USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=21 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 Set 1.1: B 15 GLN :FLIP amide:sc= -2.57! C(o=-3.8!,f=-2.8!) USER MOD Set 1.2: B 19 LYS NZ :NH3+ -123:sc= -0.225 (180deg=-0.533) USER MOD Single : A 1 G O2' : rot 49:sc= -5.98! USER MOD Single : A 2 C O2' : rot -20:sc= 0.181 USER MOD Single : A 3 C O2' : rot 47:sc= -5.87! USER MOD Single : A 4 C O2' : rot 180:sc= -1.06 USER MOD Single : A 5 U O2' : rot -21:sc= -0.205 USER MOD Single : A 6 G O2' : rot -100:sc= 0.323 USER MOD Single : A 7 A O2' : rot 180:sc= -4.98! USER MOD Single : A 8 A O2' : rot 46:sc= -2.15! USER MOD Single : A 9 A O2' : rot -16:sc= 0.11 USER MOD Single : A 10 A O2' : rot -22:sc= 0.148 USER MOD Single : A 11 A O2' : rot -84:sc= -0.62! USER MOD Single : A 12 G O2' : rot -15:sc= 0.149 USER MOD Single : A 13 G O2' : rot -91:sc= 0.806 USER MOD Single : A 14 G O2' : rot 180:sc= -1.77! USER MOD Single : A 15 C O2' : rot -18:sc= 0.196 USER MOD Single : A 15 C O3' : rot 180:sc= 0.185 USER MOD Single : B 4 GLN : amide:sc= -4.51! C(o=-4.5!,f=-4.4!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ -175:sc= 0.355 (180deg=0.343) USER MOD Single : B 17 GLN : amide:sc= -0.21 X(o=-0.21,f=-0.075) USER MOD Single : B 22 ASN : amide:sc= -5.84! C(o=-5.8!,f=-5.4!) USER MOD Single : B 29 SER OG : rot 180:sc= 0.274 USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 9.594 -12.567 -1.688 1.00 0.76 N ATOM 2 CA ASP B 2 9.188 -12.319 -0.272 1.00 0.88 C ATOM 3 C ASP B 2 7.693 -12.577 -0.101 1.00 0.68 C ATOM 4 O ASP B 2 7.065 -13.233 -0.908 1.00 0.66 O ATOM 5 CB ASP B 2 9.504 -10.844 -0.004 1.00 1.25 C ATOM 6 CG ASP B 2 10.932 -10.523 -0.455 1.00 1.88 C ATOM 7 OD1 ASP B 2 11.828 -11.266 -0.089 1.00 2.35 O ATOM 8 OD2 ASP B 2 11.104 -9.541 -1.157 1.00 2.37 O ATOM 0 HA ASP B 2 9.713 -12.977 0.421 1.00 0.88 H new ATOM 0 HB2 ASP B 2 8.795 -10.209 -0.536 1.00 1.25 H new ATOM 0 HB3 ASP B 2 9.392 -10.627 1.058 1.00 1.25 H new ATOM 15 N ALA B 3 7.125 -12.060 0.950 1.00 0.63 N ATOM 16 CA ALA B 3 5.667 -12.261 1.195 1.00 0.58 C ATOM 17 C ALA B 3 4.954 -10.916 1.251 1.00 0.63 C ATOM 18 O ALA B 3 3.951 -10.709 0.599 1.00 0.61 O ATOM 19 CB ALA B 3 5.584 -12.975 2.543 1.00 0.75 C ATOM 0 H ALA B 3 7.608 -11.504 1.655 1.00 0.63 H new ATOM 0 HA ALA B 3 5.190 -12.838 0.403 1.00 0.58 H new ATOM 0 HB1 ALA B 3 4.539 -13.159 2.794 1.00 0.75 H new ATOM 0 HB2 ALA B 3 6.116 -13.925 2.485 1.00 0.75 H new ATOM 0 HB3 ALA B 3 6.038 -12.352 3.313 1.00 0.75 H new ATOM 25 N GLN B 4 5.468 -9.998 2.015 1.00 0.75 N ATOM 26 CA GLN B 4 4.820 -8.661 2.095 1.00 0.89 C ATOM 27 C GLN B 4 4.962 -7.965 0.759 1.00 0.79 C ATOM 28 O GLN B 4 3.988 -7.578 0.143 1.00 0.81 O ATOM 29 CB GLN B 4 5.581 -7.902 3.177 1.00 1.09 C ATOM 30 CG GLN B 4 4.944 -6.527 3.379 1.00 1.29 C ATOM 31 CD GLN B 4 5.755 -5.741 4.407 1.00 0.85 C ATOM 32 OE1 GLN B 4 6.371 -6.318 5.281 1.00 1.14 O ATOM 33 NE2 GLN B 4 5.785 -4.442 4.336 1.00 0.94 N ATOM 0 H GLN B 4 6.305 -10.113 2.586 1.00 0.75 H new ATOM 0 HA GLN B 4 3.757 -8.722 2.330 1.00 0.89 H new ATOM 0 HB2 GLN B 4 5.563 -8.464 4.111 1.00 1.09 H new ATOM 0 HB3 GLN B 4 6.627 -7.792 2.891 1.00 1.09 H new ATOM 0 HG2 GLN B 4 4.912 -5.986 2.433 1.00 1.29 H new ATOM 0 HG3 GLN B 4 3.914 -6.637 3.718 1.00 1.29 H new ATOM 0 HE21 GLN B 4 5.267 -3.959 3.602 1.00 0.94 H new ATOM 0 HE22 GLN B 4 6.326 -3.907 5.015 1.00 0.94 H new ATOM 42 N THR B 5 6.169 -7.832 0.291 1.00 0.76 N ATOM 43 CA THR B 5 6.371 -7.191 -1.037 1.00 0.79 C ATOM 44 C THR B 5 5.430 -7.872 -2.028 1.00 0.59 C ATOM 45 O THR B 5 4.887 -7.256 -2.924 1.00 0.57 O ATOM 46 CB THR B 5 7.831 -7.449 -1.402 1.00 0.94 C ATOM 47 OG1 THR B 5 8.676 -6.844 -0.431 1.00 1.26 O ATOM 48 CG2 THR B 5 8.113 -6.846 -2.774 1.00 0.94 C ATOM 0 H THR B 5 7.019 -8.136 0.765 1.00 0.76 H new ATOM 0 HA THR B 5 6.162 -6.121 -1.041 1.00 0.79 H new ATOM 0 HB THR B 5 8.023 -8.522 -1.426 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.613 -7.011 -0.664 1.00 1.26 H new ATOM 0 HG21 THR B 5 9.154 -7.025 -3.043 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.461 -7.308 -3.516 1.00 0.94 H new ATOM 0 HG23 THR B 5 7.925 -5.773 -2.745 1.00 0.94 H new ATOM 56 N ARG B 6 5.198 -9.143 -1.824 1.00 0.48 N ATOM 57 CA ARG B 6 4.252 -9.884 -2.695 1.00 0.46 C ATOM 58 C ARG B 6 2.845 -9.436 -2.360 1.00 0.43 C ATOM 59 O ARG B 6 2.030 -9.178 -3.223 1.00 0.45 O ATOM 60 CB ARG B 6 4.397 -11.349 -2.303 1.00 0.56 C ATOM 61 CG ARG B 6 5.009 -12.140 -3.460 1.00 0.78 C ATOM 62 CD ARG B 6 4.452 -13.565 -3.456 1.00 1.03 C ATOM 63 NE ARG B 6 5.168 -14.256 -2.344 1.00 0.88 N ATOM 64 CZ ARG B 6 5.140 -15.563 -2.243 1.00 0.73 C ATOM 65 NH1 ARG B 6 4.485 -16.288 -3.114 1.00 1.43 N ATOM 66 NH2 ARG B 6 5.773 -16.147 -1.263 1.00 1.26 N ATOM 0 H ARG B 6 5.629 -9.699 -1.085 1.00 0.48 H new ATOM 0 HA ARG B 6 4.448 -9.718 -3.754 1.00 0.46 H new ATOM 0 HB2 ARG B 6 5.027 -11.437 -1.418 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.423 -11.763 -2.043 1.00 0.56 H new ATOM 0 HG2 ARG B 6 4.782 -11.652 -4.408 1.00 0.78 H new ATOM 0 HG3 ARG B 6 6.095 -12.162 -3.365 1.00 0.78 H new ATOM 0 HD2 ARG B 6 3.374 -13.567 -3.293 1.00 1.03 H new ATOM 0 HD3 ARG B 6 4.631 -14.062 -4.410 1.00 1.03 H new ATOM 0 HE ARG B 6 5.684 -13.707 -1.656 1.00 0.88 H new ATOM 0 HH11 ARG B 6 3.989 -15.837 -3.883 1.00 1.43 H new ATOM 0 HH12 ARG B 6 4.471 -17.304 -3.024 1.00 1.43 H new ATOM 0 HH21 ARG B 6 6.285 -15.587 -0.581 1.00 1.26 H new ATOM 0 HH22 ARG B 6 5.755 -17.163 -1.178 1.00 1.26 H new ATOM 80 N ARG B 7 2.561 -9.356 -1.091 1.00 0.61 N ATOM 81 CA ARG B 7 1.206 -8.941 -0.662 1.00 0.80 C ATOM 82 C ARG B 7 0.895 -7.560 -1.247 1.00 0.65 C ATOM 83 O ARG B 7 -0.229 -7.259 -1.594 1.00 0.56 O ATOM 84 CB ARG B 7 1.288 -8.916 0.867 1.00 1.16 C ATOM 85 CG ARG B 7 0.140 -8.091 1.467 1.00 1.10 C ATOM 86 CD ARG B 7 0.570 -7.551 2.835 1.00 0.92 C ATOM 87 NE ARG B 7 0.509 -6.063 2.700 1.00 0.41 N ATOM 88 CZ ARG B 7 1.507 -5.394 2.176 1.00 0.93 C ATOM 89 NH1 ARG B 7 2.584 -6.009 1.758 1.00 1.61 N ATOM 90 NH2 ARG B 7 1.425 -4.098 2.071 1.00 1.08 N ATOM 0 H ARG B 7 3.213 -9.561 -0.334 1.00 0.61 H new ATOM 0 HA ARG B 7 0.410 -9.604 -1.002 1.00 0.80 H new ATOM 0 HB2 ARG B 7 1.249 -9.934 1.253 1.00 1.16 H new ATOM 0 HB3 ARG B 7 2.244 -8.494 1.176 1.00 1.16 H new ATOM 0 HG2 ARG B 7 -0.118 -7.267 0.802 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -0.752 -8.708 1.570 1.00 1.10 H new ATOM 0 HD2 ARG B 7 -0.094 -7.903 3.625 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.576 -7.883 3.092 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.320 -5.562 3.020 1.00 0.41 H new ATOM 0 HH11 ARG B 7 2.655 -7.023 1.838 1.00 1.61 H new ATOM 0 HH12 ARG B 7 3.352 -5.474 1.353 1.00 1.61 H new ATOM 0 HH21 ARG B 7 0.589 -3.612 2.395 1.00 1.08 H new ATOM 0 HH22 ARG B 7 2.197 -3.569 1.665 1.00 1.08 H new ATOM 104 N ARG B 8 1.896 -6.730 -1.374 1.00 0.68 N ATOM 105 CA ARG B 8 1.681 -5.369 -1.957 1.00 0.67 C ATOM 106 C ARG B 8 1.042 -5.509 -3.322 1.00 0.48 C ATOM 107 O ARG B 8 0.141 -4.773 -3.674 1.00 0.50 O ATOM 108 CB ARG B 8 3.080 -4.764 -2.081 1.00 0.77 C ATOM 109 CG ARG B 8 2.988 -3.236 -2.078 1.00 0.73 C ATOM 110 CD ARG B 8 2.869 -2.728 -0.639 1.00 0.73 C ATOM 111 NE ARG B 8 4.065 -3.277 0.068 1.00 0.85 N ATOM 112 CZ ARG B 8 5.260 -2.790 -0.159 1.00 1.05 C ATOM 113 NH1 ARG B 8 5.434 -1.811 -1.008 1.00 1.16 N ATOM 114 NH2 ARG B 8 6.289 -3.287 0.471 1.00 1.43 N ATOM 0 H ARG B 8 2.857 -6.935 -1.099 1.00 0.68 H new ATOM 0 HA ARG B 8 1.027 -4.746 -1.347 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.706 -5.101 -1.255 