.673 -3.835 1.00 0.38 H new ATOM 0 HA GLU B 9 1.179 -5.485 -6.121 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.809 -8.398 -5.443 1.00 0.40 H new ATOM 0 HB3 GLU B 9 1.608 -7.721 -7.047 1.00 0.40 H new ATOM 0 HG2 GLU B 9 3.548 -6.034 -5.985 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.950 -7.551 -5.205 1.00 0.59 H new ATOM 143 N ARG B 10 -0.590 -7.367 -4.139 1.00 0.31 N ATOM 144 CA ARG B 10 -1.986 -7.732 -3.816 1.00 0.38 C ATOM 145 C ARG B 10 -2.705 -6.483 -3.320 1.00 0.35 C ATOM 146 O ARG B 10 -3.917 -6.438 -3.244 1.00 0.40 O ATOM 147 CB ARG B 10 -1.887 -8.785 -2.711 1.00 0.46 C ATOM 148 CG ARG B 10 -2.427 -10.123 -3.223 1.00 0.73 C ATOM 149 CD ARG B 10 -1.593 -11.269 -2.641 1.00 0.67 C ATOM 150 NE ARG B 10 -1.880 -12.440 -3.519 1.00 1.55 N ATOM 151 CZ ARG B 10 -1.131 -13.517 -3.463 1.00 2.12 C ATOM 152 NH1 ARG B 10 -0.119 -13.585 -2.638 1.00 3.14 N ATOM 153 NH2 ARG B 10 -1.400 -14.530 -4.241 1.00 2.20 N ATOM 0 H ARG B 10 0.102 -7.647 -3.445 1.00 0.31 H new ATOM 0 HA ARG B 10 -2.539 -8.121 -4.671 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -0.850 -8.898 -2.395 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -2.454 -8.464 -1.837 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -3.472 -10.238 -2.937 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -2.390 -10.149 -4.312 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -0.531 -11.025 -2.644 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -1.871 -11.474 -1.607 1.00 0.67 H new ATOM 0 HE ARG B 10 -2.665 -12.404 -4.169 1.00 1.55 H new ATOM 0 HH11 ARG B 10 0.096 -12.796 -2.029 1.00 3.14 H new ATOM 0 HH12 ARG B 10 0.455 -14.427 -2.604 1.00 3.14 H new ATOM 0 HH21 ARG B 10 -2.188 -14.482 -4.887 1.00 2.20 H new ATOM 0 HH22 ARG B 10 -0.822 -15.370 -4.203 1.00 2.20 H new ATOM 167 N ARG B 11 -1.960 -5.454 -2.996 1.00 0.29 N ATOM 168 CA ARG B 11 -2.598 -4.205 -2.528 1.00 0.29 C ATOM 169 C ARG B 11 -2.755 -3.231 -3.687 1.00 0.24 C ATOM 170 O ARG B 11 -3.223 -2.129 -3.506 1.00 0.25 O ATOM 171 CB ARG B 11 -1.653 -3.626 -1.479 1.00 0.32 C ATOM 172 CG ARG B 11 -1.565 -4.559 -0.259 1.00 0.41 C ATOM 173 CD ARG B 11 -2.973 -4.863 0.266 1.00 0.55 C ATOM 174 NE ARG B 11 -3.038 -6.354 0.310 1.00 1.59 N ATOM 175 CZ ARG B 11 -4.193 -6.975 0.372 1.00 2.18 C ATOM 176 NH1 ARG B 11 -5.315 -6.303 0.398 1.00 3.24 N ATOM 177 NH2 ARG B 11 -4.220 -8.280 0.409 1.00 1.76 N ATOM 0 H ARG B 11 -0.941 -5.434 -3.038 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.591 -4.388 -2.119 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.662 -3.488 -1.911 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -2.005 -2.643 -1.167 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -1.062 -5.486 -0.534 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.968 -4.093 0.525 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -3.131 -4.429 1.253 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.740 -4.451 -0.390 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.175 -6.897 0.292 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -5.300 -5.284 0.370 1.00 3.24 H new ATOM 0 HH12 ARG B 11 -6.205 -6.799 0.446 1.00 3.24 H new ATOM 0 HH21 ARG B 11 -3.348 -8.809 0.390 1.00 1.76 H new ATOM 0 HH22 ARG B 11 -5.113 -8.770 0.457 1.00 1.76 H new ATOM 191 N ALA B 12 -2.391 -3.623 -4.885 1.00 0.24 N ATOM 192 CA ALA B 12 -2.565 -2.687 -6.038 1.00 0.28 C ATOM 193 C ALA B 12 -4.026 -2.241 -6.071 1.00 0.31 C ATOM 194 O ALA B 12 -4.352 -1.157 -6.513 1.00 0.33 O ATOM 195 CB ALA B 12 -2.213 -3.501 -7.283 1.00 0.34 C ATOM 0 H ALA B 12 -1.989 -4.533 -5.111 1.00 0.24 H new ATOM 0 HA ALA B 12 -1.939 -1.797 -5.971 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -2.319 -2.875 -8.169 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.184 -3.853 -7.209 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -2.884 -4.356 -7.360 1.00 0.34 H new ATOM 201 N GLU B 13 -4.903 -3.069 -5.563 1.00 0.34 N ATOM 202 CA GLU B 13 -6.338 -2.699 -5.514 1.00 0.41 C ATOM 203 C GLU B 13 -6.535 -1.692 -4.386 1.00 0.38 C ATOM 204 O GLU B 13 -7.333 -0.780 -4.487 1.00 0.42 O ATOM 205 CB GLU B 13 -7.085 -4.002 -5.224 1.00 0.48 C ATOM 206 CG GLU B 13 -6.890 -4.976 -6.391 1.00 0.52 C ATOM 207 CD GLU B 13 -6.420 -6.331 -5.857 1.00 0.77 C ATOM 208 OE1 GLU B 13 -5.219 -6.512 -5.730 1.00 1.18 O ATOM 209 OE2 GLU B 13 -7.267 -7.165 -5.585 1.00 1.15 O ATOM 0 H GLU B 13 -4.680 -3.988 -5.180 1.00 0.34 H new ATOM 0 HA GLU B 13 -6.699 -2.245 -6.437 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -6.716 -4.447 -4.300 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -8.146 -3.800 -5.079 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -7.825 -5.094 -6.939 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.158 -4.577 -7.093 1.00 0.52 H new ATOM 216 N LYS B 14 -5.778 -1.825 -3.325 1.00 0.33 N ATOM 217 CA LYS B 14 -5.890 -0.847 -2.213 1.00 0.33 C ATOM 218 C LYS B 14 -5.135 0.411 -2.633 1.00 0.28 C ATOM 219 O LYS B 14 -5.525 1.527 -2.351 1.00 0.30 O ATOM 220 CB LYS B 14 -5.209 -1.523 -1.019 1.00 0.31 C ATOM 221 CG LYS B 14 -5.925 -2.834 -0.686 1.00 0.38 C ATOM 222 CD LYS B 14 -7.292 -2.536 -0.065 1.00 1.23 C ATOM 223 CE LYS B 14 -8.226 -3.727 -0.292 1.00 1.37 C ATOM 224 NZ LYS B 14 -9.448 -3.418 0.500 1.00 1.83 N ATOM 0 H LYS B 14 -5.092 -2.567 -3.186 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.915 -0.569 -1.966 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -4.162 -1.719 -1.249 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -5.227 -0.859 -0.155 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -6.048 -3.431 -1.590 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.322 -3.423 0.005 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -7.184 -2.343 1.002 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.717 -1.637 -0.510 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -8.462 -3.847 -1.349 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -7.766 -4.658 0.040 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -10.135 -4.191 0.393 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -9.195 -3.316 1.504 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -9.869 -2.531 0.157 1.00 1.83 H new ATOM 238 N GLN B 15 -4.057 0.206 -3.331 1.00 0.25 N ATOM 239 CA GLN B 15 -3.227 1.327 -3.832 1.00 0.24 C ATOM 240 C GLN B 15 -3.972 2.083 -4.924 1.00 0.28 C ATOM 241 O GLN B 15 -4.073 3.286 -4.897 1.00 0.28 O ATOM 242 CB GLN B 15 -1.995 0.631 -4.420 1.00 0.24 