USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 460 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 G O2' : rot -14:sc= -1.26 USER MOD Single : A 2 C O2' : rot -9:sc= 0.154 USER MOD Single : A 3 C O2' : rot 51:sc= -6.22! USER MOD Single : A 4 C O2' : rot 53:sc= -6.14! USER MOD Single : A 5 U O2' : rot -1:sc= -2.17! USER MOD Single : A 6 G O2' : rot 170:sc= 1 USER MOD Single : A 7 A O2' : rot -153:sc= -11.2! USER MOD Single : A 8 A O2' : rot 56:sc= -1.82! USER MOD Single : A 9 A O2' : rot -16:sc= 0.144 USER MOD Single : A 10 A O2' : rot -21:sc= 0.137 USER MOD Single : A 11 A O2' : rot -82:sc= -0.779! USER MOD Single : A 12 G O2' : rot -21:sc= 0.145 USER MOD Single : A 13 G O2' : rot -4:sc= 0.114 USER MOD Single : A 14 G O2' : rot 180:sc= -2.14! USER MOD Single : A 15 C O2' : rot -15:sc= 0.182 USER MOD Single : A 15 C O3' : rot 180:sc= 0.187 USER MOD Single : B 4 GLN : amide:sc= -4.63! C(o=-4.6!,f=-8.4!) USER MOD Single : B 5 THR OG1 : rot 180:sc= 0 USER MOD Single : B 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 15 GLN :FLIP amide:sc= -5.25! C(o=-7.6!,f=-5.2!) USER MOD Single : B 17 GLN : amide:sc= -0.0494 K(o=-0.049,f=-1.4) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 22 ASN :FLIP amide:sc= -6.99! C(o=-8.2!,f=-7!) 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 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP B 2 9.430 -11.142 -1.030 1.00 0.76 N ATOM 2 CA ASP B 2 8.872 -11.799 0.191 1.00 0.88 C ATOM 3 C ASP B 2 7.358 -11.954 0.061 1.00 0.68 C ATOM 4 O ASP B 2 6.803 -11.886 -1.019 1.00 0.66 O ATOM 5 CB ASP B 2 9.208 -10.860 1.355 1.00 1.25 C ATOM 6 CG ASP B 2 10.684 -10.457 1.293 1.00 1.88 C ATOM 7 OD1 ASP B 2 11.509 -11.234 1.748 1.00 2.37 O ATOM 8 OD2 ASP B 2 10.965 -9.380 0.795 1.00 2.35 O ATOM 0 HA ASP B 2 9.290 -12.795 0.340 1.00 0.88 H new ATOM 0 HB2 ASP B 2 8.578 -9.972 1.310 1.00 1.25 H new ATOM 0 HB3 ASP B 2 8.997 -11.353 2.304 1.00 1.25 H new ATOM 15 N ALA B 3 6.689 -12.161 1.160 1.00 0.63 N ATOM 16 CA ALA B 3 5.207 -12.323 1.122 1.00 0.58 C ATOM 17 C ALA B 3 4.530 -10.955 1.141 1.00 0.63 C ATOM 18 O ALA B 3 3.498 -10.756 0.531 1.00 0.61 O ATOM 19 CB ALA B 3 4.859 -13.115 2.382 1.00 0.75 C ATOM 0 H ALA B 3 7.106 -12.225 2.089 1.00 0.63 H new ATOM 0 HA ALA B 3 4.869 -12.832 0.219 1.00 0.58 H new ATOM 0 HB1 ALA B 3 3.782 -13.275 2.425 1.00 0.75 H new ATOM 0 HB2 ALA B 3 5.368 -14.078 2.358 1.00 0.75 H new ATOM 0 HB3 ALA B 3 5.179 -12.557 3.262 1.00 0.75 H new ATOM 25 N GLN B 4 5.107 -10.009 1.827 1.00 0.75 N ATOM 26 CA GLN B 4 4.498 -8.651 1.872 1.00 0.89 C ATOM 27 C GLN B 4 4.661 -7.989 0.516 1.00 0.79 C ATOM 28 O GLN B 4 3.695 -7.600 -0.110 1.00 0.81 O ATOM 29 CB GLN B 4 5.271 -7.895 2.951 1.00 1.09 C ATOM 30 CG GLN B 4 4.562 -6.577 3.267 1.00 1.29 C ATOM 31 CD GLN B 4 5.298 -5.863 4.402 1.00 0.85 C ATOM 32 OE1 GLN B 4 5.816 -6.499 5.299 1.00 1.14 O ATOM 33 NE2 GLN B 4 5.369 -4.560 4.400 1.00 0.94 N ATOM 0 H