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.554 -5.107 -3.001 1.00 0.77 H new ATOM 0 HG2 ARG B 8 3.871 -2.808 -2.553 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.125 -2.913 -2.660 1.00 0.73 H new ATOM 0 HD2 ARG B 8 2.857 -1.639 -0.605 1.00 0.73 H new ATOM 0 HD3 ARG B 8 1.945 -3.072 -0.175 1.00 0.73 H new ATOM 0 HE ARG B 8 3.950 -4.040 0.735 1.00 0.85 H new ATOM 0 HH11 ARG B 8 4.634 -1.417 -1.503 1.00 1.16 H new ATOM 0 HH12 ARG B 8 6.370 -1.441 -1.175 1.00 1.16 H new ATOM 0 HH21 ARG B 8 6.160 -4.050 1.136 1.00 1.43 H new ATOM 0 HH22 ARG B 8 7.222 -2.912 0.299 1.00 1.43 H new ATOM 128 N GLU B 9 1.465 -6.476 -4.081 1.00 0.38 N ATOM 129 CA GLU B 9 0.825 -6.679 -5.407 1.00 0.34 C ATOM 130 C GLU B 9 -0.647 -6.972 -5.162 1.00 0.31 C ATOM 131 O GLU B 9 -1.508 -6.623 -5.945 1.00 0.34 O ATOM 132 CB GLU B 9 1.538 -7.874 -6.045 1.00 0.40 C ATOM 133 CG GLU B 9 3.027 -7.557 -6.219 1.00 0.59 C ATOM 134 CD GLU B 9 3.351 -7.415 -7.708 1.00 1.24 C ATOM 135 OE1 GLU B 9 3.212 -6.318 -8.223 1.00 1.88 O ATOM 136 OE2 GLU B 9 3.734 -8.406 -8.309 1.00 1.73 O ATOM 0 H GLU B 9 2.215 -7.126 -3.847 1.00 0.38 H new ATOM 0 HA GLU B 9 0.899 -5.813 -6.065 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.416 -8.758 -5.420 1.00 0.40 H new ATOM 0 HB3 GLU B 9 1.090 -8.103 -7.012 1.00 0.40 H new ATOM 0 HG2 GLU B 9 3.277 -6.636 -5.693 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.632 -8.350 -5.779 1.00 0.59 H new ATOM 143 N ARG B 10 -0.934 -7.568 -4.040 1.00 0.31 N ATOM 144 CA ARG B 10 -2.342 -7.841 -3.682 1.00 0.38 C ATOM 145 C ARG B 10 -2.960 -6.554 -3.143 1.00 0.35 C ATOM 146 O ARG B 10 -4.165 -6.432 -3.032 1.00 0.40 O ATOM 147 CB ARG B 10 -2.284 -8.919 -2.597 1.00 0.46 C ATOM 148 CG ARG B 10 -2.992 -10.183 -3.091 1.00 0.73 C ATOM 149 CD ARG B 10 -2.249 -11.419 -2.576 1.00 0.67 C ATOM 150 NE ARG B 10 -2.936 -12.580 -3.215 1.00 1.55 N ATOM 151 CZ ARG B 10 -2.647 -13.806 -2.854 1.00 2.12 C ATOM 152 NH1 ARG B 10 -1.753 -14.038 -1.927 1.00 2.20 N ATOM 153 NH2 ARG B 10 -3.259 -14.808 -3.424 1.00 3.14 N ATOM 0 H ARG B 10 -0.245 -7.878 -3.354 1.00 0.31 H new ATOM 0 HA ARG B 10 -2.945 -8.174 -4.527 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -1.247 -9.144 -2.349 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -2.758 -8.557 -1.685 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -4.024 -10.194 -2.742 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -3.024 -10.193 -4.180 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -1.194 -11.387 -2.848 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -2.296 -11.483 -1.489 1.00 0.67 H new ATOM 0 HE ARG B 10 -3.636 -12.418 -3.939 1.00 1.55 H new ATOM 0 HH11 ARG B 10 -1.272 -13.260 -1.476 1.00 2.20 H new ATOM 0 HH12 ARG B 10 -1.537 -14.997 -1.655 1.00 2.20 H new ATOM 0 HH21 ARG B 10 -3.958 -14.634 -4.146 1.00 3.14 H new ATOM 0 HH22 ARG B 10 -3.038 -15.765 -3.147 1.00 3.14 H new ATOM 167 N ARG B 11 -2.141 -5.580 -2.829 1.00 0.29 N ATOM 168 CA ARG B 11 -2.688 -4.298 -2.327 1.00 0.29 C ATOM 169 C ARG B 11 -2.878 -3.324 -3.485 1.00 0.24 C ATOM 170 O ARG B 11 -3.324 -2.216 -3.291 1.00 0.25 O ATOM 171 CB ARG B 11 -1.652 -3.740 -1.358 1.00 0.32 C ATOM 172 CG ARG B 11 -1.493 -4.658 -0.137 1.00 0.41 C ATOM 173 CD ARG B 11 -2.849 -4.877 0.545 1.00 0.55 C ATOM 174 NE ARG B 11 -3.000 -6.360 0.629 1.00 1.59 N ATOM 175 CZ ARG B 11 -4.113 -6.895 1.073 1.00 2.18 C ATOM 176 NH1 ARG B 11 -5.113 -6.140 1.452 1.00 1.76 N ATOM 177 NH2 ARG B 11 -4.223 -8.193 1.138 1.00 3.24 N ATOM 0 H ARG B 11 -1.124 -5.624 -2.901 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.654 -4.444 -1.844 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.693 -3.634 -1.866 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -1.952 -2.744 -1.032 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -1.075 -5.616 -0.446 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.790 -4.216 0.569 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -2.872 -4.421 1.535 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.658 -4.429 -0.032 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.231 -6.963 0.338 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -5.032 -5.124 1.404 1.00 1.76 H new ATOM 0 HH12 ARG B 11 -5.973 -6.567 1.795 1.00 1.76 H new ATOM 0 HH21 ARG B 11 -3.447 -8.786 0.845 1.00 3.24 H new ATOM 0 HH22 ARG B 11 -5.085 -8.615 1.482 1.00 3.24 H new ATOM 191 N ALA B 12 -2.561 -3.725 -4.694 1.00 0.24 N ATOM 192 CA ALA B 12 -2.760 -2.799 -5.853 1.00 0.28 C ATOM 193 C ALA B 12 -4.192 -2.280 -5.806 1.00 0.31 C ATOM 194 O ALA B 12 -4.490 -1.176 -6.214 1.00 0.33 O ATOM 195 CB ALA B 12 -2.552 -3.662 -7.091 1.00 0.34 C ATOM 0 H ALA B 12 -2.178 -4.641 -4.926 1.00 0.24 H new ATOM 0 HA ALA B 12 -2.082 -1.945 -5.845 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -2.682 -3.053 -7.985 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.545 -4.079 -7.079 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -3.280 -4.473 -7.096 1.00 0.34 H new ATOM 201 N GLU B 13 -5.068 -3.079 -5.271 1.00 0.34 N ATOM 202 CA GLU B 13 -6.481 -2.664 -5.133 1.00 0.41 C ATOM 203 C GLU B 13 -6.547 -1.610 -4.037 1.00 0.38 C ATOM 204 O GLU B 13 -7.236 -0.615 -4.148 1.00 0.42 O ATOM 205 CB GLU B 13 -7.211 -3.964 -4.758 1.00 0.48 C ATOM 206 CG GLU B 13 -7.557 -4.018 -3.268 1.00 0.52 C ATOM 207 CD GLU B 13 -8.733 -3.084 -2.964 1.00 0.77 C ATOM 208 OE1 GLU B 13 -9.812 -3.342 -3.468 1.00 1.18 O ATOM 209 OE2 GLU B 13 -8.531 -2.129 -2.233 1.00 1.15 O ATOM 0 H GLU B 13 -4.859 -4.014 -4.920 1.00 0.34 H new ATOM 0 HA GLU B 13 -6.928 -2.221 -6.023 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -8.125 -4.049 -5.346 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -6.585 -4.818 -5.016 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -7.811 -5.039 -2.983 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.690 -3.728 -2.675 1.00 0.52 H new ATOM 216 N LYS B 14 -5.796 -1.816 -2.992 1.00 0.33 N ATOM 217 CA LYS B 14 -5.770 -0.814 -1.889 1.00 0.33 C ATOM 218 C LYS B 14 -5.015 0.414 -2.392 1.00 0.28 C ATOM 219 O LYS B 14 -5.365 1.546 -2.121 1.00 0.30 O ATOM 220 CB LYS B 14 -5.009 -1.486 -0.739 1.00 0.31 C ATOM 221 CG LYS B 14 -5.704 -2.788 -0.329 1.00 0.38 C ATOM 222 CD LYS B 14 -7.081 -2.479 0.263 1.00 1.23 C ATOM 223 CE LYS B 14 -7.965 -3.724 0.171 1.00 1.37 C ATOM 224 NZ LYS B 14 -9.360 -3.217 0.296 1.00 1.83 N ATOM 0 H LYS B 14 -5.200 -2.632 -2.853 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.762 -0.502 -1.563 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -3.984 -1.694 -1.045 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -4.956 -0.810 0.115 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -5.809 -3.443 -1.194 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.096 -3.321 0.402 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -6.980 -2.167 1.303 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.543 -1.651 -0.275 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -7.817 -4.244 -0.776 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -7.731 -4.434 0.964 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -10.020 -4.020 0.327 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -9.450 -2.661 1.170 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -9.585 -2.616 -0.522 1.00 1.83 H new ATOM 238 N GLN B 15 -3.982 0.170 -3.143 1.00 0.25 N ATOM 239 CA GLN B 15 -3.161 1.266 -3.719 1.00 0.24 C ATOM 240 C GLN B 15 -3.959 2.014 -4.780 1.00 0.28 C ATOM 241 O GLN B 15 -4.032 3.221 -4.779 1.00 0.28 O ATOM 242 CB GLN B 15 -1.975 0.537 -4.356 1.00 0.24 C ATOM 243 CG GLN B 15 -0.715 0.796 -3.536 1.00 0.25 C ATOM 244 CD GLN B 15 0.239 -0.386 -3.701 1.00 0.30 C ATOM 245 OE1 GLN B 15 -0.122 -1.557 -3.259 1.00 0.35 O flip ATOM 246 NE2 GLN B 15 1.322 -0.242 -4.236 1.00 0.33 N flip ATOM 0 H GLN B 15 -3.664 -0.768 -3.388 1.00 0.25 H new ATOM 0 HA GLN B 15 -2.853 2.005 -2.979 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -2.176 -0.533 -4.404 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -1.831 0.881 -5.380 1.00 0.24 H new ATOM 0 HG2 GLN B 15 -0.234 1.717 -3.866 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -0.971 0.929 -2.485 1.00 0.25 H new ATOM 0 HE21 GLN B 15 1.602 0.676 -4.581 1.00 0.33 H new ATOM 0 HE22 GLN B 15 1.950 -1.039 -4.339 1.00 0.33 H new ATOM 255 N ALA B 16 -4.557 1.302 -5.686 1.00 0.35 N ATOM 256 CA ALA B 16 -5.353 1.976 -6.752 1.00 0.41 C ATOM 257 C ALA B 16 -6.577 2.649 -6.135 1.00 0.40 C ATOM 258 O ALA B 16 -7.047 3.658 -6.624 1.00 0.43 O ATOM 259 CB ALA B 16 -5.768 0.863 -7.714 1.00 0.48 C ATOM 0 H ALA B 16 -4.532 0.284 -5.739 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.787 2.753 -7.266 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.359 1.286 -8.527 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -4.878 0.385 -8.123 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.364 0.123 -7.179 1.00 0.48 H new ATOM 265 N GLN B 17 -7.081 2.122 -5.050 1.00 0.40 N ATOM 266 CA GLN B 17 -8.252 2.773 -4.404 1.00 0.42 C ATOM 267 C GLN B 17 -7.745 3.980 -3.632 1.00 0.37 C ATOM 268 O GLN B 17 -8.379 5.016 -3.571 1.00 0.40 O ATOM 269 CB GLN B 17 -8.836 1.723 -3.461 1.00 0.45 C ATOM 270 CG GLN B 17 -9.796 0.816 -4.235 1.00 0.53 C ATOM 271 CD GLN B 17 -11.137 1.529 -4.419 1.00 0.66 C ATOM 272 OE1 GLN B 17 -11.594 1.711 -5.530 1.00 1.06 O ATOM 273 NE2 GLN B 17 -11.791 1.945 -3.369 1.00 1.33 N ATOM 0 H GLN B 17 -6.736 1.280 -4.590 1.00 0.40 H new ATOM 0 HA GLN B 17 -9.008 3.112 -5.112 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -8.035 1.130 -3.020 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -9.362 2.209 -2.639 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -9.371 0.563 -5.206 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -9.941 -0.121 -3.697 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -11.408 1.792 -2.436 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -12.685 2.423 -3.481 1.00 1.33 H new ATOM 282 N TRP B 18 -6.578 3.853 -3.074 1.00 0.32 N ATOM 283 CA TRP B 18 -5.974 4.984 -2.333 1.00 0.30 C ATOM 284 C TRP B 18 -5.431 5.991 -3.339 1.00 0.31 C ATOM 285 O TRP B 18 -5.647 7.182 -3.237 1.00 0.35 O ATOM 286 CB TRP B 18 -4.811 4.367 -1.554 1.00 0.25 C ATOM 287 CG TRP B 18 -4.030 5.467 -0.917 1.00 0.24 C ATOM 288 CD1 TRP B 18 -4.148 5.904 0.353 1.00 0.30 C ATOM 289 CD2 TRP B 18 -3.015 6.283 -1.533 1.00 0.24 C ATOM 290 NE1 TRP B 18 -3.266 6.958 0.542 1.00 0.31 N ATOM 291 CE2 TRP B 18 -2.538 7.217 -0.596 1.00 0.29 C ATOM 292 CE3 TRP B 18 -2.471 6.287 -2.810 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -1.546 8.133 -0.932 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -1.481 7.191 -3.155 1.00 0.36 C ATOM 295 CH2 TRP B 18 -1.016 8.114 -2.226 1.00 0.38 C ATOM 0 H TRP B 18 -6.013 3.004 -3.101 1.00 0.32 H new ATOM 0 HA TRP B 18 -6.684 5.491 -1.680 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -5.186 3.680 -0.795 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -4.173 3.787 -2.222 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -4.817 5.501 1.099 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -3.169 7.476 1.415 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -2.824 5.577 -3.543 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 -1.191 8.848 -0.205 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -1.067 7.179 -4.153 1.00 0.36 H new ATOM 0 HH2 TRP B 18 -0.245 8.817 -2.504 1.00 0.38 H new ATOM 306 N LYS B 19 -4.720 5.498 -4.308 1.00 0.30 N ATOM 307 CA LYS B 19 -4.129 6.381 -5.346 1.00 0.37 C ATOM 308 C LYS B 19 -5.248 7.108 -6.059 1.00 0.46 C ATOM 309 O LYS B 19 -5.121 8.253 -6.444 1.00 0.70 O ATOM 310 CB LYS B 19 -3.402 5.447 -6.316 1.00 0.40 C ATOM 311 CG LYS B 19 -2.089 4.949 -5.706 1.00 0.49 C ATOM 312 CD LYS B 19 -1.417 3.982 -6.683 1.00 0.96 C ATOM 313 CE LYS B 19 0.091 3.962 -6.428 1.00 1.30 C ATOM 314 NZ LYS B 19 0.475 2.524 -6.485 1.00 1.92 N ATOM 0 H LYS B 19 -4.520 4.505 -4.427 1.00 0.30 H new ATOM 0 HA LYS B 19 -3.449 7.124 -4.929 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -4.041 4.598 -6.559 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -3.199 5.971 -7.250 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -1.429 5.791 -5.496 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -2.281 4.450 -4.756 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -1.830 2.981 -6.562 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -1.619 4.288 -7.710 1.00 0.96 H new ATOM 0 HE2 LYS B 19 0.626 4.543 -7.180 1.00 1.30 H new ATOM 0 HE3 LYS B 19 0.333 4.396 -5.458 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 0.935 2.252 -5.593 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 -0.376 1.943 -6.627 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 1.134 2.372 -7.275 1.00 1.92 H new ATOM 328 N ALA B 20 -6.355 6.445 -6.230 1.00 0.44 N ATOM 329 CA ALA B 20 -7.493 7.097 -6.911 1.00 0.52 C ATOM 330 C ALA B 20 -7.917 8.338 -6.130 1.00 0.56 C ATOM 331 O ALA B 20 -8.409 9.300 -6.687 1.00 0.74 O ATOM 332 CB ALA B 20 -8.611 6.066 -6.911 1.00 0.55 C ATOM 0 H ALA B 20 -6.516 5.484 -5.928 1.00 0.44 H new ATOM 0 HA ALA B 20 -7.240 7.415 -7.922 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -9.490 6.483 -7.402 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -8.284 5.175 -7.447 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -8.861 5.800 -5.884 1.00 0.55 H new ATOM 338 N ALA B 21 -7.729 8.319 -4.836 1.00 0.54 N ATOM 339 CA ALA B 21 -8.122 9.494 -4.011 1.00 0.66 C ATOM 340 C ALA B 21 -6.919 10.040 -3.252 1.00 0.73 C ATOM 341 O ALA B 21 -7.050 10.653 -2.210 1.00 0.99 O ATOM 342 CB ALA B 21 -9.184 8.971 -3.049 1.00 0.71 C ATOM 0 H ALA B 21 -7.321 7.541 -4.318 1.00 0.54 H new ATOM 0 HA ALA B 21 -8.501 10.315 -4.620 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -9.524 9.783 -2.406 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -10.028 8.580 -3.617 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -8.760 8.176 -2.436 1.00 0.71 H new ATOM 348 N ASN B 22 -5.754 9.844 -3.788 1.00 0.73 N ATOM 349 CA ASN B 22 -4.522 10.370 -3.127 1.00 0.88 C ATOM 350 C ASN B 22 -3.398 10.608 -4.144 1.00 1.08 C ATOM 351 O ASN B 22 -2.273 10.205 -3.924 1.00 0.00 O ATOM 352 CB ASN B 22 -4.089 9.314 -2.117 1.00 0.93 C ATOM 353 CG ASN B 22 -5.137 9.185 -1.016 1.00 0.94 C ATOM 354 OD1 ASN B 22 -5.474 10.149 -0.358 1.00 1.13 O ATOM 355 ND2 ASN B 22 -5.665 8.021 -0.790 1.00 0.94 N ATOM 0 H ASN B 22 -5.594 9.340 -4.660 1.00 0.73 H new ATOM 0 HA ASN B 22 -4.729 11.328 -2.650 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -3.954 8.355 -2.617 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -3.126 9.586 -1.684 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -6.366 7.913 -0.057 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -5.379 7.215 -1.345 1.00 0.94 H new ATOM 362 N PRO B 23 -3.723 11.300 -5.201 1.00 0.00 N ATOM 363 CA PRO B 23 -2.711 11.640 -6.218 1.00 0.00 C ATOM 364 C PRO B 23 -1.806 12.707 -5.602 1.00 0.00 C ATOM 365 O PRO B 23 -0.655 12.861 -5.962 1.00 0.00 O ATOM 366 CB PRO B 23 -3.529 12.185 -7.385 1.00 0.00 C ATOM 367 CG PRO B 23 -4.800 12.667 -6.770 1.00 0.00 C ATOM 368 CD PRO B 23 -5.035 11.832 -5.536 1.00 0.00 C ATOM 0 HA PRO B 23 -2.080 10.814 -6.546 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -3.004 12.994 -7.892 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -3.719 11.412 -8.130 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -4.728 13.724 -6.513 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -5.630 12.565 -7.469 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -5.440 12.433 -4.721 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -5.750 11.032 -5.728 1.00 0.00 H new ATOM 376 N LEU B 24 -2.336 13.420 -4.639 1.00 0.00 N ATOM 377 CA LEU B 24 -1.540 14.463 -3.936 1.00 0.00 C ATOM 378 C LEU B 24 -0.363 13.794 -3.224 1.00 0.00 C ATOM 379 O LEU B 24 0.725 14.328 -3.144 1.00 0.00 O ATOM 380 CB LEU B 24 -2.525 15.098 -2.931 1.00 0.00 C ATOM 381 CG LEU B 24 -2.479 14.384 -1.561 1.00 0.00 C ATOM 382 CD1 LEU B 24 -3.192 15.250 -0.521 1.00 0.00 C ATOM 383 CD2 LEU B 24 -3.180 13.014 -1.641 1.00 0.00 C ATOM 0 H LEU B 24 -3.296 13.320 -4.310 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.122 15.216 -4.604 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -2.283 16.153 -2.801 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -3.537 15.050 -3.333 1.00 0.00 H new ATOM 0 HG LEU B 24 -1.437 14.232 -1.278 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.163 14.752 0.448 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.692 16.216 -0.448 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -4.229 15.400 -0.821 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -3.138 12.526 -0.667 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -4.221 13.154 -1.931 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -2.678 12.391 -2.381 1.00 0.00 H new ATOM 395 N LEU B 25 -0.583 12.603 -2.736 1.00 0.00 N ATOM 396 CA LEU B 25 0.501 11.847 -2.054 1.00 0.00 C ATOM 397 C LEU B 25 1.099 10.884 -3.065 1.00 0.00 C ATOM 398 O LEU B 25 1.558 9.804 -2.745 1.00 0.00 O ATOM 399 CB LEU B 25 -0.201 11.088 -0.928 1.00 0.00 C ATOM 400 CG LEU B 25 -0.254 11.961 0.326 1.00 0.00 C ATOM 401 CD1 LEU B 25 -1.450 11.548 1.186 1.00 0.00 C ATOM 402 CD2 LEU B 25 1.035 11.777 1.129 1.00 0.00 C ATOM 0 H LEU B 25 -1.479 12.118 -2.783 1.00 0.00 H new ATOM 0 HA LEU B 25 1.302 12.474 -1.663 1.00 0.00 H new ATOM 0 HB2 LEU B 25 -1.210 10.814 -1.235 1.00 0.00 H new ATOM 0 HB3 LEU B 25 0.330 10.160 -0.715 1.00 0.00 H new ATOM 0 HG LEU B 25 -0.358 13.007 0.036 1.00 0.00 H new ATOM 0 HD11 LEU B 25 -1.488 12.171 2.080 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -2.370 11.676 0.616 1.00 0.00 H new ATOM 0 HD13 LEU B 25 -1.346 10.502 1.476 1.00 0.00 H new ATOM 0 HD21 LEU B 25 0.998 12.399 2.023 1.00 0.00 H new ATOM 0 HD22 LEU B 25 1.137 10.731 1.418 1.00 0.00 H new ATOM 0 HD23 LEU B 25 1.889 12.070 0.518 1.00 0.00 H new ATOM 414 N VAL B 26 1.064 11.287 -4.291 1.00 0.00 N ATOM 415 CA VAL B 26 1.576 10.450 -5.396 1.00 0.00 C ATOM 416 C VAL B 26 2.501 11.305 -6.274 1.00 0.00 C ATOM 417 O VAL B 26 2.456 12.519 -6.226 1.00 0.00 O ATOM 418 CB VAL B 26 0.286 10.016 -6.118 1.00 0.00 C ATOM 419 CG1 VAL B 26 0.439 10.139 -7.635 1.00 0.00 C ATOM 420 CG2 VAL B 26 -0.027 8.563 -5.750 1.00 0.00 C ATOM 0 H VAL B 26 0.690 12.190 -4.584 1.00 0.00 H new ATOM 0 HA VAL B 26 2.172 9.588 -5.096 1.00 0.00 H new ATOM 0 HB VAL B 26 -0.529 10.668 -5.804 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -0.486 9.826 -8.120 1.00 0.00 H new ATOM 0 HG12 VAL B 26 0.654 11.175 -7.896 1.00 0.00 H new ATOM 0 HG13 VAL B 26 1.258 9.503 -7.971 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -0.939 8.248 -6.257 1.00 0.00 H new ATOM 0 HG22 VAL B 26 0.800 7.923 -6.059 1.00 0.00 H new ATOM 0 HG23 VAL B 26 -0.165 8.482 -4.672 1.00 0.00 H new ATOM 430 N GLY B 27 3.346 10.689 -7.058 1.00 0.00 N ATOM 431 CA GLY B 27 4.278 11.475 -7.920 1.00 0.00 C ATOM 432 C GLY B 27 3.490 12.204 -9.012 1.00 0.00 C ATOM 433 O GLY B 27 3.647 11.925 -10.184 1.00 0.00 O ATOM 0 H GLY B 27 3.431 9.676 -7.139 1.00 0.00 H new ATOM 0 HA2 GLY B 27 4.827 12.195 -7.314 1.00 0.00 H new ATOM 0 HA3 GLY B 27 5.015 10.812 -8.373 1.00 0.00 H new ATOM 437 N VAL B 28 2.646 13.134 -8.629 1.00 0.00 N ATOM 438 CA VAL B 28 1.826 13.902 -9.623 1.00 0.00 C ATOM 439 C VAL B 28 1.446 13.020 -10.814 1.00 0.00 C ATOM 440 O VAL B 28 1.470 13.438 -11.954 1.00 0.00 O ATOM 441 CB VAL B 28 2.713 15.071 -10.066 1.00 0.00 C ATOM 442 CG1 VAL B 28 3.939 14.545 -10.821 1.00 0.00 C ATOM 443 CG2 VAL B 28 1.911 15.997 -10.981 1.00 0.00 C ATOM 0 H VAL B 28 2.488 13.397 -7.656 1.00 0.00 H new ATOM 0 HA VAL B 28 0.888 14.250 -9.190 1.00 0.00 H new ATOM 0 HB VAL B 28 3.046 15.620 -9.185 1.00 0.00 H new ATOM 0 HG11 VAL B 28 4.563 15.383 -11.131 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.514 13.887 -10.169 1.00 0.00 H new ATOM 0 HG13 VAL B 28 3.614 13.990 -11.701 1.00 0.00 H new ATOM 0 HG21 VAL B 28 2.540 16.829 -11.298 1.00 0.00 H new ATOM 0 HG22 VAL B 28 1.576 15.442 -11.857 1.00 0.00 H new ATOM 0 HG23 VAL B 28 1.045 16.381 -10.442 1.00 0.00 H new ATOM 453 N SER B 29 1.106 11.799 -10.542 1.00 0.00 N ATOM 454 CA SER B 29 0.732 10.858 -11.632 1.00 0.00 C ATOM 455 C SER B 29 -0.435 9.981 -11.189 1.00 0.00 C ATOM 456 O SER B 29 -1.186 10.328 -10.299 1.00 0.00 O ATOM 457 CB SER B 29 1.982 10.009 -11.863 1.00 0.00 C ATOM 458 OG SER B 29 1.827 9.261 -13.062 1.00 0.00 O ATOM 0 H SER B 29 1.070 11.405 -9.602 1.00 0.00 H new ATOM 0 HA SER B 29 0.416 11.375 -12.538 1.00 0.00 H new ATOM 0 HB2 SER B 29 2.862 10.648 -11.931 1.00 0.00 H new ATOM 0 HB3 SER B 29 2.140 9.337 -11.019 1.00 0.00 H new ATOM 0 HG SER B 29 2.628 8.717 -13.214 1.00 0.00 H new ATOM 464 N ALA B 30 -0.589 8.847 -11.810 1.00 0.00 N ATOM 465 CA ALA B 30 -1.706 7.927 -11.441 1.00 0.00 C ATOM 466 C ALA B 30 -3.050 8.611 -11.703 1.00 0.00 C ATOM 467 O ALA B 30 -3.906 8.674 -10.842 1.00 0.00 O ATOM 468 CB ALA B 30 -1.522 7.636 -9.945 1.00 0.00 C ATOM 0 H ALA B 30 0.013 8.513 -12.563 1.00 0.00 H new ATOM 0 HA ALA B 30 -1.695 7.008 -12.027 1.00 0.00 H new ATOM 0 HB1 ALA B 30 -2.310 6.964 -9.605 1.00 0.00 H new ATOM 0 HB2 ALA B 30 -0.551 7.168 -9.782 1.00 0.00 H new ATOM 0 HB3 ALA B 30 -1.574 8.569 -9.384 1.00 0.00 H new ATOM 474 N LYS B 31 -3.236 9.123 -12.890 1.00 0.00 N ATOM 475 CA LYS B 31 -4.519 9.806 -13.222 1.00 0.00 C ATOM 476 C LYS B 31 -5.170 9.139 -14.440 1.00 0.00 C ATOM 477 O LYS B 31 -4.541 8.991 -15.469 1.00 0.00 O ATOM 478 CB LYS B 31 -4.128 11.250 -13.552 1.00 0.00 C ATOM 479 CG LYS B 31 -3.437 11.884 -12.342 1.00 0.00 C ATOM 480 CD LYS B 31 -3.473 13.409 -12.475 1.00 0.00 C ATOM 481 CE LYS B 31 -2.637 13.837 -13.684 1.00 0.00 C ATOM 482 NZ LYS B 31 -1.269 14.069 -13.143 1.00 0.00 N ATOM 0 H LYS B 31 -2.552 9.097 -13.646 1.00 0.00 H new ATOM 0 HA LYS B 31 -5.238 9.754 -12.404 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -3.462 11.269 -14.415 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -5.014 11.825 -13.820 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -3.935 11.577 -11.423 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -2.405 11.538 -12.276 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -4.502 13.750 -12.592 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -3.084 13.873 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -2.632 13.065 -14.453 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -3.039 14.741 -14.142 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -0.637 14.366 -13.913 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -1.304 14.813 -12.418 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -0.909 13.190 -12.720 1.00 