C ATOM 243 CG GLN B 15 -0.790 0.876 -3.521 1.00 0.25 C ATOM 244 CD GLN B 15 0.164 -0.312 -3.632 1.00 0.30 C ATOM 245 OE1 GLN B 15 1.238 -0.200 -4.187 1.00 0.35 O ATOM 246 NE2 GLN B 15 -0.193 -1.456 -3.118 1.00 0.33 N ATOM 0 H GLN B 15 -3.709 -0.720 -3.581 1.00 0.25 H new ATOM 0 HA GLN B 15 -2.978 2.052 -3.057 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -2.180 -0.439 -4.513 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -1.796 1.009 -5.423 1.00 0.24 H new ATOM 0 HG2 GLN B 15 -0.282 1.795 -3.814 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -1.112 1.005 -2.488 1.00 0.25 H new ATOM 0 HE21 GLN B 15 -1.096 -1.546 -2.652 1.00 0.33 H new ATOM 0 HE22 GLN B 15 0.431 -2.260 -3.181 1.00 0.33 H new ATOM 255 N ALA B 16 -4.493 1.379 -5.886 1.00 0.35 N ATOM 256 CA ALA B 16 -5.234 2.065 -6.983 1.00 0.41 C ATOM 257 C ALA B 16 -6.488 2.724 -6.418 1.00 0.40 C ATOM 258 O ALA B 16 -6.961 3.718 -6.933 1.00 0.43 O ATOM 259 CB ALA B 16 -5.601 0.963 -7.978 1.00 0.48 C ATOM 0 H ALA B 16 -4.440 0.363 -5.963 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.643 2.847 -7.459 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.150 1.396 -8.814 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -4.692 0.489 -8.347 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.223 0.218 -7.482 1.00 0.48 H new ATOM 265 N GLN B 17 -7.014 2.198 -5.344 1.00 0.40 N ATOM 266 CA GLN B 17 -8.217 2.826 -4.738 1.00 0.42 C ATOM 267 C GLN B 17 -7.763 4.035 -3.940 1.00 0.37 C ATOM 268 O GLN B 17 -8.405 5.067 -3.914 1.00 0.40 O ATOM 269 CB GLN B 17 -8.807 1.755 -3.822 1.00 0.45 C ATOM 270 CG GLN B 17 -9.597 0.745 -4.655 1.00 0.53 C ATOM 271 CD GLN B 17 -9.955 -0.465 -3.790 1.00 0.66 C ATOM 272 OE1 GLN B 17 -10.217 -0.327 -2.611 1.00 1.06 O ATOM 273 NE2 GLN B 17 -9.975 -1.653 -4.328 1.00 1.33 N ATOM 0 H GLN B 17 -6.664 1.368 -4.866 1.00 0.40 H new ATOM 0 HA GLN B 17 -8.953 3.159 -5.469 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -8.010 1.248 -3.278 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -9.457 2.216 -3.079 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -10.504 1.209 -5.043 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -9.008 0.428 -5.516 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -9.755 -1.769 -5.317 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -10.211 -2.466 -3.759 1.00 1.33 H new ATOM 282 N TRP B 18 -6.631 3.911 -3.316 1.00 0.32 N ATOM 283 CA TRP B 18 -6.073 5.041 -2.538 1.00 0.30 C ATOM 284 C TRP B 18 -5.472 6.054 -3.506 1.00 0.31 C ATOM 285 O TRP B 18 -5.687 7.245 -3.406 1.00 0.35 O ATOM 286 CB TRP B 18 -4.961 4.418 -1.696 1.00 0.25 C ATOM 287 CG TRP B 18 -4.207 5.511 -1.015 1.00 0.24 C ATOM 288 CD1 TRP B 18 -4.384 5.942 0.250 1.00 0.30 C ATOM 289 CD2 TRP B 18 -3.154 6.317 -1.573 1.00 0.24 C ATOM 290 NE1 TRP B 18 -3.504 6.989 0.486 1.00 0.31 N ATOM 291 CE2 TRP B 18 -2.718 7.245 -0.611 1.00 0.29 C ATOM 292 CE3 TRP B 18 -2.544 6.323 -2.819 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -1.702 8.155 -0.890 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -1.531 7.218 -3.107 1.00 0.36 C ATOM 295 CH2 TRP B 18 -1.107 8.134 -2.153 1.00 0.38 C ATOM 0 H TRP B 18 -6.063 3.064 -3.313 1.00 0.32 H new ATOM 0 HA TRP B 18 -6.820 5.548 -1.928 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -5.383 3.734 -0.959 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -4.292 3.833 -2.327 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -5.091 5.540 0.960 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -3.448 7.504 1.365 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -2.865 5.620 -3.573 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 -1.380 8.865 -0.143 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -1.066 7.205 -4.081 1.00 0.36 H new ATOM 0 HH2 TRP B 18 -0.316 8.831 -2.388 1.00 0.38 H new ATOM 306 N LYS B 19 -4.716 5.565 -4.442 1.00 0.30 N ATOM 307 CA LYS B 19 -4.067 6.452 -5.440 1.00 0.37 C ATOM 308 C LYS B 19 -5.143 7.188 -6.208 1.00 0.46 C ATOM 309 O LYS B 19 -4.988 8.335 -6.580 1.00 0.70 O ATOM 310 CB LYS B 19 -3.288 5.522 -6.374 1.00 0.40 C ATOM 311 CG LYS B 19 -2.004 5.034 -5.698 1.00 0.49 C ATOM 312 CD LYS B 19 -1.195 4.196 -6.691 1.00 0.96 C ATOM 313 CE LYS B 19 -0.374 5.121 -7.591 1.00 1.30 C ATOM 314 NZ LYS B 19 0.462 4.208 -8.419 1.00 1.92 N ATOM 0 H LYS B 19 -4.517 4.572 -4.560 1.00 0.30 H new ATOM 0 HA LYS B 19 -3.409 7.191 -4.982 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -3.909 4.669 -6.647 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -3.043 6.047 -7.297 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -1.414 5.884 -5.357 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -2.247 4.440 -4.817 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -0.535 3.514 -6.155 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -1.864 3.583 -7.295 1.00 0.96 H new ATOM 0 HE2 LYS B 19 -1.019 5.740 -8.214 1.00 1.30 H new ATOM 0 HE3 LYS B 19 0.245 5.798 -7.002 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 1.461 4.487 -8.342 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 0.348 3.231 -8.081 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 0.162 4.268 -9.413 1.00 1.92 H new ATOM 328 N ALA B 20 -6.245 6.535 -6.438 1.00 0.44 N ATOM 329 CA ALA B 20 -7.340 7.203 -7.173 1.00 0.52 C ATOM 330 C ALA B 20 -7.816 8.423 -6.386 1.00 0.56 C ATOM 331 O ALA B 20 -8.281 9.396 -6.947 1.00 0.74 O ATOM 332 CB ALA B 20 -8.455 6.172 -7.273 1.00 0.55 C ATOM 0 H ALA B 20 -6.430 5.574 -6.149 1.00 0.44 H new ATOM 0 HA ALA B 20 -7.024 7.547 -8.158 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -9.301 6.602 -7.808 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -8.093 5.296 -7.811 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -8.770 5.879 -6.272 1.00 0.55 H new ATOM 338 N ALA B 21 -7.701 8.373 -5.085 1.00 0.54 N ATOM 339 CA ALA B 21 -8.145 9.525 -4.253 1.00 0.66 C ATOM 340 C ALA B 21 -6.983 10.073 -3.435 1.00 0.73 C ATOM 341 O ALA B 21 -7.164 10.661 -2.387 1.00 0.99 O ATOM 342 CB ALA B 21 -9.236 8.963 -3.345 1.00 0.71 C ATOM 0 H ALA B 21 -7.319 7.584 -4.565 1.00 0.54 H new ATOM 0 HA ALA B 21 -8.512 10.353 -4.860 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -9.615 9.755 -2.699 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -10.050 8.571 -3.954 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -8.823 8.162 -2.733 1.00 0.71 H new ATOM 348 N ASN B 22 -5.796 9.908 -3.932 1.00 0.73 N ATOM 349 CA