GLN B 4 5.972 -10.117 2.357 1.00 0.75 H new ATOM 0 HA GLN B 4 3.432 -8.671 2.099 1.00 0.89 H new ATOM 0 HB2 GLN B 4 5.346 -8.504 3.852 1.00 1.09 H new ATOM 0 HB3 GLN B 4 6.289 -7.699 2.613 1.00 1.09 H new ATOM 0 HG2 GLN B 4 4.536 -5.944 2.380 1.00 1.29 H new ATOM 0 HG3 GLN B 4 3.527 -6.767 3.553 1.00 1.29 H new ATOM 0 HE21 GLN B 4 4.934 -4.027 3.647 1.00 0.94 H new ATOM 0 HE22 GLN B 4 5.859 -4.075 5.151 1.00 0.94 H new ATOM 42 N THR B 5 5.873 -7.887 0.041 1.00 0.76 N ATOM 43 CA THR B 5 6.083 -7.284 -1.307 1.00 0.79 C ATOM 44 C THR B 5 5.122 -7.969 -2.275 1.00 0.59 C ATOM 45 O THR B 5 4.590 -7.365 -3.186 1.00 0.57 O ATOM 46 CB THR B 5 7.538 -7.588 -1.670 1.00 0.94 C ATOM 47 OG1 THR B 5 8.400 -6.952 -0.736 1.00 1.26 O ATOM 48 CG2 THR B 5 7.827 -7.066 -3.074 1.00 0.94 C ATOM 0 H THR B 5 6.719 -8.192 0.522 1.00 0.76 H new ATOM 0 HA THR B 5 5.899 -6.210 -1.340 1.00 0.79 H new ATOM 0 HB THR B 5 7.707 -8.664 -1.642 1.00 0.94 H new ATOM 0 HG1 THR B 5 9.332 -7.147 -0.966 1.00 1.26 H new ATOM 0 HG21 THR B 5 8.863 -7.281 -3.336 1.00 0.94 H new ATOM 0 HG22 THR B 5 7.163 -7.555 -3.788 1.00 0.94 H new ATOM 0 HG23 THR B 5 7.661 -5.989 -3.103 1.00 0.94 H new ATOM 56 N ARG B 6 4.863 -9.226 -2.033 1.00 0.48 N ATOM 57 CA ARG B 6 3.896 -9.971 -2.877 1.00 0.46 C ATOM 58 C ARG B 6 2.502 -9.489 -2.538 1.00 0.43 C ATOM 59 O ARG B 6 1.695 -9.207 -3.401 1.00 0.45 O ATOM 60 CB ARG B 6 4.018 -11.430 -2.454 1.00 0.56 C ATOM 61 CG ARG B 6 4.560 -12.266 -3.615 1.00 0.78 C ATOM 62 CD ARG B 6 4.982 -13.642 -3.098 1.00 1.03 C ATOM 63 NE ARG B 6 3.728 -14.253 -2.571 1.00 0.88 N ATOM 64 CZ ARG B 6 2.810 -14.710 -3.388 1.00 0.73 C ATOM 65 NH1 ARG B 6 2.974 -14.640 -4.685 1.00 1.26 N ATOM 66 NH2 ARG B 6 1.721 -15.240 -2.903 1.00 1.43 N ATOM 0 H ARG B 6 5.285 -9.769 -1.280 1.00 0.48 H new ATOM 0 HA ARG B 6 4.084 -9.835 -3.942 1.00 0.46 H new ATOM 0 HB2 ARG B 6 4.682 -11.514 -1.593 1.00 0.56 H new ATOM 0 HB3 ARG B 6 3.045 -11.810 -2.144 1.00 0.56 H new ATOM 0 HG2 ARG B 6 3.798 -12.374 -4.387 1.00 0.78 H new ATOM 0 HG3 ARG B 6 5.410 -11.762 -4.075 1.00 0.78 H new ATOM 0 HD2 ARG B 6 5.413 -14.249 -3.895 1.00 1.03 H new ATOM 0 HD3 ARG B 6 5.738 -13.556 -2.318 1.00 1.03 H new ATOM 0 HE ARG B 6 3.583 -14.316 -1.563 1.00 0.88 H new ATOM 0 HH11 ARG B 6 3.823 -14.226 -5.070 1.00 1.26 H new ATOM 0 HH12 ARG B 6 2.253 -14.999 -5.310 1.00 1.26 H new ATOM 0 HH21 ARG B 6 1.587 -15.297 -1.893 1.00 1.43 H new ATOM 0 HH22 ARG B 6 1.003 -15.597 -3.533 1.00 1.43 H new ATOM 80 N ARG B 7 2.217 -9.402 -1.267 1.00 0.61 N ATOM 81 CA ARG B 7 0.872 -8.945 -0.852 1.00 0.80 C ATOM 82 C ARG B 7 0.611 -7.559 -1.439 1.00 0.65 C ATOM 83 O ARG B 7 -0.501 -7.214 -1.780 1.00 0.56 O ATOM 84 CB ARG B 7 0.920 -8.896 0.679 1.00 1.16 C ATOM 85 CG ARG B 7 -0.311 -8.158 1.220 1.00 1.10 C ATOM 86 CD ARG B 7 -0.027 -7.667 2.641 1.00 0.92 C ATOM 87 NE ARG B 7 -0.962 -6.527 2.861 1.00 0.41 N ATOM 88 CZ ARG B 7 -2.249 -6.735 3.006 1.00 0.93 C ATOM 