0.00 H new ATOM 496 N PRO B 32 -6.414 8.755 -14.289 1.00 0.00 N ATOM 497 CA PRO B 32 -7.142 8.101 -15.404 1.00 0.00 C ATOM 498 C PRO B 32 -7.491 9.127 -16.485 1.00 0.00 C ATOM 499 O PRO B 32 -7.420 10.320 -16.267 1.00 0.00 O ATOM 500 CB PRO B 32 -8.405 7.558 -14.739 1.00 0.00 C ATOM 501 CG PRO B 32 -8.611 8.420 -13.534 1.00 0.00 C ATOM 502 CD PRO B 32 -7.251 8.890 -13.088 1.00 0.00 C ATOM 0 HA PRO B 32 -6.561 7.323 -15.899 1.00 0.00 H new ATOM 0 HB2 PRO B 32 -9.260 7.612 -15.413 1.00 0.00 H new ATOM 0 HB3 PRO B 32 -8.285 6.511 -14.459 1.00 0.00 H new ATOM 0 HG2 PRO B 32 -9.253 9.268 -13.772 1.00 0.00 H new ATOM 0 HG3 PRO B 32 -9.105 7.860 -12.740 1.00 0.00 H new ATOM 0 HD2 PRO B 32 -7.281 9.921 -12.737 1.00 0.00 H new ATOM 0 HD3 PRO B 32 -6.870 8.284 -12.266 1.00 0.00 H new ATOM 510 N VAL B 33 -7.869 8.669 -17.650 1.00 0.00 N ATOM 511 CA VAL B 33 -8.225 9.619 -18.746 1.00 0.00 C ATOM 512 C VAL B 33 -9.508 9.162 -19.446 1.00 0.00 C ATOM 513 O VAL B 33 -9.757 7.982 -19.597 1.00 0.00 O ATOM 514 CB VAL B 33 -7.039 9.577 -19.713 1.00 0.00 C ATOM 515 CG1 VAL B 33 -5.778 10.059 -18.995 1.00 0.00 C ATOM 516 CG2 VAL B 33 -6.825 8.143 -20.207 1.00 0.00 C ATOM 0 H VAL B 33 -7.947 7.681 -17.890 1.00 0.00 H new ATOM 0 HA VAL B 33 -8.409 10.627 -18.374 1.00 0.00 H new ATOM 0 HB VAL B 33 -7.246 10.226 -20.564 1.00 0.00 H new ATOM 0 HG11 VAL B 33 -4.933 10.029 -19.683 1.00 0.00 H new ATOM 0 HG12 VAL B 33 -5.926 11.081 -18.646 1.00 0.00 H new ATOM 0 HG13 VAL B 33 -5.574 9.411 -18.143 1.00 0.00 H new ATOM 0 HG21 VAL B 33 -5.980 8.117 -20.895 1.00 0.00 H new ATOM 0 HG22 VAL B 33 -6.621 7.492 -19.357 1.00 0.00 H new ATOM 0 HG23 VAL B 33 -7.722 7.798 -20.721 1.00 0.00 H new ATOM 526 N ASN B 34 -10.321 10.089 -19.877 1.00 0.00 N ATOM 527 CA ASN B 34 -11.588 9.711 -20.569 1.00 0.00 C ATOM 528 C ASN B 34 -11.995 10.807 -21.557 1.00 0.00 C ATOM 529 O ASN B 34 -11.950 11.982 -21.248 1.00 0.00 O ATOM 530 CB ASN B 34 -12.626 9.577 -19.455 1.00 0.00 C ATOM 531 CG ASN B 34 -13.490 8.339 -19.709 1.00 0.00 C ATOM 532 OD1 ASN B 34 -13.522 7.430 -18.903 1.00 0.00 O ATOM 533 ND2 ASN B 34 -14.198 8.266 -20.803 1.00 0.00 N ATOM 0 H ASN B 34 -10.163 11.092 -19.780 1.00 0.00 H new ATOM 0 HA ASN B 34 -11.488 8.789 -21.141 1.00 0.00 H new ATOM 0 HB2 ASN B 34 -12.129 9.495 -18.488 1.00 0.00 H new ATOM 0 HB3 ASN B 34 -13.252 10.469 -19.417 1.00 0.00 H new ATOM 0 HD21 ASN B 34 -14.778 7.446 -20.981 1.00 0.00 H new ATOM 0 HD22 ASN B 34 -14.171 9.029 -21.480 1.00 0.00 H new ATOM 540 N ARG B 35 -12.394 10.430 -22.744 1.00 0.00 N ATOM 541 CA ARG B 35 -12.806 11.445 -23.759 1.00 0.00 C ATOM 542 C ARG B 35 -13.308 10.749 -25.033 1.00 0.00 C ATOM 543 O ARG B 35 -14.434 10.955 -25.440 1.00 0.00 O ATOM 544 CB ARG B 35 -11.546 12.268 -24.051 1.00 0.00 C ATOM 545 CG ARG B 35 -11.693 13.670 -23.450 1.00 0.00 C ATOM 546 CD ARG B 35 -10.366 14.103 -22.818 1.00 0.00 C ATOM 547 NE ARG B 35 -10.651 14.213 -21.358 1.00 0.00 N ATOM 548 CZ ARG B 35 -11.370 15.202 -20.888 1.00 0.00 C ATOM 549 NH1 ARG B 35 -11.855 16.117 -21.689 1.00 0.00 N ATOM 550 NH2 ARG B 35 -11.606 15.278 -19.606 1.00 0.00 N ATOM 0 H ARG B 35 -12.452 9.460 -23.055 1.00 0.00 H new ATOM 0 HA ARG B 35 -13.620 12.074 -23.400 1.00 0.00 H new ATOM 0 HB2 ARG B 35 -10.671 11.772 -23.631 1.00 0.00 H new ATOM 0 HB3 ARG B 35 -11.387 12.338 -25.127 1.00 0.00 H new ATOM 0 HG2 ARG B 35 -11.987 14.379 -24.224 1.00 0.00 H new ATOM 0 HG3 ARG B 35 -12.483 13.673 -22.699 1.00 0.00 H new ATOM 0 HD2 ARG B 35 -9.580 13.374 -23.013 1.00 0.00 H new ATOM 0 HD3 ARG B 35 -10.026 15.055 -23.227 1.00 0.00 H new ATOM 0 HE ARG B 35 -10.282 13.510 -20.718 1.00 0.00 H new ATOM 0 HH11 ARG B 35 -11.674 16.065 -22.692 1.00 0.00 H new ATOM 0 HH12 ARG B 35 -12.413 16.882 -21.311 1.00 0.00 H new ATOM 0 HH21 ARG B 35 -11.231 14.569 -18.976 1.00 0.00 H new ATOM 0 HH22 ARG B 35 -12.165 16.046 -19.235 1.00 0.00 H new ATOM 564 N PRO B 36 -12.459 9.941 -25.629 1.00 0.00 N ATOM 565 CA PRO B 36 -12.850 9.221 -26.867 1.00 0.00 C ATOM 566 C PRO B 36 -13.855 8.112 -26.544 1.00 0.00 C ATOM 567 O PRO B 36 -14.024 7.234 -27.374 1.00 0.00 O ATOM 568 CB PRO B 36 -11.535 8.634 -27.373 1.00 0.00 C ATOM 569 CG PRO B 36 -10.670 8.519 -26.160 1.00 0.00 C ATOM 570 CD PRO B 36 -11.080 9.623 -25.222 1.00 0.00 C ATOM 571 OXT PRO B 36 -14.439 8.162 -25.475 1.00 0.00 O ATOM 0 HA PRO B 36 -13.333 9.864 -27.603 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -11.691 7.662 -27.840 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -11.078 9.279 -28.124 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -10.796 7.545 -25.688 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -9.617 8.611 -26.427 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -11.035 9.300 -24.182 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -10.426 10.490 -25.316 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 14.035 -17.624 1.235 1.00 1.31 P ATOM 581 OP1 G A 1 12.935 -18.430 0.647 1.00 1.51 O ATOM 582 OP2 G A 1 14.897 -18.217 2.288 1.00 1.52 O ATOM 583 O5' G A 1 13.407 -16.273 1.804 1.00 1.09 O ATOM 584 C5' G A 1 12.046 -15.909 1.511 1.00 1.03 C ATOM 585 C4' G A 1 11.095 -16.728 2.348 1.00 0.94 C ATOM 586 O4' G A 1 11.475 -16.598 3.738 1.00 1.02 O ATOM 587 C3' G A 1 9.658 -16.241 2.336 1.00 0.80 C ATOM 588 O3' G A 1 8.972 -16.712 1.170 1.00 0.75 O ATOM 589 C2' G A 1 9.102 -16.817 3.639 1.00 0.78 C ATOM 590 O2' G A 1 8.640 -18.149 3.537 1.00 0.77 O ATOM 591 C1' G A 1 10.330 -16.776 4.549 1.00 0.90 C ATOM 592 N9 G A 1 10.242 -15.665 5.485 1.00 0.90 N ATOM 593 C8 G A 1 10.833 -14.431 5.380 1.00 0.97 C ATOM 594 N7 G A 1 10.528 -13.633 6.367 1.00 0.99 N ATOM 595 C5 G A 1 9.687 -14.392 7.171 1.00 0.90 C ATOM 596 C6 G A 1 9.034 -14.064 8.381 1.00 0.88 C ATOM 597 O6 G A 1 9.072 -13.002 9.006 1.00 0.94 O ATOM 598 N1 G A 1 8.274 -15.127 8.864 1.00 0.82 N ATOM 599 C2 G A 1 8.162 -16.351 8.248 1.00 0.81 C ATOM 600 N2 G A 1 7.384 -17.258 8.860 1.00 0.83 N ATOM 601 N3 G A 1 8.766 -16.667 7.118 1.00 0.83 N ATOM 602 C4 G A 1 9.506 -15.647 6.639 1.00 0.86 C ATOM 0 H5' G A 1 11.839 -16.068 0.453 1.00 1.03 H new ATOM 0 H5'' G A 1 11.895 -14.848 1.710 1.00 1.03 H new ATOM 0 H4' G A 1 11.152 -17.733 1.929 1.00 0.94 H new ATOM 0 H3' G A 1 9.548 -15.158 2.287 1.00 0.80 H new ATOM 0 H2' G A 1 8.231 -16.258 3.980 1.00 0.78 H new ATOM 0 HO2' G A 1 9.322 -18.699 3.098 1.00 0.77 H new ATOM 0 H1' G A 1 10.388 -17.706 5.115 1.00 0.90 H new ATOM 0 H8 G A 1 11.483 -14.149 4.565 1.00 0.97 H new ATOM 0 H1 G A 1 7.765 -14.987 9.737 1.00 0.82 H new ATOM 0 H21 G A 1 7.262 -18.184 8.451 1.00 0.83 H new ATOM 0 H22 G A 1 6.915 -17.021 9.734 1.00 0.83 H new ATOM 614 P C A 2 8.465 -18.237 1.081 1.00 0.69 P ATOM 615 OP1 C A 2 9.433 -19.105 1.800 1.00 0.84 O ATOM 616 OP2 C A 2 8.154 -18.513 -0.344 1.00 0.82 O ATOM 617 O5' C A 2 7.088 -18.217 1.881 1.00 0.58 O ATOM 618 C5' C A 2 6.360 -16.986 2.051 1.00 0.57 C ATOM 619 C4' C A 2 5.225 -17.173 3.030 1.00 0.55 C ATOM 620 O4' C A 2 5.724 -16.933 4.369 1.00 0.54 O ATOM 621 C3' C A 2 4.093 -16.175 2.861 1.00 0.51 C ATOM 622 O3' C A 2 3.138 -16.660 1.921 1.00 0.59 O ATOM 623 C2' C A 2 3.491 -16.097 4.260 1.00 0.53 C ATOM 624 O2' C A 2 2.516 -17.096 4.493 1.00 0.67 O ATOM 625 C1' C A 2 4.710 -16.334 5.156 1.00 0.51 C ATOM 626 N1 C A 2 5.253 -15.096 5.732 1.00 0.45 N ATOM 627 C2 C A 2 4.774 -14.675 6.972 1.00 0.44 C ATOM 628 O2 C A 2 3.909 -15.358 7.539 1.00 0.49 O ATOM 629 N3 C A 2 5.262 -13.540 7.521 1.00 0.43 N ATOM 630 C4 C A 2 6.194 -12.836 6.874 1.00 0.45 C ATOM 631 N4 C A 2 6.649 -11.724 7.455 1.00 0.49 N ATOM 632 C5 C A 2 6.701 -13.242 5.605 1.00 0.47 C ATOM 633 C6 C A 2 6.206 -14.370 5.075 1.00 0.46 C ATOM 0 H5' C A 2 5.968 -16.653 1.090 1.00 0.57 H new ATOM 0 H5'' C A 2 7.032 -16.206 2.409 1.00 0.57 H new ATOM 0 H4' C A 2 4.852 -18.182 2.854 1.00 0.55 H new ATOM 0 H3' C A 2 4.420 -15.206 2.483 1.00 0.51 H new ATOM 0 H2' C A 2 2.972 -15.154 4.433 1.00 0.53 H new ATOM 0 HO2' C A 2 2.187 -17.439 3.636 1.00 0.67 H new ATOM 0 H1' C A 2 4.390 -16.968 5.983 1.00 0.51 H new ATOM 0 H41 C A 2 7.361 -11.161 6.990 1.00 0.49 H new ATOM 0 H42 C A 2 6.285 -11.438 8.364 1.00 0.49 H new ATOM 0 H5 C A 2 7.454 -12.664 5.091 1.00 0.47 H new ATOM 0 H6 C A 2 6.566 -14.710 4.115 1.00 0.46 H new ATOM 645 P C A 3 2.071 -15.648 1.273 1.00 0.67 P ATOM 646 OP1 C A 3 0.759 -16.341 1.194 1.00 1.20 O ATOM 647 OP2 C A 3 2.681 -15.088 0.042 1.00 1.00 O ATOM 648 O5' C A 3 1.954 -14.476 2.345 1.00 0.89 O ATOM 649 C5' C A 3 0.792 -13.626 2.388 1.00 0.68 C ATOM 650 C4' C A 3 0.231 -13.583 3.786 1.00 0.61 C ATOM 651 O4' C A 3 1.335 -13.697 4.716 1.00 0.67 O ATOM 652 C3' C A 3 -0.428 -12.262 4.129 1.00 0.56 C ATOM 653 O3' C A 3 -1.804 -12.269 3.727 1.00 0.57 O ATOM 654 C2' C A 3 -0.230 -12.151 5.639 1.00 0.57 C ATOM 655 O2' C A 3 -1.229 -12.793 6.406 1.00 0.64 O ATOM 656 C1' C A 3 1.102 -12.875 5.846 1.00 0.62 C ATOM 657 N1 C A 3 2.234 -11.941 5.948 1.00 0.61 N ATOM 658 C2 C A 3 2.349 -11.135 7.083 1.00 0.56 C ATOM 659 O2 C A 3 1.494 -11.231 7.975 1.00 0.55 O ATOM 660 N3 C A 3 3.389 -10.274 7.180 1.00 0.58 N ATOM 661 C4 C A 3 4.289 -10.202 6.195 1.00 0.65 C ATOM 662 N4 C A 3 5.298 -9.340 6.330 1.00 0.71 N ATOM 663 C5 C A 3 4.194 -11.014 5.029 1.00 0.71 C ATOM 664 C6 C A 3 3.161 -11.862 4.946 1.00 0.68 C ATOM 0 H5' C A 3 0.036 -13.996 1.696 1.00 0.68 H new ATOM 0 H5'' C A 3 1.056 -12.620 2.063 1.00 0.68 H new ATOM 0 H4' C A 3 -0.504 -14.386 3.848 1.00 0.61 H new ATOM 0 H3' C A 3 -0.004 -11.401 3.612 1.00 0.56 H new ATOM 0 H2' C A 3 -0.266 -11.111 5.963 1.00 0.57 H new ATOM 0 HO2' C A 3 -1.387 -13.692 6.050 1.00 0.64 H new ATOM 0 H1' C A 3 1.034 -13.442 6.774 1.00 0.62 H new ATOM 0 H41 C A 3 6.002 -9.260 5.596 1.00 0.71 H new ATOM 0 H42 C A 3 5.365 -8.761 7.167 1.00 0.71 H new ATOM 0 H5 C A 3 4.929 -10.948 4.240 1.00 0.71 H new ATOM 0 H6 C A 3 3.059 -12.493 4.075 1.00 0.68 H new ATOM 676 P C A 4 -2.923 -12.960 4.653 1.00 0.57 P ATOM 677 OP1 C A 4 -2.319 -14.124 5.349 1.00 0.73 O ATOM 678 OP2 C A 4 -4.126 -13.160 3.807 1.00 0.60 O ATOM 679 O5' C A 4 -3.269 -11.827 5.719 1.00 0.61 O ATOM 680 C5' C A 4 -3.377 -10.449 5.309 1.00 0.51 C ATOM 681 C4' C A 4 -3.276 -9.534 6.502 1.00 0.47 C ATOM 682 O4' C A 4 -1.994 -9.744 7.142 1.00 0.55 O ATOM 683 C3' C A 4 -3.265 -8.057 6.156 1.00 0.45 C ATOM 684 O3' C A 4 -4.585 -7.545 6.014 1.00 0.51 O ATOM 685 C2' C A 4 -2.560 -7.441 7.356 1.00 0.47 C ATOM 686 O2' C A 4 -3.433 -7.198 8.442 1.00 0.57 O ATOM 687 C1' C A 4 -1.553 -8.531 7.726 1.00 0.48 C ATOM 688 N1 C A 4 -0.216 -8.234 7.198 1.00 0.43 N ATOM 689 C2 C A 4 0.561 -7.260 7.827 1.00 0.39 C ATOM 690 O2 C A 4 0.102 -6.671 8.817 1.00 0.43 O ATOM 691 N3 C A 4 1.791 -6.984 7.339 1.00 0.38 N ATOM 692 C4 C A 4 2.243 -7.641 6.270 1.00 0.45 C ATOM 693 N4 C A 4 3.455 -7.342 5.820 1.00 0.51 N ATOM 694 C5 C A 4 1.472 -8.637 5.615 1.00 0.51 C ATOM 695 C6 C A 4 0.260 -8.899 6.104 1.00 0.48 C ATOM 0 H5' C A 4 -4.327 -10.288 4.800 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.588 -10.213 4.595 1.00 0.51 H new ATOM 0 H4' C A 4 -4.148 -9.768 7.113 1.00 0.47 H new ATOM 0 H3' C A 4 -2.776 -7.840 5.206 1.00 0.45 H new ATOM 0 H2' C A 4 -2.126 -6.468 7.128 1.00 0.47 H new ATOM 0 HO2' C A 4 -2.929 -6.804 9.185 1.00 0.57 H new ATOM 0 H1' C A 4 -1.490 -8.594 8.812 1.00 0.48 H new ATOM 0 H41 C A 4 3.830 -7.826 5.004 1.00 0.51 H new ATOM 0 H42 C A 4 4.012 -6.628 6.290 1.00 0.51 H new ATOM 0 H5 C A 4 1.853 -9.163 4.752 1.00 0.51 H new ATOM 0 H6 C A 4 -0.355 -9.648 5.628 1.00 0.48 H new ATOM 707 P U A 5 -4.839 -6.260 5.083 1.00 0.57 P ATOM 708 OP1 U A 5 -6.304 -6.098 4.901 1.00 0.77 O ATOM 709 OP2 U A 5 -3.962 -6.391 3.892 1.00 0.62 O ATOM 710 O5' U A 5 -4.306 -5.043 5.962 1.00 0.49 O ATOM 711 C5' U A 5 -4.863 -4.784 7.261 1.00 0.45 C ATOM 712 C4' U A 5 -3.985 -3.830 8.036 1.00 0.41 C ATOM 713 O4' U A 5 -2.691 -4.442 8.260 1.00 0.47 O ATOM 714 C3' U A 5 -3.635 -2.536 7.324 1.00 0.35 C ATOM 715 O3' U A 5 -4.666 -1.564 7.483 1.00 0.36 O ATOM 716 C2' U A 5 -2.373 -2.090 8.049 1.00 0.41 C ATOM 717 O2' U A 5 -2.644 -1.318 9.204 1.00 0.50 O ATOM 718 C1' U A 5 -1.731 -3.420 8.442 1.00 0.43 C ATOM 719 N1 U A 5 -0.539 -3.709 7.634 1.00 0.43 N ATOM 720 C2 U A 5 0.545 -2.890 7.846 1.00 0.40 C ATOM 721 O2 U A 5 0.526 -1.975 8.654 1.00 0.39 O ATOM 722 N3 U A 5 1.646 -3.175 7.084 1.00 0.43 N ATOM 723 C4 U A 5 1.771 -4.169 6.147 1.00 0.50 C ATOM 724 O4 U A 5 2.836 -4.292 5.539 1.00 0.54 O ATOM 725 C5 U A 5 0.604 -4.981 5.980 1.00 0.55 C ATOM 726 C6 U A 5 -0.493 -4.730 6.713 1.00 0.51 C ATOM 0 H5' U A 5 -4.967 -5.719 7.811 1.00 0.45 H new ATOM 0 H5'' U A 5 -5.863 -4.363 7.156 1.00 0.45 H new ATOM 0 H4' U A 5 -4.571 -3.613 8.929 1.00 0.41 H new ATOM 0 H3' U A 5 -3.508 -2.660 6.249 1.00 0.35 H new ATOM 0 H2' U A 5 -1.749 -1.447 7.428 1.00 0.41 H new ATOM 0 HO2' U A 5 -3.546 -0.939 9.140 1.00 0.50 H new ATOM 0 H1' U A 5 -1.411 -3.365 9.483 1.00 0.43 H new ATOM 0 H3 U A 5 2.464 -2.583 7.229 1.00 0.43 H new ATOM 0 H5 U A 5 0.606 -5.792 5.267 1.00 0.55 H new ATOM 0 H6 U A 5 -1.367 -5.349 6.575 1.00 0.51 H new ATOM 737 P G A 6 -4.922 -0.479 6.325 1.00 0.43 P ATOM 738 OP1 G A 6 -6.390 -0.270 6.237 1.00 0.54 O ATOM 739 OP2 G A 6 -4.172 -0.906 5.119 1.00 0.65 O ATOM 740 O5' G A 6 -4.271 0.869 6.882 1.00 0.43 O ATOM 741 C5' G A 6 -2.886 0.922 7.290 1.00 0.47 C ATOM 742 C4' G A 6 -2.070 1.698 6.280 1.00 0.47 C ATOM 743 O4' G A 6 -0.700 1.222 6.313 1.00 0.53 O ATOM 744 C3' G A 6 -2.480 1.472 4.839 1.00 0.39 C ATOM 745 O3' G A 6 -3.554 2.340 4.493 1.00 0.41 O ATOM 746 C2' G A 6 -1.214 1.824 4.066 1.00 0.48 C ATOM 747 O2' G A 6 -1.118 3.203 3.762 1.00 0.59 O ATOM 748 C1' G A 6 -0.106 1.417 5.040 1.00 0.49 C ATOM 749 N9 G A 6 0.550 0.174 4.646 1.00 0.50 N ATOM 750 C8 G A 6 0.036 -1.093 4.746 1.00 0.60 C ATOM 751 N7 G A 6 0.854 -2.016 4.317 1.00 0.63 N ATOM 752 C5 G A 6 1.977 -1.313 3.903 1.00 0.54 C ATOM 753 C6 G A 6 3.195 -1.777 3.338 1.00 0.55 C ATOM 754 O6 G A 6 3.534 -2.939 3.090 1.00 0.61 O ATOM 755 N1 G A 6 4.067 -0.728 3.057 1.00 0.55 N ATOM 756 C2 G A 6 3.796 0.599 3.291 1.00 0.57 C ATOM 757 N2 G A 6 4.761 1.474 2.954 1.00 0.70 N ATOM 758 N3 G A 6 2.664 1.044 3.819 1.00 0.53 N ATOM 759 C4 G A 6 1.807 0.040 4.097 1.00 0.49 C ATOM 0 H5' G A 6 -2.490 -0.089 7.388 1.00 0.47 H new ATOM 0 H5'' G A 6 -2.806 1.392 8.270 1.00 0.47 H new ATOM 0 H4' G A 6 -2.212 2.743 6.555 1.00 0.47 H new ATOM 0 H3' G A 6 -2.834 0.462 4.634 1.00 0.39 H new ATOM 0 H2' G A 6 -1.174 1.326 3.097 1.00 0.48 H new ATOM 0 HO2' G A 6 -1.388 3.353 2.832 1.00 0.59 H new ATOM 0 H1' G A 6 0.648 2.204 5.050 1.00 0.49 H new ATOM 0 H8 G A 6 -0.947 -1.306 5.140 1.00 0.60 H new ATOM 0 H1 G A 6 4.972 -0.961 2.648 1.00 0.55 H new ATOM 0 H21 G A 6 4.619 2.473 3.104 1.00 0.70 H new ATOM 0 H22 G A 6 5.635 1.138 2.549 1.00 0.70 H new ATOM 771 P A A 7 -4.392 2.071 3.149 1.00 0.43 P ATOM 772 OP1 A A 7 -4.958 3.372 2.709 1.00 0.74 O ATOM 773 OP2 A A 7 -5.297 0.919 3.387 1.00 0.66 O ATOM 774 O5' A A 7 -3.283 1.629 2.096 1.00 0.33 O ATOM 775 C5' A A 7 -3.624 1.399 0.719 1.00 0.29 C ATOM 776 C4' A A 7 -2.617 2.064 -0.184 1.00 0.23 C ATOM 777 O4' A A 7 -2.714 3.497 -0.029 1.00 0.23 O ATOM 778 C3' A A 7 -1.165 1.780 0.153 1.00 0.25 C ATOM 