ASN B 22 -4.594 10.439 -3.217 1.00 0.88 C ATOM 350 C ASN B 22 -3.441 10.685 -4.197 1.00 1.08 C ATOM 351 O ASN B 22 -2.327 10.263 -3.958 1.00 0.00 O ATOM 352 CB ASN B 22 -4.192 9.377 -2.199 1.00 0.93 C ATOM 353 CG ASN B 22 -5.281 9.233 -1.140 1.00 0.94 C ATOM 354 OD1 ASN B 22 -5.637 10.186 -0.477 1.00 1.13 O ATOM 355 ND2 ASN B 22 -5.826 8.068 -0.956 1.00 0.94 N ATOM 0 H ASN B 22 -5.598 9.426 -4.809 1.00 0.73 H new ATOM 0 HA ASN B 22 -4.821 11.391 -2.737 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -4.032 8.423 -2.700 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -3.248 9.652 -1.728 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -6.556 7.952 -0.253 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -5.524 7.270 -1.515 1.00 0.94 H new ATOM 362 N PRO B 23 -3.737 11.393 -5.254 1.00 0.00 N ATOM 363 CA PRO B 23 -2.705 11.734 -6.248 1.00 0.00 C ATOM 364 C PRO B 23 -1.778 12.761 -5.609 1.00 0.00 C ATOM 365 O PRO B 23 -0.603 12.832 -5.899 1.00 0.00 O ATOM 366 CB PRO B 23 -3.495 12.328 -7.411 1.00 0.00 C ATOM 367 CG PRO B 23 -4.760 12.825 -6.794 1.00 0.00 C ATOM 368 CD PRO B 23 -5.038 11.944 -5.603 1.00 0.00 C ATOM 0 HA PRO B 23 -2.091 10.897 -6.582 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -2.944 13.137 -7.892 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -3.695 11.579 -8.177 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -4.658 13.867 -6.489 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -5.582 12.781 -7.508 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -5.464 12.514 -4.777 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -5.751 11.157 -5.848 1.00 0.00 H new ATOM 376 N LEU B 24 -2.313 13.536 -4.701 1.00 0.00 N ATOM 377 CA LEU B 24 -1.480 14.543 -3.986 1.00 0.00 C ATOM 378 C LEU B 24 -0.300 13.826 -3.332 1.00 0.00 C ATOM 379 O LEU B 24 0.806 14.328 -3.277 1.00 0.00 O ATOM 380 CB LEU B 24 -2.425 15.170 -2.938 1.00 0.00 C ATOM 381 CG LEU B 24 -2.388 14.393 -1.604 1.00 0.00 C ATOM 382 CD1 LEU B 24 -3.038 15.244 -0.511 1.00 0.00 C ATOM 383 CD2 LEU B 24 -3.156 13.066 -1.729 1.00 0.00 C ATOM 0 H LEU B 24 -3.295 13.513 -4.425 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.065 15.312 -4.638 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -2.139 16.207 -2.764 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -3.444 15.181 -3.326 1.00 0.00 H new ATOM 0 HG LEU B 24 -1.350 14.178 -1.351 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.015 14.702 0.434 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.490 16.180 -0.405 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -4.072 15.457 -0.782 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -3.118 12.533 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.194 13.270 -1.990 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -2.700 12.454 -2.507 1.00 0.00 H new ATOM 395 N LEU B 25 -0.537 12.627 -2.880 1.00 0.00 N ATOM 396 CA LEU B 25 0.547 11.817 -2.271 1.00 0.00 C ATOM 397 C LEU B 25 1.033 10.845 -3.333 1.00 0.00 C ATOM 398 O LEU B 25 1.457 9.740 -3.061 1.00 0.00 O ATOM 399 CB LEU B 25 -0.119 11.077 -1.111 1.00 0.00 C ATOM 400 CG LEU B 25 0.017 11.903 0.169 1.00 0.00 C ATOM 401 CD1 LEU B 25 -1.107 11.534 1.141 1.00 0.00 C ATOM 402 CD2 LEU B 25 1.372 11.611 0.819 1.00 0.00 C ATOM 0 H LEU B 25 -1.449 12.170 -2.908 1.00 0.00 H new ATOM 0 HA LEU B 25 1.399 12.399 -1.918 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -1.172 10.903 -1.334 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.344 10.099 -0.976 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.051 12.963 -0.074 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.008 12.124 2.052 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -2.072 11.741 0.677 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.043 10.474 1.386 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.472 12.198 1.732 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.438 10.550 1.061 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.172 11.876 0.128 1.00 0.00 H new ATOM 414 N VAL B 26 0.940 11.275 -4.551 1.00 0.00 N ATOM 415 CA VAL B 26 1.344 10.438 -5.698 1.00 0.00 C ATOM 416 C VAL B 26 1.873 11.349 -6.804 1.00 0.00 C ATOM 417 O VAL B 26 1.156 12.167 -7.344 1.00 0.00 O ATOM 418 CB VAL B 26 0.042 9.723 -6.096 1.00 0.00 C ATOM 419 CG1 VAL B 26 -0.215 9.847 -7.601 1.00 0.00 C ATOM 420 CG2 VAL B 26 0.169 8.250 -5.717 1.00 0.00 C ATOM 0 H VAL B 26 0.590 12.199 -4.805 1.00 0.00 H new ATOM 0 HA VAL B 26 2.138 9.722 -5.487 1.00 0.00 H new ATOM 0 HB VAL B 26 -0.796 10.184 -5.573 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -1.142 9.333 -7.855 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -0.299 10.900 -7.870 1.00 0.00 H new ATOM 0 HG13 VAL B 26 0.612 9.397 -8.150 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -0.745 7.724 -5.991 1.00 0.00 H new ATOM 0 HG22 VAL B 26 1.014 7.810 -6.246 1.00 0.00 H new ATOM 0 HG23 VAL B 26 0.329 8.163 -4.642 1.00 0.00 H new ATOM 430 N GLY B 27 3.127 11.237 -7.126 1.00 0.00 N ATOM 431 CA GLY B 27 3.699 12.128 -8.175 1.00 0.00 C ATOM 432 C GLY B 27 3.846 13.535 -7.585 1.00 0.00 C ATOM 433 O GLY B 27 4.931 14.079 -7.516 1.00 0.00 O ATOM 0 H GLY B 27 3.781 10.572 -6.713 1.00 0.00 H new ATOM 0 HA2 GLY B 27 4.667 11.752 -8.506 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.050 12.149 -9.050 1.00 0.00 H new ATOM 437 N VAL B 28 2.760 14.121 -7.142 1.00 0.00 N ATOM 438 CA VAL B 28 2.832 15.484 -6.537 1.00 0.00 C ATOM 439 C VAL B 28 3.750 15.463 -5.313 1.00 0.00 C ATOM 440 O VAL B 28 3.805 14.493 -4.583 1.00 0.00 O ATOM 441 CB VAL B 28 1.398 15.818 -6.116 1.00 0.00 C ATOM 442 CG1 VAL B 28 1.384 17.140 -5.333 1.00 0.00 C ATOM 443 CG2 VAL B 28 0.521 15.954 -7.364 1.00 0.00 C ATOM 0 H VAL B 28 1.826 13.712 -7.174 1.00 0.00 H new ATOM 0 HA VAL B 28 3.232 16.221 -7.233 1.00 0.00 H new ATOM 0 HB VAL B 28 1.011 15.020 -5.483 1.00 0.00 H new ATOM 0 HG11 VAL B 28 0.362 17.375 -5.035 1.00 0.00 H new ATOM 0 HG12 VAL B 28 2.008 17.043 -4.445 1.00 0.00 H new ATOM 0 HG13 VAL B 28 1.771 17.940 -5.963 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -0.500 16.192 -7.067 1.00 0.00 H new ATOM 0 HG22 VAL B 28 0.910 16.752 -7.997 1.00 0.00 H new ATOM 0 HG23 VAL B 28 0.528 15.015 -7.918 1.00 0.00 H new ATOM 453 N SER B 29 4.463 16.532 -5.082 1.00 0.00 N ATOM 454 CA SER B 29 5.376 16.592 -3.902 1.00 0.00 C ATOM 455 C SER B 29 6.263 15.343 -3.839 1.00 0.00 C ATOM 456 O SER B 29 6.300 14.550 -4.760 