USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=19 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 50:sc= -5.75! USER MOD Single : A 2 C O2' : rot -87:sc= 0.987 USER MOD Single : A 3 C O2' : rot 49:sc= -6.42! USER MOD Single : A 4 C O2' : rot 54:sc= -6.15! USER MOD Single : A 5 U O2' : rot -15:sc= 0.0589 USER MOD Single : A 6 G O2' : rot -166:sc= 0.166 USER MOD Single : A 7 A O2' : rot 180:sc= -5.08! USER MOD Single : A 8 A O2' : rot 59:sc= -2.8! USER MOD Single : A 9 A O2' : rot -14:sc= 0.14 USER MOD Single : A 10 A O2' : rot -13:sc= 0.111 USER MOD Single : A 11 A O2' : rot -22:sc= 0.166 USER MOD Single : A 12 G O2' : rot -15:sc= 0.169 USER MOD Single : A 13 G O2' : rot 58:sc= -5.27! USER MOD Single : A 14 G O2' : rot 180:sc= -1.96! USER MOD Single : A 15 C O2' : rot -24:sc= 0.192 USER MOD Single : A 15 C O3' : rot 180:sc= 0.163 USER MOD Single : B 4 GLN : amide:sc= -2.08 K(o=-2.1,f=-3.6!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0.0023 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 GLN : amide:sc= -4.77 K(o=-4.8,f=-3.4) USER MOD Single : B 17 GLN : amide:sc= -1.13 X(o=-1.1,f=-1.5) USER MOD Single : B 19 LYS NZ :NH3+ 157:sc= -0.136 (180deg=-0.342) USER MOD Single : B 22 ASN : amide:sc= -6.24! C(o=-6.2!,f=-5.6!) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 ASN : amide:sc= -0.283 K(o=-0.28,f=-1.5) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 9.972 -10.811 -0.883 1.00 0.76 N ATOM 2 CA ASP B 2 9.460 -11.587 0.285 1.00 0.88 C ATOM 3 C ASP B 2 7.943 -11.746 0.189 1.00 0.68 C ATOM 4 O ASP B 2 7.353 -11.585 -0.860 1.00 0.66 O ATOM 5 CB ASP B 2 9.827 -10.764 1.524 1.00 1.25 C ATOM 6 CG ASP B 2 11.302 -10.355 1.463 1.00 1.88 C ATOM 7 OD1 ASP B 2 11.595 -9.365 0.813 1.00 2.37 O ATOM 8 OD2 ASP B 2 12.113 -11.039 2.066 1.00 2.35 O ATOM 0 HA ASP B 2 9.891 -12.588 0.323 1.00 0.88 H new ATOM 0 HB2 ASP B 2 9.197 -9.876 1.581 1.00 1.25 H new ATOM 0 HB3 ASP B 2 9.640 -11.346 2.426 1.00 1.25 H new ATOM 15 N ALA B 3 7.316 -12.060 1.285 1.00 0.63 N ATOM 16 CA ALA B 3 5.834 -12.234 1.281 1.00 0.58 C ATOM 17 C ALA B 3 5.139 -10.875 1.279 1.00 0.63 C ATOM 18 O ALA B 3 4.107 -10.697 0.661 1.00 0.61 O ATOM 19 CB ALA B 3 5.520 -12.996 2.567 1.00 0.75 C ATOM 0 H ALA B 3 7.766 -12.205 2.189 1.00 0.63 H new ATOM 0 HA ALA B 3 5.485 -12.767 0.396 1.00 0.58 H new ATOM 0 HB1 ALA B 3 4.445 -13.164 2.637 1.00 0.75 H new ATOM 0 HB2 ALA B 3 6.037 -13.956 2.557 1.00 0.75 H new ATOM 0 HB3 ALA B 3 5.853 -12.413 3.426 1.00 0.75 H new ATOM 25 N GLN B 4 5.698 -9.914 1.959 1.00 0.75 N ATOM 26 CA GLN B 4 5.065 -8.566 1.983 1.00 0.89 C ATOM 27 C GLN B 4 5.187 -7.926 0.614 1.00 0.79 C ATOM 28 O GLN B 4 4.204 -7.519 0.024 1.00 0.81 O ATOM 29 CB GLN B 4 5.843 -7.767 3.029 1.00 1.09 C ATOM 30 CG GLN B 4 5.072 -6.492 3.378 1.00 1.29 C ATOM 31 CD GLN B 4 5.842 -5.705 4.440 1.00 0.85 C ATOM 32 OE1 GLN B 4 6.291 -6.264 5.421 1.00 1.14 O ATOM 33 NE2 GLN B 4 6.017 -4.421 4.284 1.00 0.94 N ATOM 0 H GLN B 4 6.561 -10.002 2.496 1.00 0.75 H new ATOM 0 HA GLN B 4 4.004 -8.607 2.229 1.00 0.89 H new ATOM 0 HB2 GLN B 4 5.993 -8.370 3.924 1.00 1.09 H new ATOM 0 HB3 GLN B 4 6.832 -7.513 2.646 1.00 1.09 H new ATOM 0 HG2 GLN B 4 4.935 -5.881 2.486 1.00 1.29 H new ATOM 0 HG3 GLN B 4 4.078 -6.745 3.747 1.00 1.29 H new ATOM 0 HE21 GLN B 4 5.640 -3.951 3.461 1.00 0.94 H new ATOM 0 HE22 GLN B 4 6.530 -3.887 4.985 1.00 0.94 H new ATOM 42 N THR B 5 6.378 -7.858 0.086 1.00 0.76 N ATOM 43 CA THR B 5 6.543 -7.272 -1.274 1.00 0.79 C ATOM 44 C THR B 5 5.543 -7.958 -2.200 1.00 0.59 C ATOM 45 O THR B 5 4.954 -7.349 -3.071 1.00 0.57 O ATOM 46 CB THR B 5 7.977 -7.591 -1.687 1.00 0.94 C ATOM 47 OG1 THR B 5 8.881 -7.032 -0.743 1.00 1.26 O ATOM 48 CG2 THR B 5 8.238 -6.991 -3.066 1.00 0.94 C ATOM 0 H THR B 5 7.237 -8.180 0.532 1.00 0.76 H new ATOM 0 HA THR B 5 6.366 -6.197 -1.310 1.00 0.79 H new ATOM 0 HB THR B 5 8.121 -8.671 -1.721 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.801 -7.239 -1.009 1.00 1.26 H new ATOM 0 HG21 THR B 5 9.260 -7.213 -3.372 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.542 -7.420 -3.787 1.00 0.94 H new ATOM 0 HG23 THR B 5 8.098 -5.911 -3.025 1.00 0.94 H new ATOM 56 N ARG B 6 5.321 -9.223 -1.968 1.00 0.48 N ATOM 57 CA ARG B 6 4.324 -9.972 -2.774 1.00 0.46 C ATOM 58 C ARG B 6 2.943 -9.499 -2.377 1.00 0.43 C ATOM 59 O ARG B 6 2.087 -9.246 -3.202 1.00 0.45 O ATOM 60 CB ARG B 6 4.470 -11.430 -2.355 1.00 0.56 C ATOM 61 CG ARG B 6 4.953 -12.268 -3.542 1.00 0.78 C ATOM 62 CD ARG B 6 4.569 -13.733 -3.323 1.00 1.03 C ATOM 63 NE ARG B 6 5.466 -14.206 -2.229 1.00 0.88 N ATOM 64 CZ ARG B 6 6.736 -14.438 -2.456 1.00 0.73 C ATOM 65 NH1 ARG B 6 7.247 -14.258 -3.648 1.00 1.26 N ATOM 66 NH2 ARG B 6 7.500 -14.851 -1.483 1.00 1.43 N ATOM 0 H ARG B 6 5.793 -9.771 -1.249 1.00 0.48 H new ATOM 0 HA ARG B 6 4.468 -9.834 -3.845 1.00 0.46 H new ATOM 0 HB2 ARG B 6 5.177 -11.511 -1.530 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.515 -11.811 -1.994 1.00 0.56 H new ATOM 0 HG2 ARG B 6 4.508 -11.899 -4.466 1.00 0.78 H new ATOM 0 HG3 ARG B 6 6.034 -12.177 -3.649 1.00 0.78 H new ATOM 0 HD2 ARG B 6 3.520 -13.829 -3.043 1.00 1.03 H new ATOM 0 HD3 ARG B 6 4.711 -14.319 -4.231 1.00 1.03 H new ATOM 0 HE ARG B 6 5.087 -14.351 -1.293 1.00 0.88 H new ATOM 0 HH11 ARG B 6 6.655 -13.934 -4.413 1.00 1.26 H new ATOM 0 HH12 ARG B 6 8.237 -14.442 -3.812 1.00 1.26 H new ATOM 0 HH21 ARG B 6 7.108 -14.992 -0.552 1.00 1.43 H new ATOM 0 HH22 ARG B 6 8.489 -15.033 -1.653 1.00 1.43 H new ATOM 80 N ARG B 7 2.722 -9.393 -1.095 1.00 0.61 N ATOM 81 CA ARG B 7 1.395 -8.952 -0.610 1.00 0.80 C ATOM 82 C ARG B 7 1.070 -7.582 -1.212 1.00 0.65 C ATOM 83 O ARG B 7 -0.067 -7.275 -1.507 1.00 0.56 O ATOM 84 CB ARG B 7 1.547 -8.884 0.913 1.00 1.16 C ATOM 85 CG ARG B 7 0.414 -8.061 1.541 1.00 1.10 C ATOM 86 CD ARG B 7 0.888 -7.480 2.876 1.00 0.92 C ATOM 87 NE ARG B 7 0.794 -5.997 2.713 1.00 0.41 N ATOM 88 CZ ARG B 7 1.741 -5.328 2.105 1.00 0.93 C ATOM 89 NH1 ARG B 7 2.792 -5.940 1.625 1.00 1.61 N ATOM 90 NH2 ARG B 7 1.631 -4.034 1.977 1.00 1.08 N ATOM 0 H ARG B 7 3.407 -9.594 -0.366 1.00 0.61 H new ATOM 0 HA ARG B 7 0.581 -9.618 -0.894 1.00 0.80 H new ATOM 0 HB2 ARG B 7 1.543 -9.892 1.328 1.00 1.16 H new ATOM 0 HB3 ARG B 7 2.509 -8.439 1.167 1.00 1.16 H new ATOM 0 HG2 ARG B 7 0.116 -7.258 0.867 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -0.464 -8.689 1.696 1.00 1.10 H new ATOM 0 HD2 ARG B 7 0.264 -7.826 3.700 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.910 -7.788 3.099 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.018 -5.500 3.080 1.00 0.41 H new ATOM 0 HH11 ARG B 7 2.882 -6.951 1.722 1.00 1.61 H new ATOM 0 HH12 ARG B 7 3.522 -5.406 1.154 1.00 1.61 H new ATOM 0 HH21 ARG B 7 0.812 -3.552 2.349 1.00 1.08 H new ATOM 0 HH22 ARG B 7 2.364 -3.504 1.505 1.00 1.08 H new ATOM 104 N ARG B 8 2.072 -6.766 -1.411 1.00 0.68 N ATOM 105 CA ARG B 8 1.838 -5.419 -2.015 1.00 0.67 C ATOM 106 C ARG B 8 1.121 -5.588 -3.337 1.00 0.48 C ATOM 107 O ARG B 8 0.198 -4.861 -3.651 1.00 0.50 O ATOM 108 CB ARG B 8 3.234 -4.829 -2.226 1.00 0.77 C ATOM 109 CG ARG B 8 3.160 -3.301 -2.229 1.00 0.73 C ATOM 110 CD ARG B 8 3.071 -2.788 -0.790 1.00 0.73 C ATOM 111 NE ARG B 8 4.282 -3.334 -0.107 1.00 0.85 N ATOM 112 CZ ARG B 8 5.469 -2.831 -0.342 1.00 1.05 C ATOM 113 NH1 ARG B 8 5.622 -1.839 -1.180 1.00 1.43 N ATOM 114 NH2 ARG B 8 6.510 -3.328 0.267 1.00 1.16 N ATOM 0 H ARG B 8 3.044 -6.974 -1.181 1.00 0.68 H new ATOM 0 HA ARG B 8 1.224 -4.772 -1.389 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.904 -5.167 -1.436 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.649 -5.183 -3.170 1.00 0.77 H new ATOM 0 HG2 ARG B 8 4.040 -2.885 -2.720 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.291 -2.970 -2.798 1.00 0.73 H new ATOM 0 HD2 ARG B 8 3.059 -1.698 -0.760 1.00 0.73 H new ATOM 0 HD3 ARG B 8 2.157 -3.130 -0.305 1.00 0.73 H new ATOM 0 HE ARG B 8 4.184 -4.108 0.550 1.00 0.85 H new ATOM 0 HH11 ARG B 8 4.812 -1.447 -1.660 1.00 1.43 H new ATOM 0 HH12 ARG B 8 6.552 -1.457 -1.354 1.00 1.43 H new ATOM 0 HH21 ARG B 8 6.397 -4.103 0.921 1.00 1.16 H new ATOM 0 HH22 ARG B 8 7.437 -2.942 0.089 1.00 1.16 H new ATOM 128 N GLU B 9 1.497 -6.573 -4.097 1.00 0.38 N ATOM 129 CA GLU B 9 0.779 -6.808 -5.374 1.00 0.34 C ATOM 130 C GLU B 9 -0.669 -7.115 -5.028 1.00 0.31 C ATOM 131 O GLU B 9 -1.589 -6.757 -5.737 1.00 0.34 O ATOM 132 CB GLU B 9 1.466 -8.008 -6.030 1.00 0.40 C ATOM 133 CG GLU B 9 2.895 -7.626 -6.433 1.00 0.59 C ATOM 134 CD GLU B 9 3.065 -7.792 -7.945 1.00 1.24 C ATOM 135 OE1 GLU B 9 2.692 -8.838 -8.451 1.00 1.88 O ATOM 136 OE2 GLU B 9 3.564 -6.870 -8.570 1.00 1.73 O ATOM 0 H GLU B 9 2.260 -7.218 -3.893 1.00 0.38 H new ATOM 0 HA GLU B 9 0.799 -5.956 -6.053 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.485 -8.851 -5.339 1.00 0.40 H new ATOM 0 HB3 GLU B 9 0.903 -8.327 -6.907 1.00 0.40 H new ATOM 0 HG2 GLU B 9 3.101 -6.595 -6.145 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.613 -8.254 -5.905 1.00 0.59 H new ATOM 143 N ARG B 10 -0.870 -7.731 -3.896 1.00 0.31 N ATOM 144 CA ARG B 10 -2.247 -8.016 -3.437 1.00 0.38 C ATOM 145 C ARG B 10 -2.851 -6.720 -2.908 1.00 0.35 C ATOM 146 O ARG B 10 -4.049 -6.602 -2.750 1.00 0.40 O ATOM 147 CB ARG B 10 -2.098 -9.046 -2.315 1.00 0.46 C ATOM 148 CG ARG B 10 -2.691 -10.383 -2.757 1.00 0.73 C ATOM 149 CD ARG B 10 -2.072 -11.511 -1.928 1.00 0.67 C ATOM 150 NE ARG B 10 -3.117 -12.573 -1.880 1.00 1.55 N ATOM 151 CZ ARG B 10 -4.195 -12.418 -1.149 1.00 2.12 C ATOM 152 NH1 ARG B 10 -4.376 -11.328 -0.448 1.00 2.20 N ATOM 153 NH2 ARG B 10 -5.097 -13.361 -1.122 1.00 3.14 N ATOM 0 H ARG B 10 -0.131 -8.049 -3.269 1.00 0.31 H new ATOM 0 HA ARG B 10 -2.895 -8.395 -4.227 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -1.045 -9.171 -2.061 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -2.603 -8.693 -1.416 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -3.773 -10.374 -2.629 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -2.497 -10.547 -3.817 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -1.155 -11.880 -2.387 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -1.812 -11.168 -0.927 1.00 0.67 H new ATOM 0 HE ARG B 10 -2.993 -13.429 -2.421 1.00 1.55 H new ATOM 0 HH11 ARG B 10 -3.675 -10.588 -0.466 1.00 2.20 H new ATOM 0 HH12 ARG B 10 -5.218 -11.219 0.117 1.00 2.20 H new ATOM 0 HH21 ARG B 10 -4.961 -14.212 -1.667 1.00 3.14 H new ATOM 0 HH22 ARG B 10 -5.938 -13.247 -0.556 1.00 3.14 H new ATOM 167 N ARG B 11 -2.025 -5.733 -2.648 1.00 0.29 N ATOM 168 CA ARG B 11 -2.560 -4.446 -2.152 1.00 0.29 C ATOM 169 C ARG B 11 -2.840 -3.513 -3.322 1.00 0.24 C ATOM 170 O ARG B 11 -3.288 -2.405 -3.130 1.00 0.25 O ATOM 171 CB ARG B 11 -1.477 -3.847 -1.261 1.00 0.32 C ATOM 172 CG ARG B 11 -1.260 -4.718 -0.017 1.00 0.41 C ATOM 173 CD ARG B 11 -2.573 -4.867 0.762 1.00 0.55 C ATOM 174 NE ARG B 11 -2.671 -6.326 1.064 1.00 1.59 N ATOM 175 CZ ARG B 11 -3.504 -6.767 1.976 1.00 2.18 C ATOM 176 NH1 ARG B 11 -4.267 -5.939 2.642 1.00 1.76 N ATOM 177 NH2 ARG B 11 -3.572 -8.047 2.222 1.00 3.24 N ATOM 0 H ARG B 11 -1.012 -5.772 -2.760 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.493 -4.589 -1.606 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.545 -3.762 -1.819 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -1.762 -2.839 -0.961 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -0.890 -5.700 -0.312 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.499 -4.269 0.621 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -2.561 -4.273 1.676 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.424 -4.527 0.172 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.084 -6.987 0.555 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -4.218 -4.938 2.455 1.00 1.76 H new ATOM 0 HH12 ARG B 11 -4.911 -6.295 3.349 1.00 1.76 H new ATOM 0 HH21 ARG B 11 -2.979 -8.698 1.706 1.00 3.24 H new ATOM 0 HH22 ARG B 11 -4.218 -8.397 2.930 1.00 3.24 H new ATOM 191 N ALA B 12 -2.602 -3.945 -4.537 1.00 0.24 N ATOM 192 CA ALA B 12 -2.896 -3.048 -5.696 1.00 0.28 C ATOM 193 C ALA B 12 -4.347 -2.583 -5.582 1.00 0.31 C ATOM 194 O ALA B 12 -4.710 -1.514 -6.030 1.00 0.33 O ATOM 195 CB ALA B 12 -2.693 -3.910 -6.942 1.00 0.34 C ATOM 0 H ALA B 12 -2.224 -4.862 -4.773 1.00 0.24 H new ATOM 0 HA ALA B 12 -2.259 -2.164 -5.732 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -2.892 -3.314 -7.833 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.665 -4.272 -6.970 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -3.376 -4.759 -6.913 1.00 0.34 H new ATOM 201 N GLU B 13 -5.168 -3.375 -4.940 1.00 0.34 N ATOM 202 CA GLU B 13 -6.583 -2.978 -4.743 1.00 0.41 C ATOM 203 C GLU B 13 -6.637 -1.939 -3.627 1.00 0.38 C ATOM 204 O GLU B 13 -7.431 -1.022 -3.661 1.00 0.42 O ATOM 205 CB GLU B 13 -7.317 -4.257 -4.336 1.00 0.48 C ATOM 206 CG GLU B 13 -7.206 -5.293 -5.459 1.00 0.52 C ATOM 207 CD GLU B 13 -8.532 -5.370 -6.219 1.00 0.77 C ATOM 208 OE1 GLU B 13 -9.493 -5.857 -5.645 1.00 1.15 O ATOM 209 OE2 GLU B 13 -8.564 -4.941 -7.360 1.00 1.18 O ATOM 0 H GLU B 13 -4.913 -4.280 -4.545 1.00 0.34 H new ATOM 0 HA GLU B 13 -7.035 -2.542 -5.634 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -6.890 -4.656 -3.416 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -8.365 -4.038 -4.132 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -6.400 -5.021 -6.140 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.956 -6.269 -5.044 1.00 0.52 H new ATOM 216 N LYS B 14 -5.764 -2.053 -2.657 1.00 0.33 N ATOM 217 CA LYS B 14 -5.734 -1.044 -1.566 1.00 0.33 C ATOM 218 C LYS B 14 -4.996 0.183 -2.094 1.00 0.28 C ATOM 219 O LYS B 14 -5.324 1.314 -1.794 1.00 0.30 O ATOM 220 CB LYS B 14 -4.949 -1.707 -0.430 1.00 0.31 C ATOM 221 CG LYS B 14 -5.683 -2.963 0.043 1.00 0.38 C ATOM 222 CD LYS B 14 -6.905 -2.560 0.869 1.00 1.23 C ATOM 223 CE LYS B 14 -7.552 -3.811 1.470 1.00 1.37 C ATOM 224 NZ LYS B 14 -8.931 -3.389 1.843 1.00 1.83 N ATOM 0 H LYS B 14 -5.075 -2.801 -2.578 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.721 -0.733 -1.224 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -3.947 -1.967 -0.772 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -4.832 -1.009 0.399 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -5.992 -3.561 -0.814 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.015 -3.584 0.641 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -6.610 -1.873 1.663 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.623 -2.032 0.241 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -7.571 -4.630 0.751 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -6.998 -4.163 2.340 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -9.439 -4.194 2.263 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -8.882 -2.613 2.533 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -9.437 -3.065 0.994 1.00 1.83 H new ATOM 238 N GLN B 15 -4.009 -0.060 -2.907 1.00 0.25 N ATOM 239 CA GLN B 15 -3.218 1.032 -3.520 1.00 0.24 C ATOM 240 C GLN B 15 -4.062 1.739 -4.570 1.00 0.28 C ATOM 241 O GLN B 15 -4.177 2.941 -4.577 1.00 0.28 O ATOM 242 CB GLN B 15 -2.033 0.312 -4.174 1.00 0.24 C ATOM 243 CG GLN B 15 -0.759 0.603 -3.389 1.00 0.25 C ATOM 244 CD GLN B 15 0.215 -0.562 -3.560 1.00 0.30 C ATOM 245 OE1 GLN B 15 1.298 -0.396 -4.088 1.00 0.35 O ATOM 246 NE2 GLN B 15 -0.130 -1.745 -3.132 1.00 0.33 N ATOM 0 H GLN B 15 -3.712 -0.998 -3.177 1.00 0.25 H new ATOM 0 HA GLN B 15 -2.896 1.788 -2.804 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -2.218 -0.762 -4.201 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -1.919 0.642 -5.206 1.00 0.24 H new ATOM 0 HG2 GLN B 15 -0.303 1.528 -3.742 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -0.992 0.745 -2.334 1.00 0.25 H new ATOM 0 HE21 GLN B 15 -1.039 -1.882 -2.689 1.00 0.33 H new ATOM 0 HE22 GLN B 15 0.509 -2.533 -3.240 1.00 0.33 H new ATOM 255 N ALA B 16 -4.665 0.996 -5.450 1.00 0.35 N ATOM 256 CA ALA B 16 -5.515 1.635 -6.494 1.00 0.41 C ATOM 257 C ALA B 16 -6.726 2.288 -5.832 1.00 0.40 C ATOM 258 O ALA B 16 -7.255 3.268 -6.320 1.00 0.43 O ATOM 259 CB ALA B 16 -5.946 0.498 -7.422 1.00 0.48 C ATOM 0 H ALA B 16 -4.609 -0.021 -5.494 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.988 2.413 -7.045 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.576 0.896 -8.217 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -5.064 0.030 -7.859 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.506 -0.244 -6.853 1.00 0.48 H new ATOM 265 N GLN B 17 -7.152 1.775 -4.706 1.00 0.40 N ATOM 266 CA GLN B 17 -8.307 2.403 -4.007 1.00 0.42 C ATOM 267 C GLN B 17 -7.801 3.642 -3.292 1.00 0.37 C ATOM 268 O GLN B 17 -8.444 4.673 -3.258 1.00 0.40 O ATOM 269 CB GLN B 17 -8.795 1.361 -3.001 1.00 0.45 C ATOM 270 CG GLN B 17 -9.742 0.380 -3.693 1.00 0.53 C ATOM 271 CD GLN B 17 -10.030 -0.796 -2.758 1.00 0.66 C ATOM 272 OE1 GLN B 17 -9.834 -1.938 -3.120 1.00 1.06 O ATOM 273 NE2 GLN B 17 -10.493 -0.562 -1.561 1.00 1.33 N ATOM 0 H GLN B 17 -6.753 0.957 -4.246 1.00 0.40 H new ATOM 0 HA GLN B 17 -9.113 2.696 -4.680 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -7.946 0.824 -2.578 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -9.306 1.852 -2.173 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -10.672 0.882 -3.960 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -9.296 0.020 -4.620 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -10.658 0.397 -1.256 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -10.690 -1.338 -0.930 1.00 1.33 H new ATOM 282 N TRP B 18 -6.625 3.544 -2.748 1.00 0.32 N ATOM 283 CA TRP B 18 -6.020 4.706 -2.057 1.00 0.30 C ATOM 284 C TRP B 18 -5.541 5.705 -3.104 1.00 0.31 C ATOM 285 O TRP B 18 -5.791 6.891 -3.026 1.00 0.35 O ATOM 286 CB TRP B 18 -4.815 4.135 -1.313 1.00 0.25 C ATOM 287 CG TRP B 18 -4.031 5.266 -0.739 1.00 0.24 C ATOM 288 CD1 TRP B 18 -4.121 5.749 0.518 1.00 0.30 C ATOM 289 CD2 TRP B 18 -3.045 6.071 -1.411 1.00 0.24 C ATOM 290 NE1 TRP B 18 -3.242 6.814 0.644 1.00 0.31 N ATOM 291 CE2 TRP B 18 -2.552 7.040 -0.521 1.00 0.29 C ATOM 292 CE3 TRP B 18 -2.537 6.038 -2.701 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -1.579 7.954 -0.911 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -1.568 6.942 -3.102 1.00 0.36 C ATOM 295 CH2 TRP B 18 -1.085 7.899 -2.216 1.00 0.38 C ATOM 0 H TRP B 18 -6.053 2.700 -2.753 1.00 0.32 H new ATOM 0 HA TRP B 18 -6.717 5.211 -1.389 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -5.143 3.462 -0.521 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -4.194 3.550 -1.991 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -4.769 5.370 1.295 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -3.123 7.361 1.496 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -2.901 5.300 -3.400 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 -1.211 8.694 -0.216 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -1.184 6.904 -4.111 1.00 0.36 H new ATOM 0 HH2 TRP B 18 -0.328 8.599 -2.537 1.00 0.38 H new ATOM 306 N LYS B 19 -4.848 5.208 -4.085 1.00 0.30 N ATOM 307 CA LYS B 19 -4.322 6.082 -5.165 1.00 0.37 C ATOM 308 C LYS B 19 -5.491 6.763 -5.842 1.00 0.46 C ATOM 309 O LYS B 19 -5.414 7.903 -6.255 1.00 0.70 O ATOM 310 CB LYS B 19 -3.607 5.146 -6.144 1.00 0.40 C ATOM 311 CG LYS B 19 -2.255 4.708 -5.574 1.00 0.49 C ATOM 312 CD LYS B 19 -1.477 3.933 -6.641 1.00 0.96 C ATOM 313 CE LYS B 19 0.019 4.231 -6.504 1.00 1.30 C ATOM 314 NZ LYS B 19 0.663 2.900 -6.332 1.00 1.92 N ATOM 0 H LYS B 19 -4.620 4.219 -4.186 1.00 0.30 H new ATOM 0 HA LYS B 19 -3.644 6.852 -4.796 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -4.227 4.271 -6.339 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -3.460 5.651 -7.098 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -1.684 5.579 -5.254 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -2.405 4.084 -4.693 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -1.657 2.863 -6.531 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -1.825 4.214 -7.635 1.00 0.96 H new ATOM 0 HE2 LYS B 19 0.402 4.743 -7.387 1.00 1.30 H new ATOM 0 HE3 LYS B 19 0.216 4.878 -5.649 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 1.662 2.958 -6.616 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 0.603 2.612 -5.335 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 0.175 2.199 -6.925 1.00 1.92 H new ATOM 328 N ALA B 20 -6.589 6.068 -5.943 1.00 0.44 N ATOM 329 CA ALA B 20 -7.777 6.676 -6.579 1.00 0.52 C ATOM 330 C ALA B 20 -8.189 7.923 -5.799 1.00 0.56 C ATOM 331 O ALA B 20 -8.739 8.859 -6.344 1.00 0.74 O ATOM 332 CB ALA B 20 -8.867 5.617 -6.500 1.00 0.55 C ATOM 0 H ALA B 20 -6.710 5.110 -5.613 1.00 0.44 H new ATOM 0 HA ALA B 20 -7.588 6.978 -7.609 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -9.780 6.000 -6.955 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -8.544 4.722 -7.033 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -9.058 5.369 -5.456 1.00 0.55 H new ATOM 338 N ALA B 21 -7.923 7.937 -4.518 1.00 0.54 N ATOM 339 CA ALA B 21 -8.292 9.120 -3.692 1.00 0.66 C ATOM 340 C ALA B 21 -7.054 9.715 -3.032 1.00 0.73 C ATOM 341 O ALA B 21 -7.128 10.364 -2.007 1.00 0.99 O ATOM 342 CB ALA B 21 -9.267 8.589 -2.644 1.00 0.71 C ATOM 0 H ALA B 21 -7.466 7.179 -4.011 1.00 0.54 H new ATOM 0 HA ALA B 21 -8.738 9.915 -4.290 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -9.585 9.406 -1.996 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -10.137 8.161 -3.141 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -8.776 7.821 -2.046 1.00 0.71 H new ATOM 348 N ASN B 22 -5.924 9.515 -3.637 1.00 0.73 N ATOM 349 CA ASN B 22 -4.657 10.082 -3.084 1.00 0.88 C ATOM 350 C ASN B 22 -3.611 10.266 -4.192 1.00 1.08 C ATOM 351 O ASN B 22 -2.476 9.861 -4.043 1.00 0.00 O ATOM 352 CB ASN B 22 -4.151 9.079 -2.053 1.00 0.93 C ATOM 353 CG ASN B 22 -5.137 8.981 -0.895 1.00 0.94 C ATOM 354 OD1 ASN B 22 -5.421 9.958 -0.232 1.00 1.13 O ATOM 355 ND2 ASN B 22 -5.673 7.830 -0.624 1.00 0.94 N ATOM 0 H ASN B 22 -5.816 8.980 -4.498 1.00 0.73 H new ATOM 0 HA ASN B 22 -4.834 11.062 -2.640 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -4.024 8.101 -2.517 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -3.173 9.387 -1.684 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -6.335 7.745 0.148 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -5.432 7.011 -1.183 1.00 0.94 H new ATOM 362 N PRO B 23 -4.020 10.906 -5.253 1.00 0.00 N ATOM 363 CA PRO B 23 -3.097 11.182 -6.368 1.00 0.00 C ATOM 364 C PRO B 23 -2.136 12.269 -5.903 1.00 0.00 C ATOM 365 O PRO B 23 -1.002 12.347 -6.326 1.00 0.00 O ATOM 366 CB PRO B 23 -4.008 11.673 -7.489 1.00 0.00 C ATOM 367 CG PRO B 