779 O3' A A 7 -0.753 0.545 -0.426 1.00 0.27 O ATOM 780 C2' A A 7 -0.439 2.962 -0.484 1.00 0.24 C ATOM 781 O2' A A 7 -0.125 2.753 -1.847 1.00 0.25 O ATOM 782 C1' A A 7 -1.470 4.082 -0.358 1.00 0.21 C ATOM 783 N9 A A 7 -1.122 5.055 0.677 1.00 0.24 N ATOM 784 C8 A A 7 -1.705 5.226 1.908 1.00 0.29 C ATOM 785 N7 A A 7 -1.164 6.185 2.619 1.00 0.33 N ATOM 786 C5 A A 7 -0.158 6.680 1.801 1.00 0.30 C ATOM 787 C6 A A 7 0.785 7.710 1.974 1.00 0.34 C ATOM 788 N6 A A 7 0.870 8.458 3.077 1.00 0.39 N ATOM 789 N1 A A 7 1.647 7.949 0.962 1.00 0.35 N ATOM 790 C2 A A 7 1.560 7.198 -0.144 1.00 0.32 C ATOM 791 N3 A A 7 0.722 6.204 -0.424 1.00 0.27 N ATOM 792 C4 A A 7 -0.121 5.993 0.602 1.00 0.25 C ATOM 0 H5' A A 7 -4.621 1.789 0.514 1.00 0.29 H new ATOM 0 H5'' A A 7 -3.653 0.328 0.518 1.00 0.29 H new ATOM 0 H4' A A 7 -2.853 1.676 -1.175 1.00 0.23 H new ATOM 0 H3' A A 7 -0.969 1.683 1.221 1.00 0.25 H new ATOM 0 H2' A A 7 0.520 3.157 -0.005 1.00 0.24 H new ATOM 0 HO2' A A 7 0.337 3.542 -2.201 1.00 0.25 H new ATOM 0 H1' A A 7 -1.506 4.615 -1.308 1.00 0.21 H new ATOM 0 H8 A A 7 -2.532 4.626 2.258 1.00 0.29 H new ATOM 0 H61 A A 7 1.576 9.191 3.143 1.00 0.39 H new ATOM 0 H62 A A 7 0.229 8.296 3.853 1.00 0.39 H new ATOM 0 H2 A A 7 2.273 7.434 -0.920 1.00 0.32 H new ATOM 804 P A A 8 0.225 -0.429 0.393 1.00 0.37 P ATOM 805 OP1 A A 8 0.048 -1.810 -0.122 1.00 0.44 O ATOM 806 OP2 A A 8 0.022 -0.153 1.838 1.00 0.47 O ATOM 807 O5' A A 8 1.681 0.073 -0.009 1.00 0.38 O ATOM 808 C5' A A 8 1.948 0.580 -1.330 1.00 0.39 C ATOM 809 C4' A A 8 2.958 1.698 -1.262 1.00 0.43 C ATOM 810 O4' A A 8 2.343 2.837 -0.611 1.00 0.37 O ATOM 811 C3' A A 8 4.163 1.387 -0.393 1.00 0.53 C ATOM 812 O3' A A 8 5.186 0.710 -1.131 1.00 0.66 O ATOM 813 C2' A A 8 4.632 2.766 0.057 1.00 0.50 C ATOM 814 O2' A A 8 5.478 3.393 -0.886 1.00 0.58 O ATOM 815 C1' A A 8 3.312 3.536 0.151 1.00 0.38 C ATOM 816 N9 A A 8 2.817 3.635 1.522 1.00 0.36 N ATOM 817 C8 A A 8 1.794 2.923 2.093 1.00 0.42 C ATOM 818 N7 A A 8 1.568 3.236 3.346 1.00 0.47 N ATOM 819 C5 A A 8 2.510 4.218 3.620 1.00 0.41 C ATOM 820 C6 A A 8 2.797 4.957 4.781 1.00 0.44 C ATOM 821 N6 A A 8 2.131 4.820 5.929 1.00 0.54 N ATOM 822 N1 A A 8 3.803 5.855 4.720 1.00 0.40 N ATOM 823 C2 A A 8 4.471 5.993 3.568 1.00 0.36 C ATOM 824 N3 A A 8 4.295 5.357 2.410 1.00 0.35 N ATOM 825 C4 A A 8 3.287 4.472 2.504 1.00 0.35 C ATOM 0 H5' A A 8 1.025 0.941 -1.783 1.00 0.39 H new ATOM 0 H5'' A A 8 2.323 -0.221 -1.966 1.00 0.39 H new ATOM 0 H4' A A 8 3.274 1.867 -2.291 1.00 0.43 H new ATOM 0 H3' A A 8 3.924 0.721 0.436 1.00 0.53 H new ATOM 0 H2' A A 8 5.215 2.723 0.977 1.00 0.50 H new ATOM 0 HO2' A A 8 5.091 3.304 -1.782 1.00 0.58 H new ATOM 0 H1' A A 8 3.487 4.547 -0.218 1.00 0.38 H new ATOM 0 H8 A A 8 1.227 2.174 1.560 1.00 0.42 H new ATOM 0 H61 A A 8 2.387 5.386 6.738 1.00 0.54 H new ATOM 0 H62 A A 8 1.366 4.149 5.998 1.00 0.54 H new ATOM 0 H2 A A 8 5.266 6.724 3.579 1.00 0.36 H new ATOM 837 P A A 9 5.169 0.734 -2.740 1.00 1.47 P ATOM 838 OP1 A A 9 5.211 2.156 -3.163 1.00 2.33 O ATOM 839 OP2 A A 9 4.066 -0.140 -3.213 1.00 2.35 O ATOM 840 O5' A A 9 6.549 0.056 -3.152 1.00 1.08 O ATOM 841 C5' A A 9 7.711 0.193 -2.318 1.00 1.04 C ATOM 842 C4' A A 9 8.433 1.476 -2.640 1.00 1.09 C ATOM 843 O4' A A 9 7.877 2.030 -3.858 1.00 1.26 O ATOM 844 C3' A A 9 8.215 2.579 -1.628 1.00 0.99 C ATOM 845 O3' A A 9 9.092 2.454 -0.519 1.00 1.17 O ATOM 846 C2' A A 9 8.508 3.832 -2.437 1.00 1.26 C ATOM 847 O2' A A 9 9.892 4.114 -2.523 1.00 1.57 O ATOM 848 C1' A A 9 7.967 3.444 -3.816 1.00 1.29 C ATOM 849 N9 A A 9 6.626 3.980 -4.048 1.00 0.00 N ATOM 850 C8 A A 9 5.889 4.771 -3.203 1.00 0.00 C ATOM 851 N7 A A 9 4.714 5.102 -3.680 1.00 0.00 N ATOM 852 C5 A A 9 4.672 4.485 -4.920 1.00 0.00 C ATOM 853 C6 A A 9 3.687 4.443 -5.920 1.00 0.00 C ATOM 854 N6 A A 9 2.511 5.067 -5.828 1.00 0.00 N ATOM 855 N1 A A 9 3.956 3.730 -7.035 1.00 0.00 N ATOM 856 C2 A A 9 5.134 3.103 -7.125 1.00 0.00 C ATOM 857 N3 A A 9 6.140 3.069 -6.255 1.00 0.00 N ATOM 858 C4 A A 9 5.842 3.788 -5.161 1.00 0.00 C ATOM 0 H5' A A 9 8.378 -0.656 -2.468 1.00 1.04 H new ATOM 0 H5'' A A 9 7.417 0.186 -1.268 1.00 1.04 H new ATOM 0 H4' A A 9 9.487 1.204 -2.684 1.00 1.09 H new ATOM 0 H3' A A 9 7.217 2.572 -1.189 1.00 0.99 H new ATOM 0 H2' A A 9 8.067 4.728 -1.999 1.00 1.26 H new ATOM 0 HO2' A A 9 10.373 3.605 -1.838 1.00 1.57 H new ATOM 0 H1' A A 9 8.636 3.847 -4.576 1.00 1.29 H new ATOM 0 H8 A A 9 6.244 5.091 -2.235 1.00 0.00 H new ATOM 0 H61 A A 9 1.836 4.998 -6.590 1.00 0.00 H new ATOM 0 H62 A A 9 2.287 5.613 -4.996 1.00 0.00 H new ATOM 0 H2 A A 9 5.291 2.544 -8.035 1.00 0.00 H new ATOM 870 P A A 10 8.562 2.827 0.951 1.00 1.33 P ATOM 871 OP1 A A 10 7.297 2.068 1.189 1.00 2.10 O ATOM 872 OP2 A A 10 8.564 4.307 1.082 1.00 2.11 O ATOM 873 O5' A A 10 9.674 2.241 1.925 1.00 0.79 O ATOM 874 C5' A A 10 9.366 1.999 3.302 1.00 0.59 C ATOM 875 C4' A A 10 9.441 3.286 4.084 1.00 0.54 C ATOM 876 O4' A A 10 8.170 3.965 3.963 1.00 0.50 O ATOM 877 C3' A A 10 9.643 3.093 5.574 1.00 0.50 C ATOM 878 O3' A A 10 11.035 3.033 5.878 1.00 0.61 O ATOM 879 C2' A A 10 8.971 4.317 6.183 1.00 0.50 C ATOM 880 O2' A A 10 9.839 5.432 6.263 1.00 0.61 O ATOM 881 C1' A A 10 7.843 4.600 5.185 1.00 0.48 C ATOM 882 N9 A A 10 6.564 4.040 5.606 1.00 0.45 N ATOM 883 C8 A A 10 5.830 3.103 4.928 1.00 0.45 C ATOM 884 N7 A A 10 4.713 2.770 5.529 1.00 0.51 N ATOM 885 C5 A A 10 4.717 3.541 6.683 1.00 0.54 C ATOM 886 C6 A A 10 3.808 3.650 7.750 1.00 0.64 C ATOM 887 N6 A A 10 2.672 2.953 7.829 1.00 0.72 N ATOM 888 N1 A A 10 4.111 4.510 8.747 1.00 0.69 N ATOM 889 C2 A A 10 5.251 5.208 8.666 1.00 0.66 C ATOM 890 N3 A A 10 6.184 5.193 7.716 1.00 0.58 N ATOM 891 C4 A A 10 5.852 4.329 6.742 1.00 0.51 C ATOM 0 H5' A A 10 10.064 1.272 3.716 1.00 0.59 H new ATOM 0 H5'' A A 10 8.368 1.569 3.389 1.00 0.59 H new ATOM 0 H4' A A 10 10.292 3.833 3.677 1.00 0.54 H new ATOM 0 H3' A A 10 9.223 2.164 5.961 1.00 0.50 H new ATOM 0 H2' A A 10 8.643 4.143 7.208 1.00 0.50 H new ATOM 0 HO2' A A 10 10.769 5.124 6.243 1.00 0.61 H new ATOM 0 H1' A A 10 7.747 5.683 5.103 1.00 0.48 H new ATOM 0 H8 A A 10 6.142 2.678 3.986 1.00 0.45 H new ATOM 0 H61 A A 10 2.053 3.076 8.630 1.00 0.72 H new ATOM 0 H62 A A 10 2.424 2.297 7.088 1.00 0.72 H new ATOM 0 H2 A A 10 5.441 5.880 9.490 1.00 0.66 H new ATOM 903 P A A 11 11.542 2.183 7.144 1.00 0.62 P ATOM 904 OP1 A A 11 12.699 2.906 7.731 1.00 0.65 O ATOM 905 OP2 A A 11 11.698 0.768 6.724 1.00 0.77 O ATOM 906 O5' A A 11 10.332 2.267 8.176 1.00 0.58 O ATOM 907 C5' A A 11 10.282 3.299 9.179 1.00 0.56 C ATOM 908 C4' A A 11 8.933 3.292 9.857 1.00 0.49 C ATOM 909 O4' A A 11 7.920 3.099 8.841 1.00 0.46 O ATOM 910 C3' A A 11 8.729 2.145 10.831 1.00 0.47 C ATOM 911 O3' A A 11 9.196 2.528 12.129 1.00 0.51 O ATOM 912 C2' A A 11 7.218 1.930 10.794 1.00 0.43 C ATOM 913 O2' A A 11 6.520 2.778 11.685 1.00 0.47 O ATOM 914 C1' A A 11 6.864 2.312 9.356 1.00 0.42 C ATOM 915 N9 A A 11 6.713 1.162 8.465 1.00 0.41 N ATOM 916 C8 A A 11 7.643 0.656 7.590 1.00 0.46 C ATOM 917 N7 A A 11 7.214 -0.370 6.897 1.00 0.47 N ATOM 918 C5 A A 11 5.915 -0.557 7.346 1.00 0.42 C ATOM 919 C6 A A 11 4.916 -1.487 7.004 1.00 0.43 C ATOM 920 N6 A A 11 5.069 -2.452 6.088 1.00 0.49 N ATOM 921 N1 A A 11 3.732 -1.394 7.644 1.00 0.40 N ATOM 922 C2 A A 11 3.567 -0.434 8.562 1.00 0.37 C ATOM 923 N3 A A 11 4.425 0.496 8.969 1.00 0.37 N ATOM 924 C4 A A 11 5.594 0.379 8.316 1.00 0.39 C ATOM 0 H5' A A 11 10.464 4.272 8.722 1.00 0.56 H new ATOM 0 H5'' A A 11 11.070 3.141 9.916 1.00 0.56 H new ATOM 0 H4' A A 11 8.870 4.235 10.400 1.00 0.49 H new ATOM 0 H3' A A 11 