1.00 0.00 O ATOM 457 CB SER B 29 4.451 16.652 -2.688 1.00 0.00 C ATOM 458 OG SER B 29 3.523 17.717 -2.856 1.00 0.00 O ATOM 0 H SER B 29 4.453 17.371 -5.662 1.00 0.00 H new ATOM 0 HA SER B 29 6.047 17.449 -3.950 1.00 0.00 H new ATOM 0 HB2 SER B 29 3.920 15.707 -2.574 1.00 0.00 H new ATOM 0 HB3 SER B 29 5.034 16.802 -1.779 1.00 0.00 H new ATOM 0 HG SER B 29 2.927 17.757 -2.079 1.00 0.00 H new ATOM 464 N ALA B 30 6.970 15.161 -2.754 1.00 0.00 N ATOM 465 CA ALA B 30 7.852 13.961 -2.618 1.00 0.00 C ATOM 466 C ALA B 30 8.770 13.824 -3.837 1.00 0.00 C ATOM 467 O ALA B 30 8.713 12.848 -4.561 1.00 0.00 O ATOM 468 CB ALA B 30 6.895 12.770 -2.531 1.00 0.00 C ATOM 0 H ALA B 30 6.975 15.793 -1.953 1.00 0.00 H new ATOM 0 HA ALA B 30 8.500 14.030 -1.745 1.00 0.00 H new ATOM 0 HB1 ALA B 30 7.469 11.849 -2.429 1.00 0.00 H new ATOM 0 HB2 ALA B 30 6.244 12.889 -1.665 1.00 0.00 H new ATOM 0 HB3 ALA B 30 6.290 12.722 -3.436 1.00 0.00 H new ATOM 474 N LYS B 31 9.614 14.792 -4.070 1.00 0.00 N ATOM 475 CA LYS B 31 10.534 14.714 -5.243 1.00 0.00 C ATOM 476 C LYS B 31 11.947 15.147 -4.837 1.00 0.00 C ATOM 477 O LYS B 31 12.396 16.218 -5.196 1.00 0.00 O ATOM 478 CB LYS B 31 9.945 15.681 -6.271 1.00 0.00 C ATOM 479 CG LYS B 31 8.809 14.992 -7.036 1.00 0.00 C ATOM 480 CD LYS B 31 9.183 14.873 -8.515 1.00 0.00 C ATOM 481 CE LYS B 31 10.280 13.819 -8.681 1.00 0.00 C ATOM 482 NZ LYS B 31 9.562 12.514 -8.686 1.00 0.00 N ATOM 0 H LYS B 31 9.707 15.633 -3.500 1.00 0.00 H new ATOM 0 HA LYS B 31 10.617 13.702 -5.639 1.00 0.00 H new ATOM 0 HB2 LYS B 31 9.571 16.574 -5.771 1.00 0.00 H new ATOM 0 HB3 LYS B 31 10.720 16.005 -6.966 1.00 0.00 H new ATOM 0 HG2 LYS B 31 8.623 14.003 -6.617 1.00 0.00 H new ATOM 0 HG3 LYS B 31 7.887 15.563 -6.929 1.00 0.00 H new ATOM 0 HD2 LYS B 31 8.307 14.597 -9.102 1.00 0.00 H new ATOM 0 HD3 LYS B 31 9.529 15.835 -8.892 1.00 0.00 H new ATOM 0 HE2 LYS B 31 10.834 13.968 -9.608 1.00 0.00 H new ATOM 0 HE3 LYS B 31 11.002 13.869 -7.866 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 10.074 11.834 -8.089 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 8.600 12.646 -8.314 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 9.510 12.150 -9.659 1.00 0.00 H new ATOM 496 N PRO B 32 12.605 14.291 -4.096 1.00 0.00 N ATOM 497 CA PRO B 32 13.979 14.587 -3.635 1.00 0.00 C ATOM 498 C PRO B 32 14.989 14.304 -4.750 1.00 0.00 C ATOM 499 O PRO B 32 15.013 13.231 -5.320 1.00 0.00 O ATOM 500 CB PRO B 32 14.180 13.624 -2.470 1.00 0.00 C ATOM 501 CG PRO B 32 13.243 12.483 -2.729 1.00 0.00 C ATOM 502 CD PRO B 32 12.134 12.986 -3.622 1.00 0.00 C ATOM 0 HA PRO B 32 14.120 15.630 -3.352 1.00 0.00 H new ATOM 0 HB2 PRO B 32 15.213 13.280 -2.419 1.00 0.00 H new ATOM 0 HB3 PRO B 32 13.957 14.107 -1.518 1.00 0.00 H new ATOM 0 HG2 PRO B 32 13.771 11.657 -3.205 1.00 0.00 H new ATOM 0 HG3 PRO B 32 12.836 12.104 -1.792 1.00 0.00 H new ATOM 0 HD2 PRO B 32 11.954 12.304 -4.453 1.00 0.00 H new ATOM 0 HD3 PRO B 32 11.195 13.078 -3.075 1.00 0.00 H new ATOM 510 N VAL B 33 15.825 15.258 -5.064 1.00 0.00 N ATOM 511 CA VAL B 33 16.837 15.043 -6.140 1.00 0.00 C ATOM 512 C VAL B 33 18.233 15.404 -5.626 1.00 0.00 C ATOM 513 O VAL B 33 18.472 16.506 -5.173 1.00 0.00 O ATOM 514 CB VAL B 33 16.423 15.977 -7.285 1.00 0.00 C ATOM 515 CG1 VAL B 33 15.019 15.608 -7.770 1.00 0.00 C ATOM 516 CG2 VAL B 33 16.425 17.430 -6.800 1.00 0.00 C ATOM 0 H VAL B 33 15.851 16.177 -4.622 1.00 0.00 H new ATOM 0 HA VAL B 33 16.875 14.004 -6.466 1.00 0.00 H new ATOM 0 HB VAL B 33 17.133 15.868 -8.105 1.00 0.00 H new ATOM 0 HG11 VAL B 33 14.728 16.273 -8.583 1.00 0.00 H new ATOM 0 HG12 VAL B 33 15.016 14.578 -8.126 1.00 0.00 H new ATOM 0 HG13 VAL B 33 14.311 15.710 -6.947 1.00 0.00 H new ATOM 0 HG21 VAL B 33 16.130 18.087 -7.618 1.00 0.00 H new ATOM 0 HG22 VAL B 33 15.721 17.539 -5.975 1.00 0.00 H new ATOM 0 HG23 VAL B 33 17.425 17.699 -6.461 1.00 0.00 H new ATOM 526 N ASN B 34 19.158 14.483 -5.692 1.00 0.00 N ATOM 527 CA ASN B 34 20.538 14.776 -5.205 1.00 0.00 C ATOM 528 C ASN B 34 21.567 13.997 -6.028 1.00 0.00 C ATOM 529 O ASN B 34 22.390 13.279 -5.494 1.00 0.00 O ATOM 530 CB ASN B 34 20.552 14.311 -3.748 1.00 0.00 C ATOM 531 CG ASN B 34 19.917 15.385 -2.863 1.00 0.00 C ATOM 532 OD1 ASN B 34 18.710 15.516 -2.818 1.00 0.00 O ATOM 533 ND2 ASN B 34 20.686 16.164 -2.152 1.00 0.00 N ATOM 0 H ASN B 34 19.018 13.543 -6.061 1.00 0.00 H new ATOM 0 HA ASN B 34 20.792 15.832 -5.298 1.00 0.00 H new ATOM 0 HB2 ASN B 34 20.005 13.373 -3.649 1.00 0.00 H new ATOM 0 HB3 ASN B 34 21.576 14.118 -3.427 1.00 0.00 H new ATOM 0 HD21 ASN B 34 20.274 16.883 -1.558 1.00 0.00 H new ATOM 0 HD22 ASN B 34 21.699 16.053 -2.190 1.00 0.00 H new ATOM 540 N ARG B 35 21.525 14.136 -7.325 1.00 0.00 N ATOM 541 CA ARG B 35 22.500 13.407 -8.189 1.00 0.00 C ATOM 542 C ARG B 35 23.881 14.077 -8.127 1.00 0.00 C ATOM 543 O ARG B 35 24.862 13.428 -7.824 1.00 0.00 O ATOM 544 CB ARG B 35 21.921 13.490 -9.603 1.00 0.00 C ATOM 545 CG ARG B 35 21.228 12.171 -9.953 1.00 0.00 C ATOM 546 CD ARG B 35 19.970 12.457 -10.777 1.00 0.00 C ATOM 547 NE ARG B 35 20.361 12.173 -12.189 1.00 0.00 N ATOM 548 CZ ARG B 35 20.547 10.941 -12.596 1.00 0.00 C ATOM 549 NH1 ARG B 35 20.392 9.934 -11.774 1.00 0.00 N ATOM 550 NH2 ARG B 35 20.889 10.715 -13.835 1.00 0.00 N ATOM 0 H ARG B 35 20.858 14.723 -7.825 1.00 0.00 H new ATOM 0 HA ARG B 35 22.640 12.375 -7.867 1.00 0.00 H new ATOM 0 HB2 ARG B 35 21.210 14.314 -9.668 1.00 0.00 H new ATOM 0 HB3 ARG B 35 22.715 13.697 -10.320 1.00 0.00 H new ATOM 0 HG2 ARG B 35 21.906 11.530 -10.516 1.00 0.00 H new ATOM 0 HG3 ARG B 35 20.964 11.634 -9.042 1.00 0.00 H new ATOM 0 HD2 ARG B 35 19.140 11.825 -10.462 1.00 0.00 H new ATOM 0 HD3 ARG B 35 19.646 13.491 -10.657 1.00 0.00 H new ATOM 0 HE ARG B 35 20.485 12.945 -12.844 1.00 0.00 H new ATOM 0 HH11 ARG B 35 20.124 10.104 -10.805 1.00 0.00 H new ATOM 0 HH12 ARG B 35 20.540 8.980 -12.103 1.00 0.00 H new ATOM 0 HH21 ARG B 35 21.010 11.495 -14.481 1.00 0.00 H new ATOM 0 HH22 ARG B 35 21.035 9.758 -14.157 1.00 0.00 H new ATOM 564 N PRO B 36 23.919 15.356 -8.418 1.00 0.00 N ATOM 565 CA PRO B 36 25.206 16.095 -8.389 1.00 0.00 C ATOM 566 C PRO B 36 25.639 16.357 -6.944 1.00 0.00 C ATOM 567 O PRO B 36 24.772 16.415 -6.087 1.00 0.00 O ATOM 568 CB PRO B 36 24.886 17.403 -9.106 1.00 0.00 C ATOM 569 CG PRO B 36 23.413 17.594 -8.936 1.00 0.00 C ATOM 570 CD PRO B 36 22.795 16.226 -8.796 1.00 0.00 C ATOM 571 OXT PRO B 36 26.830 16.495 -6.719 1.00 0.00 O