23 -5.218 12.203 -6.792 1.00 0.00 C ATOM 368 CD PRO B 23 -5.352 11.435 -5.502 1.00 0.00 C ATOM 0 HA PRO B 23 -2.502 10.330 -6.697 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -3.522 12.447 -8.083 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -4.267 10.864 -8.171 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -5.115 13.270 -6.597 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -6.106 12.077 -7.411 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -5.681 12.081 -4.688 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -6.087 10.635 -5.591 1.00 0.00 H new ATOM 376 N LEU B 24 -2.590 13.090 -4.990 1.00 0.00 N ATOM 377 CA LEU B 24 -1.714 14.161 -4.438 1.00 0.00 C ATOM 378 C LEU B 24 -0.446 13.514 -3.884 1.00 0.00 C ATOM 379 O LEU B 24 0.644 14.041 -3.991 1.00 0.00 O ATOM 380 CB LEU B 24 -2.555 14.826 -3.326 1.00 0.00 C ATOM 381 CG LEU B 24 -2.342 14.134 -1.961 1.00 0.00 C ATOM 382 CD1 LEU B 24 -2.867 15.047 -0.852 1.00 0.00 C ATOM 383 CD2 LEU B 24 -3.100 12.795 -1.908 1.00 0.00 C ATOM 0 H LEU B 24 -3.534 13.062 -4.603 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.400 14.899 -5.176 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -2.286 15.879 -3.246 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -3.611 14.786 -3.594 1.00 0.00 H new ATOM 0 HG LEU B 24 -1.278 13.943 -1.826 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -2.721 14.566 0.115 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.326 15.993 -0.873 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.930 15.234 -1.007 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -2.938 12.323 -0.939 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.166 12.974 -2.050 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -2.734 12.138 -2.697 1.00 0.00 H new ATOM 395 N LEU B 25 -0.597 12.344 -3.335 1.00 0.00 N ATOM 396 CA LEU B 25 0.569 11.592 -2.809 1.00 0.00 C ATOM 397 C LEU B 25 0.941 10.565 -3.862 1.00 0.00 C ATOM 398 O LEU B 25 1.354 9.459 -3.578 1.00 0.00 O ATOM 399 CB LEU B 25 0.056 10.912 -1.539 1.00 0.00 C ATOM 400 CG LEU B 25 0.365 11.790 -0.325 1.00 0.00 C ATOM 401 CD1 LEU B 25 -0.660 11.517 0.776 1.00 0.00 C ATOM 402 CD2 LEU B 25 1.768 11.463 0.194 1.00 0.00 C ATOM 0 H LEU B 25 -1.494 11.871 -3.228 1.00 0.00 H new ATOM 0 HA LEU B 25 1.443 12.206 -2.591 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -1.018 10.743 -1.614 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.525 9.935 -1.423 1.00 0.00 H new ATOM 0 HG LEU B 25 0.317 12.840 -0.614 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -0.440 12.142 1.641 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -1.660 11.746 0.407 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -0.612 10.467 1.066 1.00 0.00 H new ATOM 0 HD21 LEU B 25 1.991 12.087 1.059 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.813 10.413 0.483 1.00 0.00 H new ATOM 0 HD23 LEU B 25 2.500 11.655 -0.590 1.00 0.00 H new ATOM 414 N VAL B 26 0.751 10.942 -5.088 1.00 0.00 N ATOM 415 CA VAL B 26 1.027 10.036 -6.220 1.00 0.00 C ATOM 416 C VAL B 26 1.350 10.870 -7.461 1.00 0.00 C ATOM 417 O VAL B 26 0.507 11.561 -7.994 1.00 0.00 O ATOM 418 CB VAL B 26 -0.285 9.246 -6.368 1.00 0.00 C ATOM 419 CG1 VAL B 26 -0.751 9.220 -7.826 1.00 0.00 C ATOM 420 CG2 VAL B 26 -0.039 7.820 -5.884 1.00 0.00 C ATOM 0 H VAL B 26 0.407 11.864 -5.357 1.00 0.00 H new ATOM 0 HA VAL B 26 1.879 9.372 -6.075 1.00 0.00 H new ATOM 0 HB VAL B 26 -1.064 9.727 -5.776 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -1.680 8.655 -7.901 1.00 0.00 H new ATOM 0 HG12 VAL B 26 -0.917 10.240 -8.173 1.00 0.00 H new ATOM 0 HG13 VAL B 26 0.012 8.747 -8.444 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -0.957 7.240 -5.980 1.00 0.00 H new ATOM 0 HG22 VAL B 26 0.745 7.361 -6.487 1.00 0.00 H new ATOM 0 HG23 VAL B 26 0.271 7.839 -4.839 1.00 0.00 H new ATOM 430 N GLY B 27 2.569 10.821 -7.912 1.00 0.00 N ATOM 431 CA GLY B 27 2.954 11.628 -9.106 1.00 0.00 C ATOM 432 C GLY B 27 2.852 13.117 -8.753 1.00 0.00 C ATOM 433 O GLY B 27 3.845 13.812 -8.661 1.00 0.00 O ATOM 0 H GLY B 27 3.318 10.258 -7.508 1.00 0.00 H new ATOM 0 HA2 GLY B 27 3.970 11.383 -9.415 1.00 0.00 H new ATOM 0 HA3 GLY B 27 2.300 11.394 -9.946 1.00 0.00 H new ATOM 437 N VAL B 28 1.657 13.604 -8.545 1.00 0.00 N ATOM 438 CA VAL B 28 1.478 15.042 -8.186 1.00 0.00 C ATOM 439 C VAL B 28 2.176 15.340 -6.857 1.00 0.00 C ATOM 440 O VAL B 28 2.288 14.488 -5.999 1.00 0.00 O ATOM 441 CB VAL B 28 -0.035 15.238 -8.051 1.00 0.00 C ATOM 442 CG1 VAL B 28 -0.336 16.695 -7.686 1.00 0.00 C ATOM 443 CG2 VAL B 28 -0.716 14.897 -9.379 1.00 0.00 C ATOM 0 H VAL B 28 0.793 13.065 -8.609 1.00 0.00 H new ATOM 0 HA VAL B 28 1.907 15.710 -8.933 1.00 0.00 H new ATOM 0 HB VAL B 28 -0.414 14.582 -7.267 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -1.413 16.831 -7.591 1.00 0.00 H new ATOM 0 HG12 VAL B 28 0.146 16.940 -6.739 1.00 0.00 H new ATOM 0 HG13 VAL B 28 0.045 17.352 -8.468 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -1.793 15.037 -9.282 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -0.334 15.552 -10.162 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -0.507 13.859 -9.639 1.00 0.00 H new ATOM 453 N SER B 29 2.642 16.549 -6.682 1.00 0.00 N ATOM 454 CA SER B 29 3.331 16.918 -5.410 1.00 0.00 C ATOM 455 C SER B 29 4.444 15.914 -5.091 1.00 0.00 C ATOM 456 O SER B 29 4.764 15.053 -5.888 1.00 0.00 O ATOM 457 CB SER B 29 2.243 16.870 -4.338 1.00 0.00 C ATOM 458 OG SER B 29 1.409 18.014 -4.462 1.00 0.00 O ATOM 0 H SER B 29 2.575 17.300 -7.369 1.00 0.00 H new ATOM 0 HA SER B 29 3.801 17.900 -5.471 1.00 0.00 H new ATOM 0 HB2 SER B 29 1.651 15.961 -4.445 1.00 0.00 H new ATOM 0 HB3 SER B 29 2.695 16.841 -3.346 1.00 0.00 H new ATOM 0 HG SER B 29 0.709 17.985 -3.776 1.00 0.00 H new ATOM 464 N ALA B 30 5.034 16.018 -3.929 1.00 0.00 N ATOM 465 CA ALA B 30 6.127 15.073 -3.543 1.00 0.00 C ATOM 466 C ALA B 30 7.200 15.012 -4.636 1.00 0.00 C ATOM 467 O ALA B 30 7.537 13.953 -5.130 1.00 0.00 O ATOM 468 CB ALA B 30 5.444 13.712 -3.387 1.00 0.00 C ATOM 0 H ALA B 30 4.805 16.721 -3.226 1.00 0.00 H new ATOM 0 HA ALA B 30 6.629 15.386 -2.628 1.00 0.00 H new ATOM 0 HB1 ALA B 30 6.184 12.964 -3.104 1.00 0.00 H new ATOM 0 HB2 ALA B 30 4.678 13.776 -2.614 1.00 0.00 H new ATOM 0 HB3 ALA B 30 4.983 13.426 -4.332 1.00 0.00 H new ATOM 474 N LYS B 31 7.742 16.139 -5.011 1.00 0.00 N ATOM 475 CA LYS B 31 8.796 16.146 -6.067 1.00 0.00 C ATOM 476 C LYS B 31 9.987 16.998 -5.613 1.00 0.00 C ATOM 477 O LYS B 31 10.189 18.092 -6.102 1.00 0.00 O ATOM 478 CB LYS B 31 8.127 16.763 -7.296 1.00 0.00 C ATOM 479 CG LYS B 31 7.123 15.770 -7.885 1.00 0.00 C ATOM 480 CD LYS B 31 7.790 14.974 -9.009 1.00 0.00 C ATOM 481 CE LYS B 31 7.210 13.558 -9.045 1.00 0.00 C ATOM 482 NZ LYS B 31 7.840 12.916 -10.233 1.00 0.00 N ATOM 0 H LYS B 31 7.501 17.055 -4.632 1.00 0.00 H new ATOM 0 HA LYS B 31 9.180 15.148 -6.276 1.00 0.00 H new ATOM 0 HB2 LYS B 31 7.621 17.688 -7.021 1.00 0.00 H new ATOM 0 HB3 LYS B 31 8.879 17.021 -8.041 1.00 0.00 H new ATOM 0 HG2 LYS B 31 6.766 15.093 -7.108 1.00 0.00 H new ATOM 0 HG3 LYS B 31 6.252 16.302 -8.269 1.00 0.00 H new ATOM 0 HD2 LYS B 31 7.627 15.470 -9.966 1.00 0.00 H new ATOM 0 HD3 LYS B 31 8.868 14.933 -8.850 1.00 0.00 H new ATOM 0 HE2 LYS B 31 7.443 13.012 -8.131 1.00 0.00 H new ATOM 0 HE3 LYS B 31 6.124 13.578 -9.136 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 7.492 11.940 -10.326 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 7.595 13.454 -11.089 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 