9.275 1.235 10.582 1.00 0.47 H new ATOM 0 H2' A A 11 6.947 0.916 11.087 1.00 0.43 H new ATOM 0 HO2' A A 11 6.517 2.380 12.581 1.00 0.47 H new ATOM 0 H1' A A 11 5.909 2.836 9.392 1.00 0.42 H new ATOM 0 H8 A A 11 8.636 1.066 7.483 1.00 0.46 H new ATOM 0 H61 A A 11 4.301 -3.093 5.890 1.00 0.49 H new ATOM 0 H62 A A 11 5.954 -2.546 5.589 1.00 0.49 H new ATOM 0 H2 A A 11 2.599 -0.412 9.040 1.00 0.37 H new ATOM 936 P G A 12 8.616 1.813 13.452 1.00 0.56 P ATOM 937 OP1 G A 12 7.164 1.601 13.259 1.00 0.68 O ATOM 938 OP2 G A 12 9.084 2.598 14.622 1.00 0.65 O ATOM 939 O5' G A 12 9.362 0.401 13.507 1.00 0.50 O ATOM 940 C5' G A 12 8.824 -0.780 12.865 1.00 0.47 C ATOM 941 C4' G A 12 7.317 -0.802 12.959 1.00 0.42 C ATOM 942 O4' G A 12 6.793 -0.597 11.626 1.00 0.40 O ATOM 943 C3' G A 12 6.716 -2.125 13.398 1.00 0.39 C ATOM 944 O3' G A 12 6.626 -2.189 14.818 1.00 0.43 O ATOM 945 C2' G A 12 5.330 -2.093 12.761 1.00 0.35 C ATOM 946 O2' G A 12 4.379 -1.413 13.556 1.00 0.37 O ATOM 947 C1' G A 12 5.585 -1.312 11.469 1.00 0.35 C ATOM 948 N9 G A 12 5.742 -2.195 10.319 1.00 0.33 N ATOM 949 C8 G A 12 6.834 -2.287 9.491 1.00 0.36 C ATOM 950 N7 G A 12 6.687 -3.176 8.548 1.00 0.36 N ATOM 951 C5 G A 12 5.422 -3.704 8.768 1.00 0.33 C ATOM 952 C6 G A 12 4.712 -4.704 8.064 1.00 0.36 C ATOM 953 O6 G A 12 5.073 -5.349 7.075 1.00 0.40 O ATOM 954 N1 G A 12 3.456 -4.934 8.620 1.00 0.36 N ATOM 955 C2 G A 12 2.955 -4.280 9.719 1.00 0.34 C ATOM 956 N2 G A 12 1.724 -4.642 10.109 1.00 0.37 N ATOM 957 N3 G A 12 3.608 -3.342 10.385 1.00 0.31 N ATOM 958 C4 G A 12 4.825 -3.106 9.858 1.00 0.31 C ATOM 0 H5' G A 12 9.235 -1.674 13.334 1.00 0.47 H new ATOM 0 H5'' G A 12 9.128 -0.801 11.818 1.00 0.47 H new ATOM 0 H4' G A 12 7.062 -0.042 13.697 1.00 0.42 H new ATOM 0 H3' G A 12 7.305 -2.993 13.101 1.00 0.39 H new ATOM 0 H2' G A 12 4.916 -3.092 12.621 1.00 0.35 H new ATOM 0 HO2' G A 12 4.728 -1.309 14.466 1.00 0.37 H new ATOM 0 H1' G A 12 4.731 -0.659 11.291 1.00 0.35 H new ATOM 0 H8 G A 12 7.723 -1.685 9.609 1.00 0.36 H new ATOM 0 H1 G A 12 2.865 -5.639 8.179 1.00 0.36 H new ATOM 0 H21 G A 12 1.293 -4.195 10.918 1.00 0.37 H new ATOM 0 H22 G A 12 1.218 -5.364 9.596 1.00 0.37 H new ATOM 970 P G A 13 7.372 -3.372 15.609 1.00 0.51 P ATOM 971 OP1 G A 13 7.752 -2.844 16.945 1.00 0.59 O ATOM 972 OP2 G A 13 8.417 -3.941 14.721 1.00 0.57 O ATOM 973 O5' G A 13 6.237 -4.471 15.817 1.00 0.57 O ATOM 974 C5' G A 13 4.968 -4.122 16.397 1.00 0.62 C ATOM 975 C4' G A 13 3.915 -5.114 15.982 1.00 0.60 C ATOM 976 O4' G A 13 3.591 -4.883 14.589 1.00 0.59 O ATOM 977 C3' G A 13 4.376 -6.556 16.020 1.00 0.59 C ATOM 978 O3' G A 13 4.180 -7.103 17.322 1.00 0.66 O ATOM 979 C2' G A 13 3.463 -7.225 14.999 1.00 0.57 C ATOM 980 O2' G A 13 2.233 -7.653 15.553 1.00 0.63 O ATOM 981 C1' G A 13 3.219 -6.105 13.985 1.00 0.54 C ATOM 982 N9 G A 13 4.003 -6.270 12.766 1.00 0.50 N ATOM 983 C8 G A 13 5.154 -5.603 12.419 1.00 0.54 C ATOM 984 N7 G A 13 5.627 -5.970 11.260 1.00 0.56 N ATOM 985 C5 G A 13 4.736 -6.937 10.815 1.00 0.50 C ATOM 986 C6 G A 13 4.727 -7.700 9.619 1.00 0.53 C ATOM 987 O6 G A 13 5.533 -7.671 8.681 1.00 0.60 O ATOM 988 N1 G A 13 3.638 -8.568 9.568 1.00 0.51 N ATOM 989 C2 G A 13 2.684 -8.684 10.550 1.00 0.48 C ATOM 990 N2 G A 13 1.710 -9.578 10.325 1.00 0.52 N ATOM 991 N3 G A 13 2.682 -7.980 11.669 1.00 0.47 N ATOM 992 C4 G A 13 3.729 -7.134 11.734 1.00 0.47 C ATOM 0 H5' G A 13 4.679 -3.120 16.080 1.00 0.62 H new ATOM 0 H5'' G A 13 5.050 -4.101 17.484 1.00 0.62 H new ATOM 0 H4' G A 13 3.090 -4.973 16.680 1.00 0.60 H new ATOM 0 H3' G A 13 5.435 -6.688 15.798 1.00 0.59 H new ATOM 0 H2' G A 13 3.910 -8.128 14.584 1.00 0.57 H new ATOM 0 HO2' G A 13 2.321 -8.575 15.872 1.00 0.63 H new ATOM 0 H1' G A 13 2.166 -6.127 13.706 1.00 0.54 H new ATOM 0 H8 G A 13 5.619 -4.853 13.042 1.00 0.54 H new ATOM 0 H1 G A 13 3.542 -9.160 8.743 1.00 0.51 H new ATOM 0 H21 G A 13 0.971 -9.712 11.015 1.00 0.52 H new ATOM 0 H22 G A 13 1.708 -10.124 9.463 1.00 0.52 H new ATOM 1004 P G A 14 4.424 -8.671 17.573 1.00 0.74 P ATOM 1005 OP1 G A 14 4.358 -8.925 19.036 1.00 0.90 O ATOM 1006 OP2 G A 14 5.642 -9.058 16.816 1.00 0.80 O ATOM 1007 O5' G A 14 3.169 -9.370 16.885 1.00 0.68 O ATOM 1008 C5' G A 14 2.250 -10.169 17.654 1.00 0.70 C ATOM 1009 C4' G A 14 1.829 -11.382 16.858 1.00 0.68 C ATOM 1010 O4' G A 14 1.574 -10.968 15.493 1.00 0.67 O ATOM 1011 C3' G A 14 2.900 -12.448 16.724 1.00 0.67 C ATOM 1012 O3' G A 14 2.871 -13.332 17.838 1.00 0.77 O ATOM 1013 C2' G A 14 2.507 -13.159 15.436 1.00 0.67 C ATOM 1014 O2' G A 14 1.527 -14.159 15.638 1.00 0.80 O ATOM 1015 C1' G A 14 1.916 -12.018 14.606 1.00 0.61 C ATOM 1016 N9 G A 14 2.881 -11.492 13.646 1.00 0.50 N ATOM 1017 C8 G A 14 3.635 -10.352 13.776 1.00 0.50 C ATOM 1018 N7 G A 14 4.430 -10.147 12.761 1.00 0.47 N ATOM 1019 C5 G A 14 4.183 -11.216 11.911 1.00 0.41 C ATOM 1020 C6 G A 14 4.751 -11.535 10.651 1.00 0.40 C ATOM 1021 O6 G A 14 5.611 -10.913 10.019 1.00 0.45 O ATOM 1022 N1 G A 14 4.216 -12.712 10.128 1.00 0.41 N ATOM 1023 C2 G A 14 3.257 -13.479 10.748 1.00 0.46 C ATOM 1024 N2 G A 14 2.864 -14.578 10.090 1.00 0.55 N ATOM 1025 N3 G A 14 2.722 -13.190 11.923 1.00 0.49 N ATOM 1026 C4 G A 14 3.228 -12.054 12.443 1.00 0.44 C ATOM 0 H5' G A 14 1.375 -9.577 17.920 1.00 0.70 H new ATOM 0 H5'' G A 14 2.719 -10.481 18.587 1.00 0.70 H new ATOM 0 H4' G A 14 0.971 -11.791 17.392 1.00 0.68 H new ATOM 0 H3' G A 14 3.915 -12.051 16.698 1.00 0.67 H new ATOM 0 H2' G A 14 3.349 -13.678 14.978 1.00 0.67 H new ATOM 0 HO2' G A 14 1.310 -14.582 14.781 1.00 0.80 H new ATOM 0 H1' G A 14 1.053 -12.399 14.059 1.00 0.61 H new ATOM 0 H8 G A 14 3.576 -9.693 14.630 1.00 0.50 H new ATOM 0 H1 G A 14 4.560 -13.027 9.221 1.00 0.41 H new ATOM 0 H21 G A 14 2.156 -15.189 10.496 1.00 0.55 H new ATOM 0 H22 G A 14 3.273 -14.803 9.183 1.00 0.55 H new ATOM 1038 P C A 15 4.234 -14.014 18.345 1.00 0.87 P ATOM 1039 OP1 C A 15 3.967 -14.604 19.681 1.00 0.91 O ATOM 1040 OP2 C A 15 5.337 -13.032 18.184 1.00 1.02 O ATOM 1041 O5' C A 15 4.466 -15.204 17.313 1.00 0.85 O ATOM 1042 C5' C A 15 3.411 -16.136 17.026 1.00 0.94 C ATOM 1043 C4' C A 15 3.758 -16.965 15.812 1.00 0.97 C ATOM 1044 O4' C A 15 3.682 -16.137 14.628 1.00 0.84 O ATOM 1045 C3' C A 15 5.187 -17.471 15.789 1.00 1.09 C ATOM 1046 O3' C A 15 5.313 -18.681 16.546 1.00 1.31 O ATOM 1047 C2' C A 15 5.424 -17.729 14.305 1.00 1.09 C ATOM 1048 O2' C A 15 5.014 -19.021 13.899 1.00 1.30 O ATOM 1049 C1' C A 15 4.549 -16.664 13.642 1.00 0.89 C ATOM 1050 N1 C A 15 5.350 -15.569 13.078 1.00 0.75 N ATOM 1051 C2 C A 15 6.030 -15.795 11.881 1.00 0.77 C ATOM 1052 O2 C A 15 5.926 -16.900 11.329 1.00 0.89 O ATOM 1053 N3 C A 15 6.782 -14.812 11.354 1.00 0.70 N ATOM 1054 C4 C A 15 6.871 -13.638 11.972 1.00 0.66 C ATOM 1055 N4 C A 15 7.627 -12.706 11.406 1.00 0.71 N ATOM 1056 C5 C A 15 6.187 -13.374 13.194 1.00 0.64 C ATOM 1057 C6 C A 15 5.442 -14.361 13.709 1.00 0.66 C ATOM 0 H5' C A 15 2.479 -15.598 16.853 1.00 0.94 H new ATOM 0 H5'' C A 15 3.249 -16.787 17.885 1.00 0.94 H new ATOM 0 H4' C A 15 3.058 -17.800 15.844 1.00 0.97 H new ATOM 0 H3' C A 15 5.902 -16.776 16.229 1.00 1.09 H new ATOM 0 H2' C A 15 6.481 -17.680 14.042 1.00 1.09 H new ATOM 0 HO2' C A 15 4.922 -19.597 14.686 1.00 1.30 H new ATOM 0 HO3' C A 15 6.242 -18.990 16.516 1.00 1.31 H new ATOM 0 H1' C A 15 3.996 -17.126 12.824 1.00 0.89 H new ATOM 0 H41 C A 15 7.723 -11.791 11.846 1.00 0.71 H new ATOM 0 H42 C A 15 8.112 -12.905 10.531 1.00 0.71 H new ATOM 0 H5 C A 15 6.266 -12.416 13.686 1.00 0.64 H new ATOM 0 H6 C A 15 4.908 -14.200 14.634 1.00 0.66 H new TER 1069 C A 15