ATOM 0 HA PRO B 36 26.024 15.548 -8.857 1.00 0.00 H new ATOM 0 HB2 PRO B 36 25.443 18.235 -8.675 1.00 0.00 H new ATOM 0 HB3 PRO B 36 25.157 17.350 -10.160 1.00 0.00 H new ATOM 0 HG2 PRO B 36 23.204 18.202 -8.056 1.00 0.00 H new ATOM 0 HG3 PRO B 36 22.992 18.119 -9.793 1.00 0.00 H new ATOM 0 HD2 PRO B 36 22.013 16.219 -8.036 1.00 0.00 H new ATOM 0 HD3 PRO B 36 22.336 15.900 -9.729 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 13.781 -19.970 1.799 1.00 1.31 P ATOM 581 OP1 G A 1 15.178 -19.976 1.297 1.00 1.51 O ATOM 582 OP2 G A 1 12.959 -21.203 1.695 1.00 1.52 O ATOM 583 O5' G A 1 12.999 -18.784 1.077 1.00 1.09 O ATOM 584 C5' G A 1 12.326 -17.769 1.844 1.00 1.03 C ATOM 585 C4' G A 1 11.121 -18.354 2.541 1.00 0.94 C ATOM 586 O4' G A 1 11.394 -18.409 3.963 1.00 1.02 O ATOM 587 C3' G A 1 9.864 -17.506 2.458 1.00 0.80 C ATOM 588 O3' G A 1 9.189 -17.720 1.211 1.00 0.75 O ATOM 589 C2' G A 1 9.067 -17.979 3.672 1.00 0.78 C ATOM 590 O2' G A 1 8.322 -19.161 3.458 1.00 0.77 O ATOM 591 C1' G A 1 10.180 -18.266 4.679 1.00 0.90 C ATOM 592 N9 G A 1 10.322 -17.167 5.624 1.00 0.90 N ATOM 593 C8 G A 1 11.257 -16.162 5.609 1.00 0.97 C ATOM 594 N7 G A 1 11.096 -15.303 6.577 1.00 0.99 N ATOM 595 C5 G A 1 9.991 -15.775 7.273 1.00 0.90 C ATOM 596 C6 G A 1 9.342 -15.261 8.419 1.00 0.88 C ATOM 597 O6 G A 1 9.623 -14.254 9.070 1.00 0.94 O ATOM 598 N1 G A 1 8.257 -16.052 8.796 1.00 0.82 N ATOM 599 C2 G A 1 7.856 -17.192 8.143 1.00 0.81 C ATOM 600 N2 G A 1 6.788 -17.827 8.649 1.00 0.83 N ATOM 601 N3 G A 1 8.455 -17.680 7.072 1.00 0.83 N ATOM 602 C4 G A 1 9.507 -16.925 6.696 1.00 0.86 C ATOM 0 H5' G A 1 12.016 -16.954 1.190 1.00 1.03 H new ATOM 0 H5'' G A 1 13.010 -17.345 2.579 1.00 1.03 H new ATOM 0 H4' G A 1 10.953 -19.313 2.050 1.00 0.94 H new ATOM 0 H3' G A 1 10.038 -16.430 2.479 1.00 0.80 H new ATOM 0 H2' G A 1 8.321 -17.242 3.968 1.00 0.78 H new ATOM 0 HO2' G A 1 8.907 -19.853 3.084 1.00 0.77 H new ATOM 0 H1' G A 1 9.937 -19.172 5.234 1.00 0.90 H new ATOM 0 H8 G A 1 12.044 -16.090 4.873 1.00 0.97 H new ATOM 0 H1 G A 1 7.723 -15.763 9.616 1.00 0.82 H new ATOM 0 H21 G A 1 6.444 -18.679 8.206 1.00 0.83 H new ATOM 0 H22 G A 1 6.320 -17.458 9.477 1.00 0.83 H new ATOM 614 P C A 2 8.243 -19.005 1.005 1.00 0.69 P ATOM 615 OP1 C A 2 8.894 -20.159 1.679 1.00 0.82 O ATOM 616 OP2 C A 2 7.905 -19.099 -0.437 1.00 0.84 O ATOM 617 O5' C A 2 6.914 -18.620 1.795 1.00 0.58 O ATOM 618 C5' C A 2 6.546 -17.240 1.981 1.00 0.57 C ATOM 619 C4' C A 2 5.322 -17.134 2.860 1.00 0.55 C ATOM 620 O4' C A 2 5.748 -17.010 4.240 1.00 0.54 O ATOM 621 C3' C A 2 4.483 -15.893 2.605 1.00 0.51 C ATOM 622 O3' C A 2 3.522 -16.150 1.586 1.00 0.59 O ATOM 623 C2' C A 2 3.807 -15.651 3.950 1.00 0.53 C ATOM 624 O2' C A 2 2.606 -16.384 4.096 1.00 0.67 O ATOM 625 C1' C A 2 4.857 -16.162 4.942 1.00 0.51 C ATOM 626 N1 C A 2 5.645 -15.085 5.554 1.00 0.45 N ATOM 627 C2 C A 2 5.208 -14.547 6.763 1.00 0.44 C ATOM 628 O2 C A 2 4.167 -14.990 7.271 1.00 0.49 O ATOM 629 N3 C A 2 5.927 -13.563 7.349 1.00 0.43 N ATOM 630 C4 C A 2 7.041 -13.117 6.767 1.00 0.45 C ATOM 631 N4 C A 2 7.719 -12.147 7.381 1.00 0.49 N ATOM 632 C5 C A 2 7.509 -13.646 5.529 1.00 0.47 C ATOM 633 C6 C A 2 6.787 -14.621 4.962 1.00 0.46 C ATOM 0 H5' C A 2 6.348 -16.777 1.014 1.00 0.57 H new ATOM 0 H5'' C A 2 7.374 -16.694 2.433 1.00 0.57 H new ATOM 0 H4' C A 2 4.731 -18.024 2.644 1.00 0.55 H new ATOM 0 H3' C A 2 5.062 -15.035 2.263 1.00 0.51 H new ATOM 0 H2' C A 2 3.519 -14.609 4.086 1.00 0.53 H new ATOM 0 HO2' C A 2 1.948 -16.068 3.442 1.00 0.67 H new ATOM 0 H1' C A 2 4.327 -16.678 5.743 1.00 0.51 H new ATOM 0 H41 C A 2 8.576 -11.781 6.965 1.00 0.49 H new ATOM 0 H42 C A 2 7.381 -11.771 8.267 1.00 0.49 H new ATOM 0 H5 C A 2 8.411 -13.275 5.066 1.00 0.47 H new ATOM 0 H6 C A 2 7.111 -15.047 4.024 1.00 0.46 H new ATOM 645 P C A 3 2.740 -14.926 0.902 1.00 0.67 P ATOM 646 OP1 C A 3 2.289 -15.354 -0.446 1.00 1.20 O ATOM 647 OP2 C A 3 3.596 -13.719 1.040 1.00 1.00 O ATOM 648 O5' C A 3 1.455 -14.730 1.822 1.00 0.89 O ATOM 649 C5' C A 3 0.967 -13.414 2.136 1.00 0.68 C ATOM 650 C4' C A 3 0.460 -13.371 3.557 1.00 0.61 C ATOM 651 O4' C A 3 1.591 -13.513 4.453 1.00 0.67 O ATOM 652 C3' C A 3 -0.165 -12.047 3.953 1.00 0.56 C ATOM 653 O3' C A 3 -1.546 -12.006 3.570 1.00 0.57 O ATOM 654 C2' C A 3 0.048 -12.002 5.464 1.00 0.57 C ATOM 655 O2' C A 3 -0.950 -12.670 6.210 1.00 0.64 O ATOM 656 C1' C A 3 1.376 -12.745 5.624 1.00 0.62 C ATOM 657 N1 C A 3 2.514 -11.825 5.771 1.00 0.61 N ATOM 658 C2 C A 3 2.600 -11.032 6.919 1.00 0.56 C ATOM 659 O2 C A 3 1.716 -11.131 7.784 1.00 0.55 O ATOM 660 N3 C A 3 3.640 -10.178 7.058 1.00 0.58 N ATOM 661 C4 C A 3 4.569 -10.102 6.104 1.00 0.65 C ATOM 662 N4 C A 3 5.578 -9.246 6.281 1.00 0.71 N ATOM 663 C5 C A 3 4.507 -10.898 4.924 1.00 0.71 C ATOM 664 C6 C A 3 3.472 -11.739 4.799 1.00 0.68 C ATOM 0 H5' C A 3 0.166 -13.141 1.448 1.00 0.68 H new ATOM 0 H5'' C A 3 1.764 -12.682 2.004 1.00 0.68 H new ATOM 0 H4' C A 3 -0.286 -14.163 3.623 1.00 0.61 H new ATOM 0 H3' C A 3 0.274 -11.179 3.461 1.00 0.56 H new ATOM 0 H2' C A 3 0.025 -10.977 5.835 1.00 0.57 H new ATOM 0 HO2' C A 3 -1.082 -13.571 5.847 1.00 0.64 H new ATOM 0 H1' C A 3 1.314 -13.360 6.522 1.00 0.62 H new ATOM 0 H41 C A 3 6.306 -9.162 5.572 1.00 0.71 H new ATOM 0 H42 C A 3 5.621 -8.676 7.126 1.00 0.71 H new ATOM 0 H5 C A 3 5.266 -10.826 4.159 1.00 0.71 H new ATOM 0 H6 C A 3 3.393 -12.358 3.918 1.00 0.68 H new ATOM 676 P C A 4 -2.655 -12.785 4.434 1.00 0.57 P ATOM 677 OP1 C A 4 -2.035 -13.998 5.026 1.00 0.73 O ATOM 678 OP2 C A 4 -3.859 -12.925 3.578 1.00 0.60 O ATOM 679 O5' C A 4 -3.006 -11.754 5.597 1.00 0.61 O ATOM 680 C5' C A 4 -3.000 -10.336 5.341 1.00 0.51 C ATOM 681 C4' C A 4 -2.889 -9.567 6.633 1.00 0.47 C ATOM 682 O4' C A 4 -1.559 -9.752 7.172 1.00 0.55 O ATOM 683 C3' C A 4 -3.032 -8.063 6.475 1.00 0.45 C ATOM 684 O3' C A 4 -4.404 -7.692 6.566 1.00 0.51 O ATOM 685 C2' C A 4 -2.236 -7.517 7.653 1.00 0.47 C ATOM 686 O2' C A 4 -3.006 -7.417 8.837 1.00 0.57 O ATOM 687 C1' C A 4 -1.140 -8.569 7.824 1.00 0.48 C ATOM 688 N1 C A 4 0.141 -8.154 7.234 1.00 0.43 N ATOM 689 C2 C A 4 0.893 -7.165 7.870 1.00 0.39 C ATOM 690 O2 C A 4 0.456 -6.650 8.911 1.00 0.43 O ATOM 691 N3 C A 4 2.077 -6.795 7.333 1.00 0.38 N ATOM 692 C4 C A 4 2.508 -7.375 6.212 1.00 0.45 C ATOM 693 N4 C A 4 3.675 -6.989 5.714 1.00 0.51 N ATOM 694 C5 C A 4 1.759 -8.380 5.548 1.00 0.51 C ATOM 695 C6 C A 4 0.594 -8.736 6.084 1.00 0.48 C ATOM 0 H5' C A 4 -3.913 -10.051 