89 NH1 ARG B 7 -2.741 -7.946 2.959 1.00 1.61 N ATOM 90 NH2 ARG B 7 -3.049 -5.723 3.198 1.00 1.08 N ATOM 0 H ARG B 7 2.857 -9.628 -0.506 1.00 0.61 H new ATOM 0 HA ARG B 7 0.073 -9.600 -1.199 1.00 0.80 H new ATOM 0 HB2 ARG B 7 0.954 -9.908 1.082 1.00 1.16 H new ATOM 0 HB3 ARG B 7 1.829 -8.392 1.006 1.00 1.16 H new ATOM 0 HG2 ARG B 7 -0.556 -7.315 0.574 1.00 1.10 H new ATOM 0 HG3 ARG B 7 -1.176 -8.822 1.219 1.00 1.10 H new ATOM 0 HD2 ARG B 7 -0.195 -8.459 3.371 1.00 0.92 H new ATOM 0 HD3 ARG B 7 1.011 -7.350 2.747 1.00 0.92 H new ATOM 0 HE ARG B 7 -0.597 -5.575 2.899 1.00 0.41 H new ATOM 0 HH11 ARG B 7 -2.122 -8.742 2.808 1.00 1.61 H new ATOM 0 HH12 ARG B 7 -3.744 -8.094 3.073 1.00 1.61 H new ATOM 0 HH21 ARG B 7 -2.673 -4.776 3.235 1.00 1.08 H new ATOM 0 HH22 ARG B 7 -4.051 -5.879 3.311 1.00 1.08 H new ATOM 104 N ARG B 8 1.643 -6.770 -1.566 1.00 0.68 N ATOM 105 CA ARG B 8 1.479 -5.404 -2.139 1.00 0.67 C ATOM 106 C ARG B 8 0.830 -5.507 -3.505 1.00 0.48 C ATOM 107 O ARG B 8 -0.020 -4.712 -3.859 1.00 0.50 O ATOM 108 CB ARG B 8 2.896 -4.847 -2.246 1.00 0.77 C ATOM 109 CG ARG B 8 2.892 -3.366 -1.873 1.00 0.73 C ATOM 110 CD ARG B 8 2.778 -3.218 -0.351 1.00 0.73 C ATOM 111 NE ARG B 8 3.907 -4.019 0.213 1.00 0.85 N ATOM 112 CZ ARG B 8 5.149 -3.623 0.080 1.00 1.05 C ATOM 113 NH1 ARG B 8 5.433 -2.517 -0.550 1.00 1.43 N ATOM 114 NH2 ARG B 8 6.112 -4.345 0.584 1.00 1.16 N ATOM 0 H ARG B 8 2.596 -7.014 -1.296 1.00 0.68 H new ATOM 0 HA ARG B 8 0.845 -4.760 -1.529 1.00 0.67 H new ATOM 0 HB2 ARG B 8 3.565 -5.397 -1.585 1.00 0.77 H new ATOM 0 HB3 ARG B 8 3.273 -4.976 -3.261 1.00 0.77 H new ATOM 0 HG2 ARG B 8 3.806 -2.889 -2.227 1.00 0.73 H new ATOM 0 HG3 ARG B 8 2.059 -2.860 -2.361 1.00 0.73 H new ATOM 0 HD2 ARG B 8 2.851 -2.172 -0.052 1.00 0.73 H new ATOM 0 HD3 ARG B 8 1.817 -3.587 0.008 1.00 0.73 H new ATOM 0 HE ARG B 8 3.707 -4.888 0.709 1.00 0.85 H new ATOM 0 HH11 ARG B 8 4.684 -1.949 -0.946 1.00 1.43 H new ATOM 0 HH12 ARG B 8 6.404 -2.220 -0.647 1.00 1.43 H new ATOM 0 HH21 ARG B 8 5.895 -5.211 1.077 1.00 1.16 H new ATOM 0 HH22 ARG B 8 7.081 -4.043 0.485 1.00 1.16 H new ATOM 128 N GLU B 9 1.179 -6.508 -4.259 1.00 0.38 N ATOM 129 CA GLU B 9 0.517 -6.673 -5.577 1.00 0.34 C ATOM 130 C GLU B 9 -0.960 -6.912 -5.306 1.00 0.31 C ATOM 131 O GLU B 9 -1.827 -6.479 -6.040 1.00 0.34 O ATOM 132 CB GLU B 9 1.175 -7.890 -6.233 1.00 0.40 C ATOM 133 CG GLU B 9 2.655 -7.596 -6.498 1.00 0.59 C ATOM 134 CD GLU B 9 2.966 -7.816 -7.979 1.00 1.24 C ATOM 135 OE1 GLU B 9 2.449 -8.769 -8.537 1.00 1.88 O ATOM 136 OE2 GLU B 9 3.716 -7.027 -8.531 1.00 1.73 O ATOM 0 H GLU B 9 1.882 -7.208 -4.025 1.00 0.38 H new ATOM 0 HA GLU B 9 0.615 -5.808 -6.233 1.00 0.34 H new ATOM 0 HB2 GLU B 9 1.078 -8.761 -5.585 1.00 0.40 H new ATOM 0 HB3 GLU B 9 0.669 -8.129 -7.168 1.00 0.40 H new ATOM 0 HG2 GLU B 9 2.888 -6.569 -6.216 1.00 0.59 H new ATOM 0 HG3 GLU B 9 3.280 -8.245 -5.885 1.00 0.59 H new ATOM 143 N ARG B 10 -1.242 -7.553 -4.205 1.00 0.31 N ATOM 144 CA ARG B 10 -2.651 -7.776 -3.812 1.00 0.38 C ATOM 145 C ARG B 10 -3.205 -6.462 -3.270 1.00 0.35 C ATOM 146 O ARG B 10 -4.400 -6.283 -3.144 1.00 0.40 O ATOM 147 CB ARG B 10 -2.603 -8.843 -2.716 1.00 0.46 C ATOM 148 CG ARG B 10 -3.279 -10.121 -3.215 1.00 0.73 C ATOM 149 CD ARG B 10 -2.692 -11.330 -2.484 1.00 0.67 C ATOM 150 NE ARG B 10 -3.477 -12.496 -2.981 1.00 1.55 N ATOM 151 CZ ARG B 10 -3.263 -12.986 -4.178 1.00 2.12 C ATOM 152 NH1 ARG B 10 -2.357 -12.461 -4.965 1.00 3.14 N ATOM 153 NH2 ARG B 10 -3.963 -14.007 -4.592 1.00 2.20 N ATOM 0 H ARG B 10 -0.548 -7.932 -3.560 1.00 0.31 H new ATOM 0 HA ARG B 10 -3.286 -8.098 -4.637 1.00 0.38 H new ATOM 0 HB2 ARG B 10 -1.569 -9.050 -2.441 1.00 0.46 H new ATOM 0 HB3 ARG B 10 -3.105 -8.480 -1.819 1.00 0.46 H new ATOM 0 HG2 ARG B 10 -4.354 -10.067 -3.044 1.00 0.73 H new ATOM 0 HG3 ARG B 10 -3.132 -10.226 -4.290 1.00 0.73 H new ATOM 0 HD2 ARG B 10 -1.630 -11.446 -2.702 1.00 0.67 H new ATOM 0 HD3 ARG B 10 -2.786 -11.222 -1.403 1.00 0.67 H new ATOM 0 HE ARG B 10 -4.188 -12.917 -2.383 1.00 1.55 H new ATOM 0 HH11 ARG B 10 -1.808 -11.661 -4.649 1.00 3.14 H new ATOM 0 HH12 ARG B 10 -2.200 -12.852 -5.894 1.00 3.14 H new ATOM 0 HH21 ARG B 10 -4.672 -14.419 -3.985 1.00 2.20 H new ATOM 0 HH22 ARG B 10 -3.801 -14.393 -5.522 1.00 2.20 H new ATOM 167 N ARG B 11 -2.335 -5.528 -2.966 1.00 0.29 N ATOM 168 CA ARG B 11 -2.811 -4.220 -2.455 1.00 0.29 C ATOM 169 C ARG B 11 -2.929 -3.224 -3.603 1.00 0.24 C ATOM 170 O ARG B 11 -3.255 -2.077 -3.391 1.00 0.25 O ATOM 171 CB ARG B 11 -1.764 -3.749 -1.450 1.00 0.32 C ATOM 172 CG ARG B 11 -1.716 -4.704 -0.249 1.00 0.41 C ATOM 173 CD ARG B 11 -3.100 -4.786 0.405 1.00 0.55 C ATOM 174 NE ARG B 11 -3.392 -6.247 0.501 1.00 1.59 N ATOM 175 CZ ARG B 11 -4.575 -6.668 0.882 1.00 2.18 C ATOM 176 NH1 ARG B 11 -5.521 -5.817 1.184 1.00 1.76 N ATOM 177 NH2 ARG B 11 -4.810 -7.950 0.961 1.00 3.24 N ATOM 0 H ARG B 11 -1.323 -5.621 -3.052 1.00 0.29 H new ATOM 0 HA ARG B 11 -3.794 -4.304 -1.991 1.00 0.29 H new ATOM 0 HB2 ARG B 11 -0.785 -3.704 -1.928 1.00 0.32 H new ATOM 0 HB3 ARG B 11 -2.001 -2.740 -1.113 1.00 0.32 H new ATOM 0 HG2 ARG B 11 -1.398 -5.695 -0.573 1.00 0.41 H new ATOM 0 HG3 ARG B 11 -0.981 -4.354 0.476 1.00 0.41 H new ATOM 0 HD2 ARG B 11 -3.101 -4.317 1.389 1.00 0.55 H new ATOM 0 HD3 ARG B 11 -3.851 -4.271 -0.194 1.00 0.55 H new ATOM 0 HE ARG B 11 -2.665 -6.924 0.268 1.00 1.59 H new ATOM 0 HH11 ARG B 11 -5.343 -4.814 1.125 1.00 1.76 H new ATOM 0 HH12 ARG B 11 -6.437 -6.156 1.479 1.00 1.76 H new ATOM 0 HH21 ARG B 11 -4.076 -8.618 0.727 1.00 3.24 H new ATOM 0 HH22 ARG B 11 -5.728 -8.283 1.257 1.00 3.24 H new ATOM 191 N ALA B 12 -2.698 -3.647 -4.824 1.00 0.24 N ATOM 192 CA ALA B 12 -2.845 -2.691 -5.963 1.00 0.28 C ATOM 193 C ALA B 12 -4.248 -2.091 -5.896 1.00 0.31 C ATOM 194 O ALA B 12 -4.488 -0.981 -6.328 1.00 0.33 O ATOM 195 CB ALA B 12 -2.670 -3.532 -7.228 1.00 0.34 C