8.873 12.905 -10.115 1.00 0.00 H new ATOM 496 N PRO B 32 10.738 16.463 -4.685 1.00 0.00 N ATOM 497 CA PRO B 32 11.918 17.183 -4.155 1.00 0.00 C ATOM 498 C PRO B 32 13.105 17.048 -5.112 1.00 0.00 C ATOM 499 O PRO B 32 14.052 16.333 -4.842 1.00 0.00 O ATOM 500 CB PRO B 32 12.204 16.475 -2.835 1.00 0.00 C ATOM 501 CG PRO B 32 11.635 15.097 -2.988 1.00 0.00 C ATOM 502 CD PRO B 32 10.559 15.154 -4.047 1.00 0.00 C ATOM 0 HA PRO B 32 11.747 18.253 -4.034 1.00 0.00 H new ATOM 0 HB2 PRO B 32 13.275 16.437 -2.634 1.00 0.00 H new ATOM 0 HB3 PRO B 32 11.741 17.000 -2.000 1.00 0.00 H new ATOM 0 HG2 PRO B 32 12.415 14.392 -3.274 1.00 0.00 H new ATOM 0 HG3 PRO B 32 11.221 14.748 -2.042 1.00 0.00 H new ATOM 0 HD2 PRO B 32 10.668 14.343 -4.767 1.00 0.00 H new ATOM 0 HD3 PRO B 32 9.566 15.059 -3.609 1.00 0.00 H new ATOM 510 N VAL B 33 13.064 17.727 -6.226 1.00 0.00 N ATOM 511 CA VAL B 33 14.193 17.637 -7.198 1.00 0.00 C ATOM 512 C VAL B 33 14.461 19.008 -7.826 1.00 0.00 C ATOM 513 O VAL B 33 13.548 19.754 -8.119 1.00 0.00 O ATOM 514 CB VAL B 33 13.728 16.642 -8.265 1.00 0.00 C ATOM 515 CG1 VAL B 33 13.461 15.283 -7.616 1.00 0.00 C ATOM 516 CG2 VAL B 33 12.441 17.154 -8.919 1.00 0.00 C ATOM 0 H VAL B 33 12.298 18.340 -6.506 1.00 0.00 H new ATOM 0 HA VAL B 33 15.119 17.317 -6.721 1.00 0.00 H new ATOM 0 HB VAL B 33 14.504 16.538 -9.023 1.00 0.00 H new ATOM 0 HG11 VAL B 33 13.130 14.575 -8.376 1.00 0.00 H new ATOM 0 HG12 VAL B 33 14.376 14.915 -7.152 1.00 0.00 H new ATOM 0 HG13 VAL B 33 12.686 15.388 -6.857 1.00 0.00 H new ATOM 0 HG21 VAL B 33 12.112 16.445 -9.678 1.00 0.00 H new ATOM 0 HG22 VAL B 33 11.665 17.261 -8.161 1.00 0.00 H new ATOM 0 HG23 VAL B 33 12.629 18.122 -9.384 1.00 0.00 H new ATOM 526 N ASN B 34 15.707 19.340 -8.037 1.00 0.00 N ATOM 527 CA ASN B 34 16.031 20.662 -8.650 1.00 0.00 C ATOM 528 C ASN B 34 15.417 20.754 -10.050 1.00 0.00 C ATOM 529 O ASN B 34 15.492 19.827 -10.831 1.00 0.00 O ATOM 530 CB ASN B 34 17.560 20.707 -8.729 1.00 0.00 C ATOM 531 CG ASN B 34 18.075 19.494 -9.507 1.00 0.00 C ATOM 532 OD1 ASN B 34 18.319 18.450 -8.935 1.00 0.00 O ATOM 533 ND2 ASN B 34 18.252 19.588 -10.797 1.00 0.00 N ATOM 0 H ASN B 34 16.512 18.755 -7.812 1.00 0.00 H new ATOM 0 HA ASN B 34 15.633 21.495 -8.070 1.00 0.00 H new ATOM 0 HB2 ASN B 34 17.881 21.627 -9.218 1.00 0.00 H new ATOM 0 HB3 ASN B 34 17.985 20.714 -7.725 1.00 0.00 H new ATOM 0 HD21 ASN B 34 18.595 18.785 -11.325 1.00 0.00 H new ATOM 0 HD22 ASN B 34 18.047 20.464 -11.277 1.00 0.00 H new ATOM 540 N ARG B 35 14.807 21.864 -10.370 1.00 0.00 N ATOM 541 CA ARG B 35 14.185 22.014 -11.717 1.00 0.00 C ATOM 542 C ARG B 35 15.073 22.884 -12.616 1.00 0.00 C ATOM 543 O ARG B 35 15.042 24.095 -12.525 1.00 0.00 O ATOM 544 CB ARG B 35 12.845 22.702 -11.461 1.00 0.00 C ATOM 545 CG ARG B 35 11.941 21.779 -10.637 1.00 0.00 C ATOM 546 CD ARG B 35 11.589 20.532 -11.455 1.00 0.00 C ATOM 547 NE ARG B 35 10.980 21.051 -12.716 1.00 0.00 N ATOM 548 CZ ARG B 35 9.756 21.523 -12.726 1.00 0.00 C ATOM 549 NH1 ARG B 35 9.039 21.550 -11.630 1.00 0.00 N ATOM 550 NH2 ARG B 35 9.247 21.971 -13.840 1.00 0.00 N ATOM 0 H ARG B 35 14.713 22.673 -9.756 1.00 0.00 H new ATOM 0 HA ARG B 35 14.061 21.057 -12.223 1.00 0.00 H new ATOM 0 HB2 ARG B 35 13.003 23.641 -10.931 1.00 0.00 H new ATOM 0 HB3 ARG B 35 12.364 22.948 -12.408 1.00 0.00 H new ATOM 0 HG2 ARG B 35 12.445 21.490 -9.715 1.00 0.00 H new ATOM 0 HG3 ARG B 35 11.031 22.307 -10.351 1.00 0.00 H new ATOM 0 HD2 ARG B 35 12.476 19.934 -11.663 1.00 0.00 H new ATOM 0 HD3 ARG B 35 10.892 19.891 -10.916 1.00 0.00 H new ATOM 0 HE ARG B 35 11.522 21.038 -13.580 1.00 0.00 H new ATOM 0 HH11 ARG B 35 9.431 21.201 -10.755 1.00 0.00 H new ATOM 0 HH12 ARG B 35 8.089 21.920 -11.651 1.00 0.00 H new ATOM 0 HH21 ARG B 35 9.800 21.953 -14.697 1.00 0.00 H new ATOM 0 HH22 ARG B 35 8.296 22.339 -13.854 1.00 0.00 H new ATOM 564 N PRO B 36 15.838 22.237 -13.461 1.00 0.00 N ATOM 565 CA PRO B 36 16.739 22.974 -14.383 1.00 0.00 C ATOM 566 C PRO B 36 15.929 23.664 -15.483 1.00 0.00 C ATOM 567 O PRO B 36 15.587 22.998 -16.446 1.00 0.00 O ATOM 568 CB PRO B 36 17.628 21.880 -14.967 1.00 0.00 C ATOM 569 CG PRO B 36 16.826 20.625 -14.848 1.00 0.00 C ATOM 570 CD PRO B 36 15.939 20.782 -13.641 1.00 0.00 C ATOM 571 OXT PRO B 36 15.665 24.848 -15.344 1.00 0.00 O ATOM 0 HA PRO B 36 17.309 23.760 -13.888 1.00 0.00 H new ATOM 0 HB2 PRO B 36 17.881 22.090 -16.006 1.00 0.00 H new ATOM 0 HB3 PRO B 36 18.568 21.801 -14.420 1.00 0.00 H new ATOM 0 HG2 PRO B 36 16.230 20.462 -15.746 1.00 0.00 H new ATOM 0 HG3 PRO B 36 17.479 19.759 -14.737 1.00 0.00 H new ATOM 0 HD2 PRO B 36 14.960 20.331 -13.804 1.00 0.00 H new ATOM 0 HD3 PRO B 36 16.370 20.300 -12.763 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 13.627 -18.673 1.143 1.00 1.31 P ATOM 581 OP1 G A 1 14.466 -19.287 2.205 1.00 1.51 O ATOM 582 OP2 G A 1 14.050 -18.773 -0.276 1.00 1.52 O ATOM 583 O5' G A 1 13.427 -17.133 1.499 1.00 1.09 O ATOM 584 C5' G A 1 12.139 -16.504 1.365 1.00 1.03 C ATOM 585 C4' G A 1 11.103 -17.264 2.155 1.00 0.94 C ATOM 586 O4' G A 1 11.480 -17.239 3.552 1.00 1.02 O ATOM 587 C3' G A 1 9.720 -16.641 2.156 1.00 0.80 C ATOM 588 O3' G A 1 8.998 -16.991 0.968 1.00 0.75 O ATOM 589 C2' G A 1 9.101 -17.221 3.426 1.00 0.78 C ATOM 590 O2' G A 1 8.555 -18.515 3.270 1.00 0.77 O ATOM 591 C1' G A 1 10.314 -17.295 4.352 1.00 0.90 C ATOM 592 N9 G A 1 10.331 -16.173 5.280 1.00 0.90 N ATOM 593 C8 G A 1 11.103 -15.039 5.211 1.00 0.97 C ATOM 594 N7 G A 1 10.862 -14.199 6.180 1.00 0.99 N ATOM 595 C5 G A 1 9.874 -14.819 6.932 1.00 0.90 C ATOM 596 C6 G A 1 9.208 -14.390 8.104 1.00 0.88 C ATOM 597 O6 G A 1 9.365 -13.342 8.734 1.00 0.94 O ATOM 598 N1 G A 1 8.272 -15.327 8.539 1.00 0.82 N ATOM 599 C2 G A 1 8.016 -16.525 7.916 1.00 0.81 C ATOM 600 N2 G A 1 7.079 -17.301 8.480 1.00 0.83 N ATOM 601 N3 G A 1 8.631 -16.934 6.822 1.00 0.83 N ATOM 602 C4 G A 1 9.540 -16.038 6.389 1.00 0.86 C ATOM 0 H5' G A 1 11.851 -16.468 0.314 1.00 1.03 H new ATOM 0 H5'' G A 1 12.191 -15.474 1.717 1.00 1.03 H new ATOM 0 H4' G A 1 11.065 -18.248 1.688 1.00 0.94 H new ATOM 0 H3' G A 1 9.717 -15.551 2.154 1.00 0.80 H new ATOM 0 H2' G A 1 8.262 -16.618 3.773 1.00 0.78 H new ATOM 0 HO2' G A 1 9.213 -19.098 2.837 1.00 0.77 H new ATOM 0 H1' G A 1 10.269 -18.220 4.927 1.00 0.90 H new ATOM 0 H8 G A 1 11.833 -14.861 4.436 1.00 0.97 H new ATOM 0 H1 G A 1 7.739 -15.108 9.380 1.00 0.82 H new ATOM 0 H21 G A 1 6.845 -18.202 8.064 1.00 0.83 H new ATOM 0 H22 G A 1 6.601 -16.990 9.325 1.00 0.83 H new ATOM 614 P C A 2 8.369 -18.463 0.802 1.00 0.69 P ATOM 615 OP1 C A 2 9.269 -19.445 1.459 1.00 0.84 O ATOM 616 OP2 C A 2 8.028 -18.633 -0.634 1.00 0.82 O ATOM 617 O5' C A 2 7.003 -18.382 1.618 1.00 0.58 O ATOM 618 C5' C A 2 6.354 -17.114 1.832 1.00 0.57 C ATOM 619 C4' C A 2 5.252 -17.252 2.857 1.00 0.55 C ATOM 620 O4' C A 2 5.811 -17.027 4.175 1.00 0.54 O ATOM 621 C3' C A 2 4.154 -16.210 2.725 1.00 0.51 C ATOM 622 O3' C A 2 3.146 -16.670 1.827 1.00 0.59 O ATOM 623 C2' C A 2 3.617 -16.091 4.146 1.00 0.53 C ATOM 624 O2' C A 2 2.615 -17.046 4.436 1.00 0.67 O ATOM 625 C1' C A 2 4.862 -16.366 4.993 1.00 0.51 C ATOM 626 N1 C A 2 5.490 -15.146 5.519 1.00 0.45 N ATOM 627 C2 C A 2 5.006 -14.611 6.712 1.00 0.44 C ATOM 628 O2 C A 2 4.058 -15.176 7.277 1.00 0.49 O ATOM 629 N3 C A 2 5.579 -13.496 7.218 1.00 0.43 N ATOM 630 C4 C A 2 6.597 -12.922 6.576 1.00 0.45 C ATOM 631 N4 C A 2 7.134 -11.825 7.113 1.00 0.49 N ATOM 632 C5 C A 2 7.111 -13.446 5.354 1.00 0.47 C ATOM 633 C6 C A 2 6.532 -14.550 4.866 1.00 0.46 