4.818 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.166 -10.082 4.687 1.00 0.51 H new ATOM 0 H4' C A 4 -3.694 -9.944 7.264 1.00 0.47 H new ATOM 0 H3' C A 4 -2.679 -7.685 5.516 1.00 0.45 H new ATOM 0 H2' C A 4 -1.874 -6.505 7.472 1.00 0.47 H new ATOM 0 HO2' C A 4 -3.922 -7.717 8.658 1.00 0.57 H new ATOM 0 H1' C A 4 -0.984 -8.716 8.893 1.00 0.48 H new ATOM 0 H41 C A 4 4.030 -7.415 4.858 1.00 0.51 H new ATOM 0 H42 C A 4 4.217 -6.266 6.187 1.00 0.51 H new ATOM 0 H5 C A 4 2.121 -8.840 4.640 1.00 0.51 H new ATOM 0 H6 C A 4 -0.002 -9.497 5.602 1.00 0.48 H new ATOM 707 P U A 5 -4.940 -6.425 5.738 1.00 0.57 P ATOM 708 OP1 U A 5 -6.418 -6.400 5.874 1.00 0.62 O ATOM 709 OP2 U A 5 -4.331 -6.467 4.392 1.00 0.77 O ATOM 710 O5' U A 5 -4.351 -5.179 6.535 1.00 0.49 O ATOM 711 C5' U A 5 -4.777 -4.919 7.881 1.00 0.45 C ATOM 712 C4' U A 5 -3.932 -3.841 8.512 1.00 0.41 C ATOM 713 O4' U A 5 -2.590 -4.340 8.731 1.00 0.47 O ATOM 714 C3' U A 5 -3.705 -2.606 7.658 1.00 0.35 C ATOM 715 O3' U A 5 -4.795 -1.692 7.760 1.00 0.36 O ATOM 716 C2' U A 5 -2.448 -2.006 8.273 1.00 0.41 C ATOM 717 O2' U A 5 -2.725 -1.141 9.359 1.00 0.50 O ATOM 718 C1' U A 5 -1.697 -3.243 8.763 1.00 0.43 C ATOM 719 N1 U A 5 -0.524 -3.524 7.927 1.00 0.43 N ATOM 720 C2 U A 5 0.555 -2.691 8.107 1.00 0.40 C ATOM 721 O2 U A 5 0.550 -1.783 8.925 1.00 0.39 O ATOM 722 N3 U A 5 1.634 -2.952 7.305 1.00 0.43 N ATOM 723 C4 U A 5 1.740 -3.937 6.357 1.00 0.50 C ATOM 724 O4 U A 5 2.785 -4.037 5.709 1.00 0.54 O ATOM 725 C5 U A 5 0.581 -4.768 6.225 1.00 0.55 C ATOM 726 C6 U A 5 -0.492 -4.540 6.999 1.00 0.51 C ATOM 0 H5' U A 5 -4.709 -5.833 8.471 1.00 0.45 H new ATOM 0 H5'' U A 5 -5.824 -4.615 7.884 1.00 0.45 H new ATOM 0 H4' U A 5 -4.490 -3.575 9.410 1.00 0.41 H new ATOM 0 H3' U A 5 -3.615 -2.833 6.596 1.00 0.35 H new ATOM 0 H2' U A 5 -1.897 -1.390 7.562 1.00 0.41 H new ATOM 0 HO2' U A 5 -3.673 -0.893 9.346 1.00 0.50 H new ATOM 0 H1' U A 5 -1.338 -3.068 9.777 1.00 0.43 H new ATOM 0 H3 U A 5 2.447 -2.348 7.426 1.00 0.43 H new ATOM 0 H5 U A 5 0.570 -5.574 5.506 1.00 0.55 H new ATOM 0 H6 U A 5 -1.359 -5.175 6.890 1.00 0.51 H new ATOM 737 P G A 6 -5.177 -0.766 6.501 1.00 0.43 P ATOM 738 OP1 G A 6 -6.658 -0.715 6.397 1.00 0.65 O ATOM 739 OP2 G A 6 -4.378 -1.247 5.345 1.00 0.54 O ATOM 740 O5' G A 6 -4.658 0.689 6.896 1.00 0.43 O ATOM 741 C5' G A 6 -3.306 0.905 7.353 1.00 0.47 C ATOM 742 C4' G A 6 -2.523 1.702 6.332 1.00 0.47 C ATOM 743 O4' G A 6 -1.132 1.302 6.396 1.00 0.53 O ATOM 744 C3' G A 6 -2.909 1.428 4.890 1.00 0.39 C ATOM 745 O3' G A 6 -4.004 2.256 4.506 1.00 0.41 O ATOM 746 C2' G A 6 -1.644 1.800 4.125 1.00 0.48 C ATOM 747 O2' G A 6 -1.585 3.176 3.795 1.00 0.59 O ATOM 748 C1' G A 6 -0.534 1.448 5.119 1.00 0.49 C ATOM 749 N9 G A 6 0.144 0.197 4.790 1.00 0.50 N ATOM 750 C8 G A 6 -0.375 -1.067 4.897 1.00 0.60 C ATOM 751 N7 G A 6 0.466 -2.000 4.543 1.00 0.63 N ATOM 752 C5 G A 6 1.612 -1.308 4.174 1.00 0.54 C ATOM 753 C6 G A 6 2.862 -1.788 3.697 1.00 0.55 C ATOM 754 O6 G A 6 3.215 -2.958 3.504 1.00 0.61 O ATOM 755 N1 G A 6 3.750 -0.748 3.438 1.00 0.55 N ATOM 756 C2 G A 6 3.469 0.584 3.616 1.00 0.57 C ATOM 757 N2 G A 6 4.460 1.444 3.309 1.00 0.70 N ATOM 758 N3 G A 6 2.308 1.045 4.061 1.00 0.53 N ATOM 759 C4 G A 6 1.433 0.050 4.318 1.00 0.49 C ATOM 0 H5' G A 6 -2.817 -0.054 7.528 1.00 0.47 H new ATOM 0 H5'' G A 6 -3.318 1.435 8.305 1.00 0.47 H new ATOM 0 H4' G A 6 -2.723 2.745 6.577 1.00 0.47 H new ATOM 0 H3' G A 6 -3.231 0.403 4.708 1.00 0.39 H new ATOM 0 H2' G A 6 -1.578 1.282 3.168 1.00 0.48 H new ATOM 0 HO2' G A 6 -1.833 3.298 2.855 1.00 0.59 H new ATOM 0 H1' G A 6 0.210 2.244 5.090 1.00 0.49 H new ATOM 0 H8 G A 6 -1.379 -1.270 5.240 1.00 0.60 H new ATOM 0 H1 G A 6 4.677 -0.993 3.091 1.00 0.55 H new ATOM 0 H21 G A 6 4.316 2.448 3.419 1.00 0.70 H new ATOM 0 H22 G A 6 5.354 1.091 2.967 1.00 0.70 H new ATOM 771 P A A 7 -4.799 1.944 3.146 1.00 0.43 P ATOM 772 OP1 A A 7 -5.516 3.177 2.731 1.00 0.66 O ATOM 773 OP2 A A 7 -5.562 0.687 3.355 1.00 0.74 O ATOM 774 O5' A A 7 -3.647 1.655 2.086 1.00 0.33 O ATOM 775 C5' A A 7 -3.955 1.461 0.694 1.00 0.29 C ATOM 776 C4' A A 7 -2.898 2.105 -0.167 1.00 0.23 C ATOM 777 O4' A A 7 -2.982 3.540 -0.029 1.00 0.23 O ATOM 778 C3' A A 7 -1.471 1.804 0.246 1.00 0.25 C ATOM 779 O3' A A 7 -1.054 0.564 -0.303 1.00 0.27 O ATOM 780 C2' A A 7 -0.694 2.968 -0.361 1.00 0.24 C ATOM 781 O2' A A 7 -0.309 2.739 -1.702 1.00 0.25 O ATOM 782 C1' A A 7 -1.714 4.104 -0.299 1.00 0.21 C ATOM 783 N9 A A 7 -1.404 5.076 0.747 1.00 0.24 N ATOM 784 C8 A A 7 -2.053 5.275 1.940 1.00 0.29 C ATOM 785 N7 A A 7 -1.527 6.226 2.674 1.00 0.33 N ATOM 786 C5 A A 7 -0.462 6.685 1.912 1.00 0.30 C ATOM 787 C6 A A 7 0.497 7.689 2.132 1.00 0.34 C ATOM 788 N6 A A 7 0.539 8.446 3.231 1.00 0.39 N ATOM 789 N1 A A 7 1.425 7.892 1.171 1.00 0.35 N ATOM 790 C2 A A 7 1.383 7.132 0.068 1.00 0.32 C ATOM 791 N3 A A 7 0.533 6.161 -0.252 1.00 0.27 N ATOM 792 C4 A A 7 -0.374 5.986 0.724 1.00 0.25 C ATOM 0 H5' A A 7 -4.931 1.890 0.467 1.00 0.29 H new ATOM 0 H5'' A A 7 -4.016 0.395 0.472 1.00 0.29 H new ATOM 0 H4' A A 7 -3.092 1.714 -1.166 1.00 0.23 H new ATOM 0 H3' A A 7 -1.330 1.715 1.323 1.00 0.25 H new ATOM 0 H2' A A 7 0.241 3.156 0.166 1.00 0.24 H new ATOM 0 HO2' A A 7 0.657 2.879 -1.794 1.00 0.25 H new ATOM 0 H1' A A 7 -1.695 4.630 -1.254 1.00 0.21 H new ATOM 0 H8 A A 7 -2.916 4.702 2.246 1.00 0.29 H new ATOM 0 H61 A A 7 1.261 9.159 3.332 1.00 0.39 H new ATOM 0 H62 A A 7 -0.151 8.311 3.970 1.00 0.39 H new ATOM 0 H2 A A 7 2.149 7.338 -0.665 1.00 0.32 H new ATOM 804 P A A 8 -0.211 -0.461 0.599 1.00 0.37 P ATOM 805 OP1 A A 8 -0.546 -1.836 0.158 1.00 0.44 O ATOM 806 OP2 A A 8 -0.409 -0.078 2.018 1.00 0.47 O ATOM 807 O5' A A 8 1.299 -0.147 0.206 1.00 0.38 O ATOM 808 C5' A A 8 1.627 0.348 -1.103 1.00 0.39 C ATOM 809 C4' A A 8 2.660 1.443 -1.007 1.00 0.43 C ATOM 810 O4' A A 8 2.050 2.612 -0.409 1.00 0.37 O ATOM 811 C3' A A 8 3.820 1.128 -0.082 1.00 0.53 C ATOM 812 O3' A A 8 4.836 0.379 -0.756 1.00 0.66 O ATOM 813 C2' A A 8 4.320 2.514 0.306 1.00 0.50 C ATOM 814 O2' A A 8 5.199 3.069 -0.651 1.00 0.58 O ATOM 815 C1' A A 8 3.022 3.326 0.336 1.00 0.38 C ATOM 816 N9 A A 8 2.505 3.511 1.690 1.00 0.36 N ATOM 817 C8 A A 8 1.462 2.849 2.283 1.00 0.42 C ATOM 818 N7 A A 8 1.222 3.237 3.512 1.00 0.47 N ATOM 819 C5 A A 8 2.175 4.218 3.745 1.00 0.41 C ATOM 820 C6 A A 8 2.455 5.019 4.865 1.00 0.44 C ATOM 821 N6 A A 8 1.770 4.957 6.010 1.00 0.54 N ATOM 822 N1 A A 8 3.476 5.899 4.769 1.00 0.40 N ATOM 823 