ATOM 0 H ALA B 12 -2.419 -4.595 -5.076 1.00 0.24 H new ATOM 0 HA ALA B 12 -2.123 -1.875 -5.941 1.00 0.28 H new ATOM 0 HB1 ALA B 12 -2.766 -2.893 -8.106 1.00 0.34 H new ATOM 0 HB2 ALA B 12 -1.684 -3.996 -7.223 1.00 0.34 H new ATOM 0 HB3 ALA B 12 -3.436 -4.307 -7.258 1.00 0.34 H new ATOM 201 N GLU B 13 -5.169 -2.816 -5.314 1.00 0.34 N ATOM 202 CA GLU B 13 -6.548 -2.289 -5.162 1.00 0.41 C ATOM 203 C GLU B 13 -6.539 -1.256 -4.040 1.00 0.38 C ATOM 204 O GLU B 13 -7.245 -0.267 -4.085 1.00 0.42 O ATOM 205 CB GLU B 13 -7.409 -3.498 -4.789 1.00 0.48 C ATOM 206 CG GLU B 13 -7.421 -4.496 -5.949 1.00 0.52 C ATOM 207 CD GLU B 13 -8.055 -5.808 -5.484 1.00 0.77 C ATOM 208 OE1 GLU B 13 -9.267 -5.840 -5.345 1.00 1.18 O ATOM 209 OE2 GLU B 13 -7.319 -6.758 -5.276 1.00 1.15 O ATOM 0 H GLU B 13 -5.020 -3.752 -4.938 1.00 0.34 H new ATOM 0 HA GLU B 13 -6.931 -1.809 -6.063 1.00 0.41 H new ATOM 0 HB2 GLU B 13 -7.016 -3.974 -3.890 1.00 0.48 H new ATOM 0 HB3 GLU B 13 -8.426 -3.177 -4.561 1.00 0.48 H new ATOM 0 HG2 GLU B 13 -7.981 -4.087 -6.790 1.00 0.52 H new ATOM 0 HG3 GLU B 13 -6.405 -4.675 -6.300 1.00 0.52 H new ATOM 216 N LYS B 14 -5.705 -1.459 -3.049 1.00 0.33 N ATOM 217 CA LYS B 14 -5.606 -0.469 -1.947 1.00 0.33 C ATOM 218 C LYS B 14 -4.769 0.697 -2.458 1.00 0.28 C ATOM 219 O LYS B 14 -5.039 1.854 -2.197 1.00 0.30 O ATOM 220 CB LYS B 14 -4.887 -1.200 -0.813 1.00 0.31 C ATOM 221 CG LYS B 14 -5.813 -2.260 -0.217 1.00 0.38 C ATOM 222 CD LYS B 14 -6.654 -1.635 0.900 1.00 1.23 C ATOM 223 CE LYS B 14 -6.399 -2.380 2.212 1.00 1.37 C ATOM 224 NZ LYS B 14 -7.460 -3.423 2.271 1.00 1.83 N ATOM 0 H LYS B 14 -5.091 -2.269 -2.961 1.00 0.33 H new ATOM 0 HA LYS B 14 -6.568 -0.086 -1.608 1.00 0.33 H new ATOM 0 HB2 LYS B 14 -3.977 -1.668 -1.188 1.00 0.31 H new ATOM 0 HB3 LYS B 14 -4.587 -0.490 -0.042 1.00 0.31 H new ATOM 0 HG2 LYS B 14 -6.463 -2.667 -0.992 1.00 0.38 H new ATOM 0 HG3 LYS B 14 -5.227 -3.091 0.176 1.00 0.38 H new ATOM 0 HD2 LYS B 14 -6.401 -0.581 1.013 1.00 1.23 H new ATOM 0 HD3 LYS B 14 -7.712 -1.683 0.643 1.00 1.23 H new ATOM 0 HE2 LYS B 14 -5.405 -2.826 2.226 1.00 1.37 H new ATOM 0 HE3 LYS B 14 -6.459 -1.707 3.067 1.00 1.37 H new ATOM 0 HZ1 LYS B 14 -7.353 -3.978 3.144 1.00 1.83 H new ATOM 0 HZ2 LYS B 14 -8.395 -2.968 2.262 1.00 1.83 H new ATOM 0 HZ3 LYS B 14 -7.374 -4.053 1.448 1.00 1.83 H new ATOM 238 N GLN B 15 -3.759 0.374 -3.214 1.00 0.25 N ATOM 239 CA GLN B 15 -2.874 1.407 -3.805 1.00 0.24 C ATOM 240 C GLN B 15 -3.642 2.191 -4.857 1.00 0.28 C ATOM 241 O GLN B 15 -3.649 3.397 -4.861 1.00 0.28 O ATOM 242 CB GLN B 15 -1.746 0.609 -4.466 1.00 0.24 C ATOM 243 CG GLN B 15 -0.446 0.830 -3.701 1.00 0.25 C ATOM 244 CD GLN B 15 0.358 -0.469 -3.712 1.00 0.30 C ATOM 245 OE1 GLN B 15 -0.175 -1.545 -3.200 1.00 0.35 O flip ATOM 246 NE2 GLN B 15 1.474 -0.506 -4.187 1.00 0.33 N flip ATOM 0 H GLN B 15 -3.506 -0.585 -3.451 1.00 0.25 H new ATOM 0 HA GLN B 15 -2.503 2.120 -3.069 1.00 0.24 H new ATOM 