C ATOM 0 H5' C A 2 5.941 -16.746 0.892 1.00 0.57 H new ATOM 0 H5'' C A 2 7.083 -16.378 2.170 1.00 0.57 H new ATOM 0 H4' C A 2 4.834 -18.247 2.703 1.00 0.55 H new ATOM 0 H3' C A 2 4.499 -15.256 2.325 1.00 0.51 H new ATOM 0 H2' C A 2 3.144 -15.126 4.326 1.00 0.53 H new ATOM 0 HO2' C A 2 1.740 -16.694 4.169 1.00 0.67 H new ATOM 0 H1' C A 2 4.548 -16.966 5.847 1.00 0.51 H new ATOM 0 H41 C A 2 7.914 -11.360 6.649 1.00 0.49 H new ATOM 0 H42 C A 2 6.764 -11.452 7.987 1.00 0.49 H new ATOM 0 H5 C A 2 7.935 -12.971 4.842 1.00 0.47 H new ATOM 0 H6 C A 2 6.894 -14.976 3.942 1.00 0.46 H new ATOM 645 P C A 3 1.740 -15.894 1.736 1.00 0.67 P ATOM 646 OP1 C A 3 0.910 -16.338 2.885 1.00 1.00 O ATOM 647 OP2 C A 3 1.218 -16.039 0.353 1.00 1.20 O ATOM 648 O5' C A 3 2.126 -14.366 1.966 1.00 0.89 O ATOM 649 C5' C A 3 1.106 -13.356 2.079 1.00 0.68 C ATOM 650 C4' C A 3 0.492 -13.389 3.455 1.00 0.61 C ATOM 651 O4' C A 3 1.563 -13.549 4.417 1.00 0.67 O ATOM 652 C3' C A 3 -0.191 -12.095 3.852 1.00 0.56 C ATOM 653 O3' C A 3 -1.553 -12.083 3.402 1.00 0.57 O ATOM 654 C2' C A 3 -0.048 -12.072 5.373 1.00 0.57 C ATOM 655 O2' C A 3 -1.065 -12.767 6.065 1.00 0.64 O ATOM 656 C1' C A 3 1.283 -12.797 5.583 1.00 0.62 C ATOM 657 N1 C A 3 2.398 -11.861 5.783 1.00 0.61 N ATOM 658 C2 C A 3 2.410 -11.058 6.923 1.00 0.56 C ATOM 659 O2 C A 3 1.482 -11.163 7.739 1.00 0.55 O ATOM 660 N3 C A 3 3.429 -10.189 7.110 1.00 0.58 N ATOM 661 C4 C A 3 4.409 -10.107 6.207 1.00 0.65 C ATOM 662 N4 C A 3 5.394 -9.234 6.430 1.00 0.71 N ATOM 663 C5 C A 3 4.420 -10.915 5.034 1.00 0.71 C ATOM 664 C6 C A 3 3.404 -11.772 4.861 1.00 0.68 C ATOM 0 H5' C A 3 0.336 -13.520 1.325 1.00 0.68 H new ATOM 0 H5'' C A 3 1.535 -12.372 1.888 1.00 0.68 H new ATOM 0 H4' C A 3 -0.242 -14.195 3.441 1.00 0.61 H new ATOM 0 H3' C A 3 0.244 -11.203 3.401 1.00 0.56 H new ATOM 0 H2' C A 3 -0.107 -11.053 5.756 1.00 0.57 H new ATOM 0 HO2' C A 3 -1.176 -13.659 5.674 1.00 0.64 H new ATOM 0 H1' C A 3 1.190 -13.421 6.472 1.00 0.62 H new ATOM 0 H41 C A 3 6.158 -9.146 5.761 1.00 0.71 H new ATOM 0 H42 C A 3 5.382 -8.655 7.270 1.00 0.71 H new ATOM 0 H5 C A 3 5.218 -10.840 4.310 1.00 0.71 H new ATOM 0 H6 C A 3 3.380 -12.400 3.983 1.00 0.68 H new ATOM 676 P C A 4 -2.711 -12.775 4.278 1.00 0.57 P ATOM 677 OP1 C A 4 -2.140 -13.996 4.903 1.00 0.60 O ATOM 678 OP2 C A 4 -3.922 -12.891 3.425 1.00 0.73 O ATOM 679 O5' C A 4 -3.019 -11.697 5.411 1.00 0.61 O ATOM 680 C5' C A 4 -3.219 -10.311 5.068 1.00 0.51 C ATOM 681 C4' C A 4 -3.210 -9.454 6.309 1.00 0.47 C ATOM 682 O4' C A 4 -1.962 -9.672 7.011 1.00 0.55 O ATOM 683 C3' C A 4 -3.231 -7.960 6.034 1.00 0.45 C ATOM 684 O3' C A 4 -4.575 -7.499 5.849 1.00 0.51 O ATOM 685 C2' C A 4 -2.553 -7.376 7.270 1.00 0.47 C ATOM 686 O2' C A 4 -3.421 -7.151 8.362 1.00 0.57 O ATOM 687 C1' C A 4 -1.550 -8.470 7.635 1.00 0.48 C ATOM 688 N1 C A 4 -0.194 -8.153 7.165 1.00 0.43 N ATOM 689 C2 C A 4 0.538 -7.162 7.824 1.00 0.39 C ATOM 690 O2 C A 4 0.029 -6.583 8.796 1.00 0.43 O ATOM 691 N3 C A 4 1.779 -6.860 7.384 1.00 0.38 N ATOM 692 C4 C A 4 2.287 -7.507 6.335 1.00 0.45 C ATOM 693 N4 C A 4 3.509 -7.179 5.930 1.00 0.51 N ATOM 694 C5 C A 4 1.563 -8.519 5.652 1.00 0.51 C ATOM 695 C6 C A 4 0.338 -8.809 6.092 1.00 0.48 C ATOM 0 H5' C A 4 -4.168 -10.193 4.544 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.435 -9.982 4.386 1.00 0.51 H new ATOM 0 H4' C A 4 -4.106 -9.736 6.862 1.00 0.47 H new ATOM 0 H3' C A 4 -2.721 -7.663 5.118 1.00 0.45 H new ATOM 0 H2' C A 4 -2.132 -6.393 7.059 1.00 0.47 H new ATOM 0 HO2' C A 4 -3.904 -7.978 8.572 1.00 0.57 H new ATOM 0 H1' C A 4 -1.523 -8.559 8.721 1.00 0.48 H new ATOM 0 H41 C A 4 3.926 -7.655 5.130 1.00 0.51 H new ATOM 0 H42 C A 4 4.030 -6.451 6.419 1.00 0.51 H new ATOM 0 H5 C A 4 1.989 -9.036 4.805 1.00 0.51 H new ATOM 0 H6 C A 4 -0.241 -9.572 5.593 1.00 0.48 H new ATOM 707 P U A 5 -5.554 -7.307 7.111 1.00 0.57 P ATOM 708 OP1 U A 5 -5.178 -8.315 8.135 1.00 0.62 O ATOM 709 OP2 U A 5 -6.950 -7.265 6.607 1.00 0.77 O ATOM 710 O5' U A 5 -5.184 -5.855 7.651 1.00 0.49 O ATOM 711 C5' U A 5 -4.322 -4.983 6.890 1.00 0.45 C ATOM 712 C4' U A 5 -3.552 -4.072 7.816 1.00 0.41 C ATOM 713 O4' U A 5 -2.239 -4.644 8.020 1.00 0.47 O ATOM 714 C3' U A 5 -3.243 -2.690 7.264 1.00 0.35 C ATOM 715 O3' U A 5 -4.324 -1.788 7.493 1.00 0.36 O ATOM 716 C2' U A 5 -2.025 -2.274 8.078 1.00 0.41 C ATOM 717 O2' U A 5 -2.368 -1.658 9.305 1.00 0.50 O ATOM 718 C1' U A 5 -1.331 -3.612 8.338 1.00 0.43 C ATOM 719 N1 U A 5 -0.126 -3.771 7.514 1.00 0.43 N ATOM 720 C2 U A 5 0.911 -2.911 7.772 1.00 0.40 C ATOM 721 O2 U A 5 0.852 -2.052 8.639 1.00 0.39 O ATOM 722 N3 U A 5 2.019 -3.085 6.984 1.00 0.43 N ATOM 723 C4 U A 5 2.189 -4.011 5.983 1.00 0.50 C ATOM 724 O4 U A 5 3.253 -4.037 5.360 1.00 0.54 O ATOM 725 C5 U A 5 1.066 -4.870 5.772 1.00 0.55 C ATOM 726 C6 U A 5 -0.031 -4.728 6.527 1.00 0.51 C ATOM 0 H5' U A 5 -4.916 -4.389 6.195 1.00 0.45 H new ATOM 0 H5'' U A 5 -3.629 -5.576 6.292 1.00 0.45 H new ATOM 0 H4' U A 5 -4.186 -3.978 8.697 1.00 0.41 H new ATOM 0 H3' U A 5 -3.079 -2.686 6.186 1.00 0.35 H new ATOM 0 H2' U A 5 -1.415 -1.536 7.557 1.00 0.41 H new ATOM 0 HO2' U A 5 -3.313 -1.400 9.289 1.00 0.50 H new ATOM 0 H1' U A 5 -1.028 -3.650 9.384 1.00 0.43 H new ATOM 0 H3 U A 5 2.804 -2.458 7.160 1.00 0.43 H new ATOM 0 H5 U A 5 1.102 -5.631 5.006 1.00 0.55 H new ATOM 0 H6 U A 5 -0.870 -5.386 6.356 1.00 0.51 H new ATOM 737 P G A 6 -4.688 -0.683 6.383 1.00 0.43 P ATOM 738 OP1 G A 6 -6.166 -0.546 6.337 1.00 0.65 O ATOM 739 OP2 G A 6 -3.950 -1.043 5.147 1.00 0.54 O ATOM 740 O5' G A 6 -4.084 0.679 6.956 1.00 0.43 O ATOM 741 C5' G A 6 -2.718 0.763 7.414 1.00 0.47 C ATOM 742 C4' G A 6 -1.885 1.565 6.439 1.00 0.47 C ATOM 743 O4' G A 6 -0.525 1.062 6.450 1.00 0.53 O ATOM 744 C3' G A 6 -2.299 1.406 4.990 1.00 0.39 C ATOM 745 O3' G A 6 -3.357 2.308 4.682 1.00 0.41 O ATOM 746 C2' G A 6 -1.027 1.768 4.231 1.00 0.48 C ATOM 747 O2' G A 6 -0.909 3.156 3.981 1.00 0.59 O ATOM 748 C1' G A 6 0.074 1.306 5.188 1.00 0.49 C ATOM 749 N9 G A 6 0.720 0.075 4.741 1.00 0.50 N ATOM 750 C8 G A 6 0.194 -1.190 4.791 1.00 0.60 C ATOM 751 N7 G A 6 1.005 -2.103 4.328 1.00 0.63 N ATOM 752 C5 G A 6 2.137 -1.394 3.942 1.00 0.54 C ATOM 753 C6 G A 6 3.352 -1.845 3.361 1.00 0.55 C ATOM 754 O6 G A 6 3.684 -3.000 3.069 1.00 0.61 O ATOM 755 N1 G A 6 4.232 -0.793 3.122 1.00 0.55 N ATOM 756 C2 G A 6 3.970 0.525 3.408 1.00 0.57 C ATOM 757 N2 G A 6 4.944 1.401 3.105 1.00 0.70 N ATOM 758 N3 G A 6 2.842 0.958 3.950 1.00 0.53 N ATOM 759 C4 G A 6 1.977 -0.048 4.189 1.00 0.49 C ATOM 0 H5' G A 6 -2.301 -0.238 7.521 1.00 0.47 H new ATOM 0 H5'' G A 6 -2.686 1.229 8.399 1.00 0.47 H new ATOM 0 H4' G A 6 -2.005 2.600 6.759 1.00 0.47 H new ATOM 0 H3' G A 6 -2.670 0.411 4.743 1.00 0.39 H new ATOM 0 H2' G A 6 -0.994 1.308 3.244 1.00 0.48 H new ATOM 0 HO2' G A 6 -0.212 3.309 3.309 1.00 0.59 H new ATOM 0 H1' G A 6 0.837 2.083 5.233 1.00 0.49 H new ATOM 0 H8 G A 6 -0.791 -1.409 5.175 1.00 0.60 H new ATOM 0 H1 G A 6 5.136 -1.017 2.705 1.00 0.55 H new ATOM 0 H21 G A 6 4.812 2.395 3.292 1.00 0.70 H new ATOM 0 H22 G A 6 5.815 1.072 2.688 1.00 0.70 H new ATOM 771 P A A 7 -4.197 2.116 3.328 1.00 0.43 P ATOM 772 OP1 A A 7 -4.569 3.458 2.815 1.00 0.66 O ATOM 773 OP2 A A 7 -5.259 1.115 3.601 1.00 0.74 O ATOM 774 O5' A A 7 -3.150 1.466 2.320 1.00 0.33 O ATOM 775 C5' A A 7 -3.514 1.187 0.959 1.00 0.29 C ATOM 776 C4' A A 7 -2.553 1.862 0.014 1.00 0.23 C ATOM 777 O4' A A 7 -2.680 3.295 0.154 1.00 0.23 O ATOM 778 C3' A A 7 -1.083 1.619 0.302 1.00 0.25 C ATOM 779 O3' A A 7 -0.660 0.387 -0.274 1.00 0.27 O ATOM 