C2 A A 8 4.163 5.960 3.621 1.00 0.36 C ATOM 824 N3 A A 8 3.995 5.260 2.501 1.00 0.35 N ATOM 825 C4 A A 8 2.973 4.397 2.631 1.00 0.35 C ATOM 0 H5' A A 8 0.729 0.728 -1.591 1.00 0.39 H new ATOM 0 H5'' A A 8 2.006 -0.465 -1.722 1.00 0.39 H new ATOM 0 H4' A A 8 3.023 1.577 -2.026 1.00 0.43 H new ATOM 0 H3' A A 8 3.537 0.514 0.773 1.00 0.53 H new ATOM 0 H2' A A 8 4.885 2.500 1.238 1.00 0.50 H new ATOM 0 HO2' A A 8 4.812 2.971 -1.546 1.00 0.58 H new ATOM 0 H1' A A 8 3.231 4.312 -0.079 1.00 0.38 H new ATOM 0 H8 A A 8 0.891 2.080 1.785 1.00 0.42 H new ATOM 0 H61 A A 8 2.022 5.566 6.789 1.00 0.54 H new ATOM 0 H62 A A 8 0.995 4.301 6.106 1.00 0.54 H new ATOM 0 H2 A A 8 4.968 6.680 3.601 1.00 0.36 H new ATOM 837 P A A 9 4.915 0.394 -2.363 1.00 1.47 P ATOM 838 OP1 A A 9 4.965 1.806 -2.813 1.00 2.35 O ATOM 839 OP2 A A 9 3.848 -0.502 -2.875 1.00 2.33 O ATOM 840 O5' A A 9 6.322 -0.279 -2.689 1.00 1.08 O ATOM 841 C5' A A 9 7.462 -0.038 -1.851 1.00 1.04 C ATOM 842 C4' A A 9 8.146 1.243 -2.257 1.00 1.09 C ATOM 843 O4' A A 9 7.568 1.713 -3.499 1.00 1.26 O ATOM 844 C3' A A 9 7.913 2.399 -1.306 1.00 0.99 C ATOM 845 O3' A A 9 8.814 2.346 -0.210 1.00 1.17 O ATOM 846 C2' A A 9 8.169 3.610 -2.192 1.00 1.26 C ATOM 847 O2' A A 9 9.546 3.921 -2.306 1.00 1.57 O ATOM 848 C1' A A 9 7.627 3.129 -3.542 1.00 1.29 C ATOM 849 N9 A A 9 6.275 3.619 -3.804 1.00 0.00 N ATOM 850 C8 A A 9 5.508 4.427 -3.003 1.00 0.00 C ATOM 851 N7 A A 9 4.327 4.697 -3.502 1.00 0.00 N ATOM 852 C5 A A 9 4.313 4.019 -4.712 1.00 0.00 C ATOM 853 C6 A A 9 3.339 3.899 -5.716 1.00 0.00 C ATOM 854 N6 A A 9 2.141 4.487 -5.663 1.00 0.00 N ATOM 855 N1 A A 9 3.641 3.144 -6.795 1.00 0.00 N ATOM 856 C2 A A 9 4.841 2.553 -6.847 1.00 0.00 C ATOM 857 N3 A A 9 5.838 2.592 -5.968 1.00 0.00 N ATOM 858 C4 A A 9 5.507 3.350 -4.911 1.00 0.00 C ATOM 0 H5' A A 9 8.161 -0.871 -1.927 1.00 1.04 H new ATOM 0 H5'' A A 9 7.150 0.023 -0.808 1.00 1.04 H new ATOM 0 H4' A A 9 9.206 0.992 -2.299 1.00 1.09 H new ATOM 0 H3' A A 9 6.922 2.404 -0.852 1.00 0.99 H new ATOM 0 H2' A A 9 7.709 4.519 -1.804 1.00 1.26 H new ATOM 0 HO2' A A 9 10.047 3.446 -1.610 1.00 1.57 H new ATOM 0 H1' A A 9 8.284 3.504 -4.327 1.00 1.29 H new ATOM 0 H8 A A 9 5.846 4.805 -2.050 1.00 0.00 H new ATOM 0 H61 A A 9 1.477 4.360 -6.426 1.00 0.00 H new ATOM 0 H62 A A 9 1.891 5.063 -4.859 1.00 0.00 H new ATOM 0 H2 A A 9 5.026 1.959 -7.730 1.00 0.00 H new ATOM 870 P A A 10 8.515 1.350 1.015 1.00 1.33 P ATOM 871 OP1 A A 10 8.929 -0.017 0.613 1.00 2.11 O ATOM 872 OP2 A A 10 7.112 1.592 1.480 1.00 2.10 O ATOM 873 O5' A A 10 9.505 1.853 2.156 1.00 0.79 O ATOM 874 C5' A A 10 9.089 1.855 3.525 1.00 0.59 C ATOM 875 C4' A A 10 9.212 3.238 4.112 1.00 0.54 C ATOM 876 O4' A A 10 7.936 3.905 3.985 1.00 0.50 O ATOM 877 C3' A A 10 9.505 3.236 5.599 1.00 0.50 C ATOM 878 O3' A A 10 10.914 3.202 5.824 1.00 0.61 O ATOM 879 C2' A A 10 8.866 4.526 6.093 1.00 0.50 C ATOM 880 O2' A A 10 9.729 5.641 5.982 1.00 0.61 O ATOM 881 C1' A A 10 7.679 4.685 5.138 1.00 0.48 C ATOM 882 N9 A A 10 6.430 4.180 5.695 1.00 0.45 N ATOM 883 C8 A A 10 5.620 3.227 5.135 1.00 0.45 C ATOM 884 N7 A A 10 4.553 2.955 5.844 1.00 0.51 N ATOM 885 C5 A A 10 4.672 3.785 6.951 1.00 0.54 C ATOM 886 C6 A A 10 3.862 3.975 8.085 1.00 0.64 C ATOM 887 N6 A A 10 2.722 3.315 8.299 1.00 0.72 N ATOM 888 N1 A A 10 4.270 4.877 9.002 1.00 0.69 N ATOM 889 C2 A A 10 5.416 5.538 8.786 1.00 0.66 C ATOM 890 N3 A A 10 6.259 5.448 7.764 1.00 0.58 N ATOM 891 C4 A A 10 5.825 4.545 6.871 1.00 0.51 C ATOM 0 H5' A A 10 9.698 1.155 4.097 1.00 0.59 H new ATOM 0 H5'' A A 10 8.057 1.513 3.598 1.00 0.59 H new ATOM 0 H4' A A 10 10.029 3.723 3.578 1.00 0.54 H new ATOM 0 H3' A A 10 9.111 2.366 6.125 1.00 0.50 H new ATOM 0 H2' A A 10 8.603 4.480 7.150 1.00 0.50 H new ATOM 0 HO2' A A 10 10.658 5.333 5.943 1.00 0.61 H new ATOM 0 H1' A A 10 7.573 5.751 4.935 1.00 0.48 H new ATOM 0 H8 A A 10 5.841 2.744 4.195 1.00 0.45 H new ATOM 0 H61 A A 10 2.178 3.497 9.142 1.00 0.72 H new ATOM 0 H62 A A 10 2.395 2.628 7.619 1.00 0.72 H new ATOM 0 H2 A A 10 5.694 6.245 9.553 1.00 0.66 H new ATOM 903 P A A 11 11.494 2.531 7.164 1.00 0.62 P ATOM 904 OP1 A A 11 12.587 3.404 7.662 1.00 0.65 O ATOM 905 OP2 A A 11 11.767 1.098 6.886 1.00 0.77 O ATOM 906 O5' A A 11 10.284 2.618 8.195 1.00 0.58 O ATOM 907 C5' A A 11 10.237 3.651 9.198 1.00 0.56 C ATOM 908 C4' A A 11 8.909 3.614 9.916 1.00 0.49 C ATOM 909 O4' A A 11 7.866 3.420 8.929 1.00 0.46 O ATOM 910 C3' A A 11 8.748 2.452 10.881 1.00 0.47 C ATOM 911 O3' A A 11 9.247 2.823 12.170 1.00 0.51 O ATOM 912 C2' A A 11 7.240 2.219 10.888 1.00 0.43 C ATOM 913 O2' A A 11 6.561 3.047 11.813 1.00 0.47 O ATOM 914 C1' A A 11 6.836 2.614 9.467 1.00 0.42 C ATOM 915 N9 A A 11 6.669 1.471 8.569 1.00 0.41 N ATOM 916 C8 A A 11 7.577 0.988 7.658 1.00 0.46 C ATOM 917 N7 A A 11 7.139 -0.038 6.968 1.00 0.47 N ATOM 918 C5 A A 11 5.859 -0.250 7.460 1.00 0.42 C ATOM 919 C6 A A 11 4.865 -1.194 7.143 1.00 0.43 C ATOM 920 N6 A A 11 4.998 -2.149 6.213 1.00 0.49 N ATOM 921 N1 A A 11 3.702 -1.127 7.826 1.00 0.40 N ATOM 922 C2 A A 11 3.556 -0.177 8.759 1.00 0.37 C ATOM 923 N3 A A 11 4.412 0.764 9.144 1.00 0.37 N ATOM 924 C4 A A 11 5.558 0.672 8.449 1.00 0.39 C ATOM 0 H5' A A 11 10.382 4.627 8.734 1.00 0.56 H new ATOM 0 H5'' A A 11 11.049 3.514 9.912 1.00 0.56 H new ATOM 0 H4' A A 11 8.852 4.549 10.473 1.00 0.49 H new ATOM 0 H3' A A 11 9.298 1.553 10.603 1.00 0.47 H new ATOM 0 H2' A A 11 6.990 1.198 11.175 1.00 0.43 H new ATOM 0 HO2' A A 11 6.569 2.625 12.697 1.00 0.47 H new ATOM 0 H1' A A 11 5.877 3.127 9.538 1.00 0.42 H new ATOM 0 H8 A A 11 8.560 1.414 7.523 1.00 0.46 H new ATOM 0 H61 A A 11 4.233 -2.800 6.037 1.00 0.49 H new ATOM 0 H62 A A 11 5.865 -2.225 5.681 1.00 0.49 H new ATOM 0 H2 A A 11 2.606 -0.175 9.272 1.00 0.37 H new ATOM 936 P G A 12 8.746 2.050 13.493 1.00 0.56 P ATOM 937 OP1 G A 12 7.298 1.778 13.340 1.00 0.68 O ATOM 938 OP2 G A 12 9.216 2.825 14.668 1.00 0.65 O ATOM 939 O5' G A 12 9.554 0.673 13.487 1.00 0.50 O ATOM 940 C5' G A 12 9.049 -0.511 12.823 1.00 0.47 C ATOM 941 C4' G A 12 7.552 -0.610 12.978 1.00 0.42 C ATOM 942 O4' G A 12 6.969 -0.362 11.678 1.00 0.40 O ATOM 943 C3' G A 12 7.023 -1.978 13.367 1.00 0.39 C ATOM 944 O3' G A 12 6.995 -2.123 14.784 1.00 0.43 O ATOM 945 C2' G A 12 5.611 -1.971 12.789 1.00 0.35 C ATOM 946 O2' G A 12 4.669 -1.369 13.656 1.00 0.37 O ATOM 947 C1' G A 12 5.784 -1.116 11.531 1.00 0.35 C ATOM 948 N9 G A 12 5.930 -1.939 10.337 1.00 0.33 N ATOM 949 C8 G A 12 6.980 -1.930 9.452 1.00 0.36 C ATOM 950 N7 G A 12 6.830 -2.781 8.475 1.00 0.36 N ATOM 951 C5 G A 12 5.609 -3.389 8.732 1.00 0.33 C ATOM 952 C6 G A 12 4.918 -4.395 8.016 1.00 0.36 C ATOM 953 O6 G A 12 5.259 -4.972 6.977 1.00 0.40 O ATOM 954 N1 G A 12 3.708 -4.720 8.623 1.00 0.36 N ATOM 955 C2 G A 12 3.232 -4.149 9.778 1.00 0.34 C ATOM 956 N2 G A 12 2.044 -4.597 10.212 1.00 0.37 N ATOM 957 N3 G A 12 3.868 -3.208 10.455 1.00 0.31 N ATOM 958 C4 G A 12 5.042 -2.879 9.878 1.00 0.31 C ATOM 0 H5' G A 12 9.523 -1.399 13.242 1.00 0.47 H new ATOM 0 H5'' G A 12 9.309 -0.480 11.765 1.00 0.47 H new ATOM 0 H4' G A 12 7.296 0.095 13.769 1.00 0.42 H new ATOM 0 H3' G A 12 7.634 -2.802 12.999 1.00 0.39 H new ATOM 0 H2' G A 12 5.228 -2.977 12.615 1.00 0.35 H new ATOM 0 HO2' G A 12 5.045 -1.313 14.559 1.00 0.37 H new ATOM 0 H1' G A 12 4.901 -0.487 11.417 1.00 0.35 H new ATOM 0 H8 G A 12 7.840 -1.285 9.554 1.00 0.36 H new ATOM 0 H1 G A 12 3.133 -5.435 8.177 1.00 0.36 H new ATOM 0 H21 G A 12 1.635 -4.214 11.064 1.00 0.37 H new ATOM 0 H22 G A 12 1.550 -5.321 9.690 1.00 0.37 H new ATOM 970 P G A 13 7.616 -3.441 15.462 1.00 0.51 P ATOM 971 OP1 G A 13 8.026 -3.103 16.849 1.00 0.57 O ATOM 972 OP2 G A 13 8.617 -3.998 14.517 1.00 0.59 O ATOM 973 O5' G A 13 6.388 -4.453 15.536 1.00 0.57 O ATOM 974 C5' G A 13 5.171 -4.088 16.213 1.00 0.62 C ATOM 975 C4' G A 13 4.075 -5.068 15.880 1.00 0.60 C ATOM 976 O4' G A 13 3.664 -4.839 14.509 1.00 0.59 O ATOM 977 C3' G A 13 4.508 -6.520 15.914 1.00 0.59 C ATOM 978 O3' G A 13 4.368 -7.064 17.230 1.00 0.66 O ATOM 979 C2' G A 13 3.559 -7.182 14.921 1.00 0.57 C ATOM 980 O2' G A 13 2.333 -7.595 15.493 1.00 0.63 O ATOM 981 C1' G A 13 3.314 -6.067 13.904 1.00 0.54 C ATOM 982 N9 G A 13 4.128 -6.226 12.703 1.00 0.50 N ATOM 983 C8 G A 13 5.292 -5.565 12.395 1.00 0.54 C ATOM 984 N7 G A 13 5.796 -5.925 11.247 1.00 0.56 N ATOM 985 C5 G A 13 4.911 -6.880 10.767 1.00 0.50 C ATOM 986 C6 G A 13 4.934 -7.631 9.563 1.00 0.53 C ATOM 987 O6 G A 13 5.767 -7.598 8.652 1.00 0.60 O ATOM 988 N1 G A 13 3.842 -8.491 9.473 1.00 0.51 N ATOM 989 C2 G A 13 2.858 -8.610 10.425 1.00 0.48 C ATOM 990 N2 G A 13 1.885 -9.495 10.159 1.00 0.52 N ATOM 991 N3 G A 13 2.827 -7.917 11.550 1.00 0.47 N ATOM 992 C4 G A 13 3.876 -7.078 11.655 1.00 0.47 C ATOM 0 H5' G A 13 4.871 -3.082 15.919 1.00 0.62 H new ATOM 0 H5'' G A 13 5.337 -4.069 17.290 1.00 0.62 H new ATOM 0 H4' G A 13 3.299 -4.908 16.628 1.00 0.60 H new ATOM 0 H3' G A 13 5.557 -6.670 15.657 1.00 0.59 H new ATOM 0 H2' G A 13 3.984 -8.098 14.511 1.00 0.57 H new ATOM 0 HO2' G A 13 1.890 -6.826 15.908 1.00 0.63 H new ATOM 0 H1' G A 13 2.265 -6.101 13.610 1.00 0.54 H new ATOM 0 H8 G A 13 5.744 -4.823 13.037 1.00 0.54 H new ATOM 0 H1 G A 13 3.767 -9.075 8.640 1.00 0.51 H new ATOM 0 H21 G A 13 1.124 -9.632 10.824 1.00 0.52 H new ATOM 0 H22 G A 13 1.906 -10.031 9.291 1.00 0.52 H new ATOM 1004 P G A 14 2.932 -7.073 17.957 1.00 0.74 P ATOM 1005 OP1 G A 14 2.013 -6.159 17.232 1.00 0.90 O ATOM 1006 OP2 G A 14 3.173 -6.868 19.409 1.00 0.80 O ATOM 1007 O5' G A 14 2.412 -8.564 17.756 1.00 0.68 O ATOM 1008 C5' G A 14 3.312 -9.609 17.339 1.00 0.70 C ATOM 1009 C4' G A 14 2.585 -10.614 16.481 1.00 0.68 C ATOM 1010 O4' G A 14 2.546 -10.104 15.126 1.00 0.67 O ATOM 1011 C3' G A 14 3.286 -11.953 16.357 1.00 0.67 C ATOM 1012 O3' G A 14 2.904 -12.820 17.419 1.00 0.77 O ATOM 1013 C2' G A 14 2.791 -12.471 15.013 1.00 0.67 C ATOM 1014 O2' G A 14 1.547 -13.140 15.107 1.00 0.80 O ATOM 1015 C1' G A 14 2.622 -11.180 14.211 1.00 0.61 C ATOM 1016 N9 G A 14 3.754 -10.929 13.327 1.00 0.50 N ATOM 1017 C8 G A 14 4.760 -10.013 13.514 1.00 0.50 C ATOM 1018 N7 G A 14 5.642 -10.019 12.553 1.00 0.47 N ATOM 1019 C5 G A 14 5.192 -11.002 11.681 1.00 0.41 C ATOM 1020 C6 G A 14 5.738 -11.462 10.456 1.00 0.40 C ATOM 1021 O6 G A 14 6.763 -11.079 9.882 1.00 0.45 O ATOM 1022 N1 G A 14 4.961 -12.474 9.892 1.00 0.41 N ATOM 1023 C2 G A 14 3.806 -12.973 10.446 1.00 0.46 C ATOM 1024 N2 G A 14 3.194 -13.947 9.759 1.00 0.55 N ATOM 1025 N3 G A 14 3.288 -12.551 11.587 1.00 0.49 N ATOM 1026 C4 G A 14 4.027 -11.571 12.145 1.00 0.44 C ATOM 0 H5' G A 14 3.734 -10.105 18.213 1.00 0.70 H new ATOM 0 H5'' G A 14 4.145 -9.180 16.782 1.00 0.70 H new ATOM 0 H4' G A 14 1.614 -10.757 16.956 1.00 0.68 H new ATOM 0 H3' G A 14 4.372 -11.885 16.413 1.00 0.67 H new ATOM 0 H2' G A 14 3.473 -13.201 14.577 1.00 0.67 H new ATOM 0 HO2' G A 14 1.275 -13.451 14.218 1.00 0.80 H new ATOM 0 H1' G A 14 1.723 -11.276 13.602 1.00 0.61 H new ATOM 0 H8 G A 14 4.815 -9.355 14.369 1.00 0.50 H new ATOM 0 H1 G A 14 5.272 -12.872 9.006 1.00 0.41 H new ATOM 0 H21 G A 14 2.332 -14.359 10.117 1.00 0.55 H new ATOM 0 H22 G A 14 3.590 -14.276 8.878 1.00 0.55 H new ATOM 1038 P C A 15 3.938 -13.928 17.950 1.00 0.87 P ATOM 1039 OP1 C A 15 3.395 -14.472 19.221 1.00 0.91 O ATOM 1040 OP2 C A 15 5.302 -13.343 17.926 1.00 1.02 O ATOM 1041 O5' C A 15 3.862 -15.074 16.847 1.00 0.85 O ATOM 1042 C5' C A 15 2.597 -15.635 16.460 1.00 0.94 C ATOM 1043 C4' C A 15 2.760 -16.497 15.231 1.00 0.97 C ATOM 1044 O4' C A 15 3.030 -15.654 14.087 1.00 0.84 O ATOM 1045 C3' C A 15 3.961 -17.421 15.271 1.00 1.09 C ATOM 1046 O3' C A 15 3.651 -18.631 15.972 1.00 1.31 O ATOM 1047 C2' C A 15 4.217 -17.698 13.793 1.00 1.09 C ATOM 1048 O2' C A 15 3.460 -18.787 13.297 1.00 1.30 O ATOM 1049 C1' C A 15 3.764 -16.396 13.130 1.00 0.89 C ATOM 1050 N1 C A 15 4.905 -15.590 12.678 1.00 0.75 N ATOM 1051 C2 C A 15 5.612 -16.013 11.551 1.00 0.77 C ATOM 1052 O2 C A 15 5.248 -17.042 10.966 1.00 0.89 O ATOM 1053 N3 C A 15 6.670 -15.297 11.129 1.00 0.70 N ATOM 1054 C4 C A 15 7.032 -14.198 11.782 1.00 0.66 C ATOM 1055 N4 C A 15 8.083 -13.531 11.321 1.00 0.71 N ATOM 1056 C5 C A 15 6.331 -13.738 12.934 1.00 0.64 C ATOM 1057 C6 C A 15 5.280 -14.458 13.346 1.00 0.66 C ATOM 0 H5' C A 15 1.883 -14.836 16.260 1.00 0.94 H new ATOM 0 H5'' C A 15 2.190 -16.229 17.278 1.00 0.94 H new ATOM 0 H4' C A 15 1.837 -17.074 15.179 1.00 0.97 H new ATOM 0 H3' C A 15 4.821 -16.995 15.788 1.00 1.09 H new ATOM 0 H2' C A 15 5.254 -17.972 13.601 1.00 1.09 H new ATOM 0 HO2' C A 15 3.109 -19.311 14.048 1.00 1.30 H new ATOM 0 HO3' C A 15 4.439 -19.213 15.984 1.00 1.31 H new ATOM 0 H1' C A 15 3.159 -16.638 12.256 1.00 0.89 H new ATOM 0 H41 C A 15 8.395 -12.682 11.792 1.00 0.71 H new ATOM 0 H42 C A 15 8.579 -13.868 10.496 1.00 0.71 H new ATOM 0 H5 C A 15 6.636 -12.843 13.455 1.00 0.64 H new ATOM 0 H6 C A 15 4.723 -14.141 14.215 1.00 0.66 H new TER 1069 C A 15