0 HB2 GLN B 15 -1.996 -0.452 -4.478 1.00 0.24 H new ATOM 0 HB3 GLN B 15 -1.626 0.920 -5.504 1.00 0.24 H new ATOM 0 HG2 GLN B 15 0.130 1.634 -4.159 1.00 0.25 H new ATOM 0 HG3 GLN B 15 -0.658 1.134 -2.676 1.00 0.25 H new ATOM 0 HE21 GLN B 15 1.887 0.337 -4.586 1.00 0.33 H new ATOM 0 HE22 GLN B 15 1.999 -1.380 -4.187 1.00 0.33 H new ATOM 255 N ALA B 16 -4.290 1.507 -5.751 1.00 0.35 N ATOM 256 CA ALA B 16 -5.059 2.221 -6.806 1.00 0.41 C ATOM 257 C ALA B 16 -6.204 3.003 -6.171 1.00 0.40 C ATOM 258 O ALA B 16 -6.633 4.015 -6.690 1.00 0.43 O ATOM 259 CB ALA B 16 -5.593 1.128 -7.734 1.00 0.48 C ATOM 0 H ALA B 16 -4.322 0.489 -5.799 1.00 0.35 H new ATOM 0 HA ALA B 16 -4.446 2.938 -7.352 1.00 0.41 H new ATOM 0 HB1 ALA B 16 -6.172 1.584 -8.538 1.00 0.48 H new ATOM 0 HB2 ALA B 16 -4.758 0.571 -8.159 1.00 0.48 H new ATOM 0 HB3 ALA B 16 -6.231 0.449 -7.168 1.00 0.48 H new ATOM 265 N GLN B 17 -6.685 2.569 -5.034 1.00 0.40 N ATOM 266 CA GLN B 17 -7.775 3.332 -4.373 1.00 0.42 C ATOM 267 C GLN B 17 -7.140 4.503 -3.646 1.00 0.37 C ATOM 268 O GLN B 17 -7.672 5.595 -3.596 1.00 0.40 O ATOM 269 CB GLN B 17 -8.424 2.357 -3.393 1.00 0.45 C ATOM 270 CG GLN B 17 -9.554 1.602 -4.095 1.00 0.53 C ATOM 271 CD GLN B 17 -10.868 2.363 -3.912 1.00 0.66 C ATOM 272 OE1 GLN B 17 -10.867 3.548 -3.649 1.00 1.06 O ATOM 273 NE2 GLN B 17 -12.000 1.725 -4.042 1.00 1.33 N ATOM 0 H GLN B 17 -6.373 1.731 -4.544 1.00 0.40 H new ATOM 0 HA GLN B 17 -8.521 3.722 -5.066 1.00 0.42 H new ATOM 0 HB2 GLN B 17 -7.681 1.653 -3.018 1.00 0.45 H new ATOM 0 HB3 GLN B 17 -8.815 2.898 -2.531 1.00 0.45 H new ATOM 0 HG2 GLN B 17 -9.329 1.494 -5.156 1.00 0.53 H new ATOM 0 HG3 GLN B 17 -9.644 0.596 -3.684 1.00 0.53 H new ATOM 0 HE21 GLN B 17 -12.002 0.729 -4.263 1.00 1.33 H new ATOM 0 HE22 GLN B 17 -12.882 2.222 -3.923 1.00 1.33 H new ATOM 282 N TRP B 18 -5.980 4.274 -3.113 1.00 0.32 N ATOM 283 CA TRP B 18 -5.250 5.350 -2.412 1.00 0.30 C ATOM 284 C TRP B 18 -4.604 6.264 -3.449 1.00 0.31 C ATOM 285 O TRP B 18 -4.699 7.474 -3.389 1.00 0.35 O ATOM 286 CB TRP B 18 -4.155 4.633 -1.632 1.00 0.25 C ATOM 287 CG TRP B 18 -3.251 5.657 -1.049 1.00 0.24 C ATOM 288 CD1 TRP B 18 -3.335 6.186 0.184 1.00 0.30 C ATOM 289 CD2 TRP B 18 -2.121 6.280 -1.680 1.00 0.24 C ATOM 290 NE1 TRP B 18 -2.327 7.128 0.330 1.00 0.31 N ATOM 291 CE2 TRP B 18 -1.546 7.206 -0.795 1.00 0.29 C ATOM 292 CE3 TRP B 18 -1.554 6.122 -2.933 1.00 0.28 C ATOM 293 CZ2 TRP B 18 -0.430 7.953 -1.153 1.00 0.34 C ATOM 294 CZ3 TRP B 18 -0.441 6.854 -3.300 1.00 0.36 C ATOM 295 CH2 TRP B 18 0.124 7.768 -2.420 1.00 0.38 C ATOM 0 H TRP B 18 -5.502 3.373 -3.135 1.00 0.32 H new ATOM 0 HA TRP B 18 -5.897 5.949 -1.771 1.00 0.30 H new ATOM 0 HB2 TRP B 18 -4.590 4.018 -0.844 1.00 0.25 H new ATOM 0 HB3 TRP B 18 -3.598 3.964 -2.288 1.00 0.25 H new ATOM 0 HD1 TRP B 18 -4.065 5.922 0.935 1.00 0.30 H new ATOM 0 HE1 TRP B 18 -2.185 7.692 1.168 1.00 0.31 H new ATOM 0 HE3 TRP B 18 -1.986 5.420 -3.631 