780 C2' A A 7 -0.409 2.808 -0.376 1.00 0.24 C ATOM 781 O2' A A 7 -0.138 2.587 -1.746 1.00 0.25 O ATOM 782 C1' A A 7 -1.463 3.905 -0.230 1.00 0.21 C ATOM 783 N9 A A 7 -1.101 4.903 0.777 1.00 0.24 N ATOM 784 C8 A A 7 -1.658 5.098 2.016 1.00 0.29 C ATOM 785 N7 A A 7 -1.109 6.076 2.694 1.00 0.33 N ATOM 786 C5 A A 7 -0.127 6.561 1.842 1.00 0.30 C ATOM 787 C6 A A 7 0.810 7.603 1.972 1.00 0.34 C ATOM 788 N6 A A 7 0.912 8.376 3.056 1.00 0.39 N ATOM 789 N1 A A 7 1.647 7.826 0.936 1.00 0.35 N ATOM 790 C2 A A 7 1.543 7.050 -0.151 1.00 0.32 C ATOM 791 N3 A A 7 0.707 6.043 -0.390 1.00 0.27 N ATOM 792 C4 A A 7 -0.111 5.848 0.659 1.00 0.25 C ATOM 0 H5' A A 7 -4.529 1.536 0.768 1.00 0.29 H new ATOM 0 H5'' A A 7 -3.509 0.111 0.787 1.00 0.29 H new ATOM 0 H4' A A 7 -2.813 1.452 -0.962 1.00 0.23 H new ATOM 0 H3' A A 7 -0.848 1.543 1.364 1.00 0.25 H new ATOM 0 H2' A A 7 0.561 3.033 0.067 1.00 0.24 H new ATOM 0 HO2' A A 7 0.292 3.381 -2.127 1.00 0.25 H new ATOM 0 H1' A A 7 -1.548 4.422 -1.186 1.00 0.21 H new ATOM 0 H8 A A 7 -2.473 4.501 2.397 1.00 0.29 H new ATOM 0 H61 A A 7 1.613 9.116 3.090 1.00 0.39 H new ATOM 0 H62 A A 7 0.289 8.226 3.850 1.00 0.39 H new ATOM 0 H2 A A 7 2.237 7.274 -0.947 1.00 0.32 H new ATOM 804 P A A 8 0.342 -0.569 0.538 1.00 0.37 P ATOM 805 OP1 A A 8 0.111 -1.969 0.099 1.00 0.44 O ATOM 806 OP2 A A 8 0.220 -0.222 1.978 1.00 0.47 O ATOM 807 O5' A A 8 1.786 -0.120 0.041 1.00 0.38 O ATOM 808 C5' A A 8 1.972 0.449 -1.269 1.00 0.39 C ATOM 809 C4' A A 8 2.947 1.598 -1.202 1.00 0.43 C ATOM 810 O4' A A 8 2.309 2.712 -0.532 1.00 0.37 O ATOM 811 C3' A A 8 4.171 1.311 -0.350 1.00 0.53 C ATOM 812 O3' A A 8 5.201 0.670 -1.108 1.00 0.66 O ATOM 813 C2' A A 8 4.606 2.699 0.104 1.00 0.50 C ATOM 814 O2' A A 8 5.425 3.355 -0.842 1.00 0.58 O ATOM 815 C1' A A 8 3.268 3.431 0.223 1.00 0.38 C ATOM 816 N9 A A 8 2.794 3.498 1.603 1.00 0.36 N ATOM 817 C8 A A 8 1.796 2.757 2.177 1.00 0.42 C ATOM 818 N7 A A 8 1.583 3.044 3.439 1.00 0.47 N ATOM 819 C5 A A 8 2.509 4.040 3.714 1.00 0.41 C ATOM 820 C6 A A 8 2.800 4.765 4.883 1.00 0.44 C ATOM 821 N6 A A 8 2.155 4.593 6.039 1.00 0.54 N ATOM 822 N1 A A 8 3.788 5.683 4.823 1.00 0.40 N ATOM 823 C2 A A 8 4.436 5.854 3.662 1.00 0.36 C ATOM 824 N3 A A 8 4.253 5.235 2.498 1.00 0.35 N ATOM 825 C4 A A 8 3.263 4.329 2.592 1.00 0.35 C ATOM 0 H5' A A 8 1.016 0.795 -1.662 1.00 0.39 H new ATOM 0 H5'' A A 8 2.342 -0.313 -1.955 1.00 0.39 H new ATOM 0 H4' A A 8 3.243 1.789 -2.233 1.00 0.43 H new ATOM 0 H3' A A 8 3.963 0.632 0.477 1.00 0.53 H new ATOM 0 H2' A A 8 5.201 2.666 1.017 1.00 0.50 H new ATOM 0 HO2' A A 8 4.939 3.447 -1.688 1.00 0.58 H new ATOM 0 H1' A A 8 3.405 4.450 -0.139 1.00 0.38 H new ATOM 0 H8 A A 8 1.236 2.006 1.640 1.00 0.42 H new ATOM 0 H61 A A 8 2.412 5.150 6.854 1.00 0.54 H new ATOM 0 H62 A A 8 1.405 3.905 6.107 1.00 0.54 H new ATOM 0 H2 A A 8 5.217 6.600 3.673 1.00 0.36 H new ATOM 837 P A A 9 5.251 0.844 -2.706 1.00 1.47 P ATOM 838 OP1 A A 9 5.207 2.294 -3.019 1.00 2.35 O ATOM 839 OP2 A A 9 4.228 -0.063 -3.286 1.00 2.33 O ATOM 840 O5' A A 9 6.690 0.291 -3.108 1.00 1.08 O ATOM 841 C5' A A 9 7.807 0.438 -2.215 1.00 1.04 C ATOM 842 C4' A A 9 8.511 1.746 -2.474 1.00 1.09 C ATOM 843 O4' A A 9 7.952 2.343 -3.669 1.00 1.26 O ATOM 844 C3' A A 9 8.284 2.795 -1.403 1.00 0.99 C ATOM 845 O3' A A 9 9.216 2.641 -0.339 1.00 1.17 O ATOM 846 C2' A A 9 8.507 4.099 -2.158 1.00 1.26 C ATOM 847 O2' A A 9 9.874 4.456 -2.234 1.00 1.57 O ATOM 848 C1' A A 9 7.978 3.754 -3.552 1.00 1.29 C ATOM 849 N9 A A 9 6.614 4.237 -3.769 1.00 0.00 N ATOM 850 C8 A A 9 5.834 4.963 -2.906 1.00 0.00 C ATOM 851 N7 A A 9 4.646 5.251 -3.380 1.00 0.00 N ATOM 852 C5 A A 9 4.643 4.673 -4.641 1.00 0.00 C ATOM 853 C6 A A 9 3.669 4.613 -5.652 1.00 0.00 C ATOM 854 N6 A A 9 2.461 5.172 -5.551 1.00 0.00 N ATOM 855 N1 A A 9 3.981 3.951 -6.786 1.00 0.00 N ATOM 856 C2 A A 9 5.193 3.389 -6.886 1.00 0.00 C ATOM 857 N3 A A 9 6.191 3.378 -6.008 1.00 0.00 N ATOM 858 C4 A A 9 5.849 4.045 -4.894 1.00 0.00 C ATOM 0 H5' A A 9 8.502 -0.391 -2.351 1.00 1.04 H new ATOM 0 H5'' A A 9 7.463 0.400 -1.181 1.00 1.04 H new ATOM 0 H4' A A 9 9.570 1.496 -2.530 1.00 1.09 H new ATOM 0 H3' A A 9 7.302 2.737 -0.934 1.00 0.99 H new ATOM 0 H2' A A 9 8.021 4.948 -1.678 1.00 1.26 H new ATOM 0 HO2' A A 9 10.389 3.917 -1.597 1.00 1.57 H new ATOM 0 H1' A A 9 8.630 4.229 -4.285 1.00 1.29 H new ATOM 0 H8 A A 9 6.168 5.269 -1.926 1.00 0.00 H new ATOM 0 H61 A A 9 1.797 5.093 -6.321 1.00 0.00 H new ATOM 0 H62 A A 9 2.202 5.678 -4.704 1.00 0.00 H new ATOM 0 H2 A A 9 5.387 2.870 -7.813 1.00 0.00 H new ATOM 870 P A A 10 8.939 1.550 0.807 1.00 1.33 P ATOM 871 OP1 A A 10 9.445 0.237 0.331 1.00 2.11 O ATOM 872 OP2 A A 10 7.513 1.679 1.237 1.00 2.10 O ATOM 873 O5' A A 10 9.858 2.029 2.015 1.00 0.79 O ATOM 874 C5' A A 10 9.382 1.950 3.365 1.00 0.59 C ATOM 875 C4' A A 10 9.519 3.286 4.053 1.00 0.54 C ATOM 876 O4' A A 10 8.265 3.996 3.925 1.00 0.50 O ATOM 877 C3' A A 10 9.755 3.177 5.546 1.00 0.50 C ATOM 878 O3' A A 10 11.152 3.088 5.820 1.00 0.61 O ATOM 879 C2' A A 10 9.133 4.452 6.102 1.00 0.50 C ATOM 880 O2' A A 10 10.031 5.546 6.093 1.00 0.61 O ATOM 881 C1' A A 10 7.987 4.707 5.117 1.00 0.48 C ATOM 882 N9 A A 10 6.710 4.200 5.604 1.00 0.45 N ATOM 883 C8 A A 10 5.895 3.305 4.963 1.00 0.45 C ATOM 884 N7 A A 10 4.805 3.012 5.626 1.00 0.51 N ATOM 885 C5 A A 10 4.910 3.768 6.787 1.00 0.54 C ATOM 886 C6 A A 10 4.076 3.904 7.910 1.00 0.64 C ATOM 887 N6 A A 10 2.917 3.256 8.055 1.00 0.72 N ATOM 888 N1 A A 10 4.478 4.737 8.893 1.00 0.69 N ATOM 889 C2 A A 10 5.641 5.385 8.748 1.00 0.66 C ATOM 890 N3 A A 10 6.510 5.342 7.743 1.00 0.58 N ATOM 891 C4 A A 10 6.080 4.506 6.783 1.00 0.51 C ATOM 0 H5' A A 10 9.945 1.193 3.912 1.00 0.59 H new ATOM 0 H5'' A A 10 8.338 1.637 3.371 1.00 0.59 H new ATOM 0 H4' A A 10 10.370 3.781 3.585 1.00 0.54 H new ATOM 0 H3' A A 10 9.318 2.286 5.997 1.00 0.50 H new ATOM 0 H2' A A 10 8.830 4.347 7.144 1.00 0.50 H new ATOM 0 HO2' A A 10 10.940 5.222 5.922 1.00 0.61 H new ATOM 0 H1' A A 10 7.915 5.785 4.974 1.00 0.48 H new ATOM 0 H8 A A 10 6.130 2.880 3.998 1.00 0.45 H new ATOM 0 H61 A A 10 2.355 3.397 8.895 1.00 0.72 H new ATOM 0 H62 A A 10 2.594 2.620 7.326 1.00 0.72 H new ATOM 0 H2 A A 10 5.912 6.037 9.566 1.00 0.66 H new ATOM 903 P A A 11 11.661 2.945 7.339 1.00 0.62 P ATOM 904 OP1 A A 11 12.479 4.145 7.648 1.00 0.65 O ATOM 905 OP2 A A 11 12.250 1.592 7.506 1.00 0.77 O ATOM 906 O5' A A 11 10.326 3.020 8.204 1.00 0.58 O ATOM 907 C5' A A 11 10.260 3.828 9.394 1.00 0.56 C ATOM 908 C4' A A 11 8.946 3.604 10.102 1.00 0.49 C ATOM 909 O4' A A 11 7.917 3.412 9.100 1.00 0.46 O ATOM 910 C3' A A 11 8.891 2.345 10.950 1.00 0.47 C ATOM 911 O3' A A 11 9.353 2.610 12.272 1.00 0.51 O ATOM 912 C2' A A 11 7.408 1.994 10.948 1.00 0.43 C ATOM 913 O2' A A 11 6.685 2.665 11.965 1.00 0.47 O ATOM 914 C1' A A 11 6.957 2.486 9.573 1.00 0.42 C ATOM 915 N9 A A 11 6.861 1.403 8.593 1.00 0.41 N ATOM 916 C8 A A 11 7.808 1.008 7.682 1.00 0.46 C ATOM 917 N7 A A 11 7.427 0.006 6.924 1.00 0.47 N ATOM 918 C5 A A 11 6.144 -0.280 7.370 1.00 0.42 C ATOM 919 C6 A A 11 5.193 -1.239 6.976 1.00 0.43 C ATOM 920 N6 A A 11 5.383 -2.135 6.000 1.00 0.49 N ATOM 921 N1 A A 11 4.013 -1.250 7.631 1.00 0.40 N ATOM 922 C2 A A 11 3.807 -0.362 8.608 1.00 0.37 C ATOM 923 N3 A A 11 4.618 0.585 9.068 1.00 0.37 N ATOM 924 C4 A A 11 5.784 0.573 8.400 1.00 0.39 C ATOM 0 H5' A A 11 10.367 4.881 9.134 1.00 0.56 H new ATOM 0 H5'' A A 11 11.087 3.578 10.059 1.00 0.56 H new ATOM 0 H4' A A 11 8.813 4.473 10.746 1.00 0.49 H new ATOM 0 H3' A A 11 9.520 1.539 10.572 1.00 0.47 H new ATOM 0 H2' A A 11 7.235 0.934 11.134 1.00 0.43 H new ATOM 0 HO2' A A 11 7.300 2.939 12.677 1.00 0.47 H new ATOM 0 H1' A A 11 5.968 2.930 9.686 1.00 0.42 H new ATOM 0 H8 A A 11 8.777 1.478 7.596 1.00 0.46 H new ATOM 0 H61 A A 11 4.646 -2.801 5.769 1.00 0.49 H new ATOM 0 H62 A A 11 6.265 -2.151 5.487 1.00 0.49 H new ATOM 0 H2 A A 11 2.844 -0.423 9.093 1.00 0.37 H new ATOM 936 P G A 12 10.159 1.473 13.075 1.00 0.56 P ATOM 937 OP1 G A 12 10.970 2.135 14.130 1.00 0.65 O ATOM 938 OP2 G A 12 10.828 0.609 12.071 1.00 0.68 O ATOM 939 O5' G A 12 9.019 0.616 13.785 1.00 0.50 O ATOM 940 C5' G A 12 8.502 -0.579 13.171 1.00 0.47 C ATOM 941 C4' G A 12 6.994 -0.565 13.188 1.00 0.42 C ATOM 942 O4' G A 12 6.531 -0.371 11.832 1.00 0.40 O ATOM 943 C3' G A 12 6.353 -1.871 13.625 1.00 0.39 C ATOM 944 O3' G A 12 6.191 -1.901 15.040 1.00 0.43 O ATOM 945 C2' G A 12 5.004 -1.847 12.914 1.00 0.35 C ATOM 946 O2' G A 12 4.012 -1.152 13.646 1.00 0.37 O ATOM 947 C1' G A 12 5.330 -1.086 11.625 1.00 0.35 C ATOM 948 N9 G A 12 5.540 -1.975 10.488 1.00 0.33 N ATOM 949 C8 G A 12 6.662 -2.047 9.698 1.00 0.36 C ATOM 950 N7 G A 12 6.566 -2.942 8.754 1.00 0.36 N ATOM 951 C5 G A 12 5.305 -3.493 8.930 1.00 0.33 C ATOM 952 C6 G A 12 4.642 -4.512 8.203 1.00 0.36 C ATOM 953 O6 G A 12 5.051 -5.150 7.228 1.00 0.40 O ATOM 954 N1 G A 12 3.372 -4.765 8.714 1.00 0.36 N ATOM 955 C2 G A 12 2.819 -4.121 9.792 1.00 0.34 C ATOM 956 N2 G A 12 1.581 -4.509 10.138 1.00 0.37 N ATOM 957 N3 G A 12 3.427 -3.168 10.481 1.00 0.31 N ATOM 958 C4 G A 12 4.659 -2.907 9.996 1.00 0.31 C ATOM 0 H5' G A 12 8.870 -1.457 13.701 1.00 0.47 H new ATOM 0 H5'' G A 12 8.860 -0.653 12.144 1.00 0.47 H new ATOM 0 H4' G A 12 6.719 0.219 13.894 1.00 0.42 H new ATOM 0 H3' G A 12 6.947 -2.751 13.378 1.00 0.39 H new ATOM 0 H2' G A 12 4.596 -2.847 12.768 1.00 0.35 H new ATOM 0 HO2' G A 12 4.313 -1.030 14.571 1.00 0.37 H new ATOM 0 H1' G A 12 4.484 -0.436 11.399 1.00 0.35 H new ATOM 0 H8 G A 12 7.534 -1.426 9.844 1.00 0.36 H new ATOM 0 H1 G A 12 2.811 -5.482 8.253 1.00 0.36 H new ATOM 0 H21 G A 12 1.112 -4.071 10.931 1.00 0.37 H new ATOM 0 H22 G A 12 1.110 -5.242 9.608 1.00 0.37 H new ATOM 970 P G A 13 6.665 -3.196 15.867 1.00 0.51 P ATOM 971 OP1 G A 13 6.785 -2.816 17.298 1.00 0.57 O ATOM 972 OP2 G A 13 7.836 -3.772 15.159 1.00 0.59 O ATOM 973 O5' G A 13 5.447 -4.213 15.721 1.00 0.57 O ATOM 974 C5' G A 13 4.155 -3.902 16.272 1.00 0.62 C ATOM 975 C4' G A 13 3.155 -4.960 15.883 1.00 0.60 C ATOM 976 O4' G A 13 2.842 -4.795 14.478 1.00 0.59 O ATOM 977 C3' G A 13 3.676 -6.377 15.995 1.00 0.59 C ATOM 978 O3' G A 13 3.491 -6.890 17.319 1.00 0.66 O ATOM 979 C2' G A 13 2.845 -7.128 14.961 1.00 0.57 C ATOM 980 O2' G A 13 1.607 -7.600 15.452 1.00 0.63 O ATOM 981 C1' G A 13 2.604 -6.059 13.893 1.00 0.54 C ATOM 982 N9 G A 13 3.496 -6.205 12.747 1.00 0.50 N ATOM 983 C8 G A 13 4.664 -5.522 12.509 1.00 0.54 C ATOM 984 N7 G A 13 5.246 -5.876 11.396 1.00 0.56 N ATOM 985 C5 G A 13 4.411 -6.851 10.867 1.00 0.50 C ATOM 986 C6 G A 13 4.521 -7.607 9.670 1.00 0.53 C ATOM 987 O6 G A 13 5.409 -7.562 8.810 1.00 0.60 O ATOM 988 N1 G A 13 3.453 -8.488 9.517 1.00 0.51 N ATOM 989 C2 G A 13 2.415 -8.622 10.408 1.00 0.48 C ATOM 990 N2 G A 13 1.477 -9.524 10.092 1.00 0.52 N ATOM 991 N3 G A 13 2.302 -7.924 11.526 1.00 0.47 N ATOM 992 C4 G A 13 3.327 -7.065 11.690 1.00 0.47 C ATOM 0 H5' G A 13 3.823 -2.928 15.913 1.00 0.62 H new ATOM 0 H5'' G A 13 4.221 -3.835 17.358 1.00 0.62 H new ATOM 0 H4' G A 13 2.312 -4.832 16.562 1.00 0.60 H new ATOM 0 H3' G A 13 4.747 -6.466 15.814 1.00 0.59 H new ATOM 0 H2' G A 13 3.357 -8.027 14.617 1.00 0.57 H new ATOM 0 HO2' G A 13 1.081 -6.846 15.792 1.00 0.63 H new ATOM 0 H1' G A 13 1.580 -6.164 13.536 1.00 0.54 H new ATOM 0 H8 G A 13 5.060 -4.769 13.175 1.00 0.54 H new ATOM 0 H1 G A 13 3.440 -9.076 8.684 1.00 0.51 H new ATOM 0 H21 G A 13 0.681 -9.671 10.713 1.00 0.52 H new ATOM 0 H22 G A 13 1.559 -10.064 9.231 1.00 0.52 H new ATOM 1004 P G A 14 2.007 -7.092 17.914 1.00 0.74 P ATOM 1005 OP1 G A 14 1.075 -6.241 17.133 1.00 0.80 O ATOM 1006 OP2 G A 14 2.078 -6.936 19.389 1.00 0.90 O ATOM 1007 O5' G A 14 1.679 -8.618 17.596 1.00 0.68 O ATOM 1008 C5' G A 14 2.704 -9.503 17.106 1.00 0.70 C ATOM 1009 C4' G A 14 2.092 -10.621 16.301 1.00 0.68 C ATOM 1010 O4' G A 14 1.934 -10.163 14.936 1.00 0.67 O ATOM 1011 C3' G A 14 2.968 -11.853 16.182 1.00 0.67 C ATOM 1012 O3' G A 14 2.757 -12.730 17.283 1.00 0.77 O ATOM 1013 C2' G A 14 2.496 -12.478 14.875 1.00 0.67 C ATOM 1014 O2' G A 14 1.360 -13.306 15.041 1.00 0.80 O ATOM 1015 C1' G A 14 2.121 -11.248 14.047 1.00 0.61 C ATOM 1016 N9 G A 14 3.176 -10.878 13.111 1.00 0.50 N ATOM 1017 C8 G A 14 4.031 -9.809 13.213 1.00 0.50 C ATOM 1018 N7 G A 14 4.880 -9.738 12.224 1.00 0.47 N ATOM 1019 C5 G A 14 4.565 -10.828 11.423 1.00 0.41 C ATOM 1020 C6 G A 14 5.145 -11.272 10.208 1.00 0.40 C ATOM 1021 O6 G A 14 6.085 -10.772 9.580 1.00 0.45 O ATOM 1022 N1 G A 14 4.519 -12.423 9.728 1.00 0.41 N ATOM 1023 C2 G A 14 3.469 -13.057 10.346 1.00 0.46 C ATOM 1024 N2 G A 14 2.997 -14.151 9.734 1.00 0.55 N ATOM 1025 N3 G A 14 2.920 -12.651 11.479 1.00 0.49 N ATOM 1026 C4 G A 14 3.514 -11.539 11.957 1.00 0.44 C ATOM 0 H5' G A 14 3.268 -9.915 17.943 1.00 0.70 H new ATOM 0 H5'' G A 14 3.410 -8.946 16.489 1.00 0.70 H new ATOM 0 H4' G A 14 1.167 -10.881 16.816 1.00 0.68 H new ATOM 0 H3' G A 14 4.035 -11.633 16.188 1.00 0.67 H new ATOM 0 H2' G A 14 3.253 -13.124 14.430 1.00 0.67 H new ATOM 0 HO2' G A 14 1.098 -13.680 14.174 1.00 0.80 H new ATOM 0 H1' G A 14 1.220 -11.481 13.479 1.00 0.61 H new ATOM 0 H8 G A 14 4.004 -9.100 14.027 1.00 0.50 H new ATOM 0 H1 G A 14 4.866 -12.822 8.856 1.00 0.41 H new ATOM 0 H21 G A 14 2.218 -14.668 10.142 1.00 0.55 H new ATOM 0 H22 G A 14 3.417 -14.468 8.860 1.00 0.55 H new ATOM 1038 P C A 15 3.973 -13.628 17.825 1.00 0.87 P ATOM 1039 OP1 C A 15 3.589 -14.190 19.144 1.00 1.02 O ATOM 1040 OP2 C A 15 5.213 -12.820 17.704 1.00 0.91 O ATOM 1041 O5' C A 15 4.054 -14.822 16.775 1.00 0.85 O ATOM 1042 C5' C A 15 2.877 -15.570 16.424 1.00 0.94 C ATOM 1043 C4' C A 15 3.148 -16.443 15.223 1.00 0.97 C ATOM 1044 O4' C A 15 3.259 -15.614 14.042 1.00 0.84 O ATOM 1045 C3' C A 15 4.480 -17.165 15.264 1.00 1.09 C ATOM 1046 O3' C A 15 4.379 -18.381 16.016 1.00 1.31 O ATOM 1047 C2' C A 15 4.748 -17.458 13.792 1.00 1.09 C ATOM 1048 O2' C A 15 4.162 -18.669 13.355 1.00 1.30 O ATOM 1049 C1' C A 15 4.082 -16.270 13.094 1.00 0.89 C ATOM 1050 N1 C A 15 5.067 -15.310 12.580 1.00 0.75 N ATOM 1051 C2 C A 15 5.776 -15.642 11.424 1.00 0.77 C ATOM 1052 O2 C A 15 5.544 -16.722 10.863 1.00 0.89 O ATOM 1053 N3 C A 15 6.696 -14.782 10.944 1.00 0.70 N ATOM 1054 C4 C A 15 6.920 -13.631 11.569 1.00 0.66 C ATOM 1055 N4 C A 15 7.838 -12.823 11.053 1.00 0.71 N ATOM 1056 C5 C A 15 6.213 -13.263 12.751 1.00 0.64 C ATOM 1057 C6 C A 15 5.301 -14.124 13.219 1.00 0.66 C ATOM 0 H5' C A 15 2.055 -14.887 16.207 1.00 0.94 H new ATOM 0 H5'' C A 15 2.565 -16.187 17.267 1.00 0.94 H new ATOM 0 H4' C A 15 2.326 -17.158 15.216 1.00 0.97 H new ATOM 0 H3' C A 15 5.271 -16.588 15.743 1.00 1.09 H new ATOM 0 H2' C A 15 5.812 -17.575 13.584 1.00 1.09 H new ATOM 0 HO2' C A 15 4.030 -19.264 14.122 1.00 1.30 H new ATOM 0 HO3' C A 15 5.249 -18.831 16.028 1.00 1.31 H new ATOM 0 H1' C A 15 3.508 -16.643 12.246 1.00 0.89 H new ATOM 0 H41 C A 15 8.041 -11.930 11.501 1.00 0.71 H new ATOM 0 H42 C A 15 8.340 -13.096 10.208 1.00 0.71 H new ATOM 0 H5 C A 15 6.406 -12.325 13.250 1.00 0.64 H new ATOM 0 H6 C A 15 4.744 -13.879 14.111 1.00 0.66 H new TER 1069 C A 15