1.00 0.28 H new ATOM 0 HZ2 TRP B 18 0.000 8.664 -0.463 1.00 0.34 H new ATOM 0 HZ3 TRP B 18 -0.007 6.714 -4.279 1.00 0.36 H new ATOM 0 HH2 TRP B 18 0.993 8.336 -2.717 1.00 0.38 H new ATOM 306 N LYS B 19 -3.943 5.669 -4.394 1.00 0.30 N ATOM 307 CA LYS B 19 -3.264 6.451 -5.456 1.00 0.37 C ATOM 308 C LYS B 19 -4.297 7.316 -6.143 1.00 0.46 C ATOM 309 O LYS B 19 -4.030 8.434 -6.542 1.00 0.70 O ATOM 310 CB LYS B 19 -2.700 5.418 -6.435 1.00 0.40 C ATOM 311 CG LYS B 19 -1.467 4.729 -5.842 1.00 0.49 C ATOM 312 CD LYS B 19 -1.002 3.619 -6.789 1.00 0.96 C ATOM 313 CE LYS B 19 0.524 3.640 -6.893 1.00 1.30 C ATOM 314 NZ LYS B 19 0.869 2.472 -7.751 1.00 1.92 N ATOM 0 H LYS B 19 -3.843 4.657 -4.477 1.00 0.30 H new ATOM 0 HA LYS B 19 -2.474 7.095 -5.070 1.00 0.37 H new ATOM 0 HB2 LYS B 19 -3.463 4.674 -6.666 1.00 0.40 H new ATOM 0 HB3 LYS B 19 -2.435 5.905 -7.373 1.00 0.40 H new ATOM 0 HG2 LYS B 19 -0.667 5.455 -5.693 1.00 0.49 H new ATOM 0 HG3 LYS B 19 -1.705 4.312 -4.863 1.00 0.49 H new ATOM 0 HD2 LYS B 19 -1.338 2.649 -6.422 1.00 0.96 H new ATOM 0 HD3 LYS B 19 -1.446 3.758 -7.775 1.00 0.96 H new ATOM 0 HE2 LYS B 19 0.877 4.572 -7.335 1.00 1.30 H new ATOM 0 HE3 LYS B 19 0.988 3.558 -5.910 1.00 1.30 H new ATOM 0 HZ1 LYS B 19 1.901 2.420 -7.868 1.00 1.92 H new ATOM 0 HZ2 LYS B 19 0.527 1.598 -7.302 1.00 1.92 H new ATOM 0 HZ3 LYS B 19 0.420 2.581 -8.683 1.00 1.92 H new ATOM 328 N ALA B 20 -5.490 6.807 -6.270 1.00 0.44 N ATOM 329 CA ALA B 20 -6.549 7.606 -6.919 1.00 0.52 C ATOM 330 C ALA B 20 -6.827 8.858 -6.089 1.00 0.56 C ATOM 331 O ALA B 20 -7.246 9.878 -6.603 1.00 0.74 O ATOM 332 CB ALA B 20 -7.780 6.709 -6.949 1.00 0.55 C ATOM 0 H ALA B 20 -5.770 5.879 -5.953 1.00 0.44 H new ATOM 0 HA ALA B 20 -6.265 7.929 -7.921 1.00 0.52 H new ATOM 0 HB1 ALA B 20 -8.607 7.241 -7.419 1.00 0.55 H new ATOM 0 HB2 ALA B 20 -7.559 5.806 -7.519 1.00 0.55 H new ATOM 0 HB3 ALA B 20 -8.057 6.437 -5.930 1.00 0.55 H new ATOM 338 N ALA B 21 -6.594 8.785 -4.803 1.00 0.54 N ATOM 339 CA ALA B 21 -6.843 9.968 -3.934 1.00 0.66 C ATOM 340 C ALA B 21 -5.551 10.417 -3.265 1.00 0.73 C ATOM 341 O ALA B 21 -5.555 11.016 -2.208 1.00 0.99 O ATOM 342 CB ALA B 21 -7.861 9.497 -2.897 1.00 0.71 C ATOM 0 H ALA B 21 -6.243 7.958 -4.321 1.00 0.54 H new ATOM 0 HA ALA B 21 -7.213 10.823 -4.500 1.00 0.66 H new ATOM 0 HB1 ALA B 21 -8.095 10.317 -2.218 1.00 0.71 H new ATOM 0 HB2 ALA B 21 -8.771 9.173 -3.402 1.00 0.71 H new ATOM 0 HB3 ALA B 21 -7.444 8.665 -2.330 1.00 0.71 H new ATOM 348 N ASN B 22 -4.452 10.147 -3.898 1.00 0.73 N ATOM 349 CA ASN B 22 -3.134 10.568 -3.338 1.00 0.88 C ATOM 350 C ASN B 22 -2.092 10.712 -4.451 1.00 1.08 C ATOM 351 O ASN B 22 -1.003 10.185 -4.347 1.00 0.00 O ATOM 352 CB ASN B 22 -2.710 9.472 -2.369 1.00 0.93 C ATOM 353 CG ASN B 22 -3.664 9.445 -1.180 1.00 0.94 C ATOM 354 OD1 ASN B 22 -4.408 8.399 -1.000 1.00 1.13 O flip ATOM 355 ND2 ASN B 22 -3.731 10.384 -0.412 1.00 0.94 N flip ATOM 0 H ASN B 22 -4.403 9.649 -4.787 1.00 0.73 H new ATOM 0 HA ASN B 22 -3.215 11.535 -2.842 1.00 0.88 H new ATOM 0 HB2 ASN B 22 -2.713 8.506 -2.873 1.00 0.93 H new ATOM 0 HB3 ASN B 22 -1.691 9.650 -2.027 1.00 0.93 H new ATOM 0 HD21 ASN B 22 -3.143 11.205 -0.558 1.00 0.94 H new ATOM 0 HD22 ASN B 22 -4.375 10.351 0.379 1.00 0.94 H new ATOM 362 N PRO B 23 -2.448 11.452 -5.465 1.00 0.00 N ATOM 363 CA PRO B 23 -1.515 11.700 -6.580 1.00 0.00 C ATOM 364 C PRO B 23 -0.408 12.598 -6.045 1.00 0.00 C ATOM 365 O PRO B 23 0.725 12.549 -6.475 1.00 0.00 O ATOM 366 CB PRO B 23 -2.375 12.405 -7.627 1.00 0.00 C ATOM 367 CG PRO B 23 -3.491 13.020 -6.849 1.00 0.00 C ATOM 368 CD PRO B 23 -3.722 12.131 -5.654 1.00 0.00 C ATOM 0 HA PRO B 23 -1.044 10.813 -7.004 1.00 0.00 H new ATOM 0 HB2 PRO B 23 -1.803 13.161 -8.165 1.00 0.00 H new ATOM 0 HB3 PRO B 23 -2.751 11.701 -8.370 1.00 0.00 H new ATOM 0 HG2 PRO B 23 -3.234 14.032 -6.536 1.00 0.00 H new ATOM 0 HG3 PRO B 23 -4.393 13.094 -7.457 1.00 0.00 H new ATOM 0 HD2 PRO B 23 -3.999 12.711 -4.774 1.00 0.00 H new ATOM 0 HD3 PRO B 23 -4.529 11.421 -5.835 1.00 0.00 H new ATOM 376 N LEU B 24 -0.742 13.395 -5.063 1.00 0.00 N ATOM 377 CA LEU B 24 0.273 14.283 -4.430 1.00 0.00 C ATOM 378 C LEU B 24 1.410 13.418 -3.887 1.00 0.00 C ATOM 379 O LEU B 24 2.568 13.780 -3.932 1.00 0.00 O ATOM 380 CB LEU B 24 -0.488 15.009 -3.300 1.00 0.00 C ATOM 381 CG LEU B 24 -0.442 14.206 -1.979 1.00 0.00 C ATOM 382 CD1 LEU B 24 -0.907 15.105 -0.833 1.00 0.00 C ATOM 383 CD2 LEU B 24 -1.364 12.974 -2.056 1.00 0.00 C ATOM 0 H LEU B 24 -1.681 13.468 -4.671 1.00 0.00 H new ATOM 0 HA LEU B 24 0.720 15.001 -5.118 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -0.053 15.996 -3.142 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -1.525 15.162 -3.598 1.00 0.00 H new ATOM 0 HG LEU B 24 0.581 13.869 -1.809 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -0.878 14.546 0.103 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -0.249 15.971 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -1.927 15.440 -1.024 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -1.316 12.424 -1.116 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -2.389 13.298 -2.235 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -1.040 12.327 -2.872 1.00 0.00 H new ATOM 395 N LEU B 25 1.072 12.252 -3.416 1.00 0.00 N ATOM 396 CA LEU B 25 2.100 11.308 -2.912 1.00 0.00 C ATOM 397 C LEU B 25 2.339 10.285 -4.010 1.00 0.00 C ATOM 398 O LEU B 25 2.615 9.126 -3.775 1.00 0.00 O ATOM 399 CB LEU B 25 1.474 10.658 -1.679 1.00 0.00 C ATOM 400 CG LEU B 25 1.816 11.481 -0.436 1.00 0.00 C ATOM 401 CD1 LEU B 25 0.665 11.399 0.568 1.00 0.00 C ATOM 402 CD2 LEU B 25 3.090 10.927 0.205 1.00 0.00 C ATOM 0 H LEU B 25 0.113 11.910 -3.359 1.00 0.00 H new ATOM 0 HA LEU B 25 3.052 11.774 -2.655 1.00 0.00 H new ATOM 0 HB2 LEU B 25 0.393 10.594 -1.799 1.00 0.00 H new ATOM 0 HB3 LEU B 25 1.843 9.639 -1.566 1.00 0.00 H new ATOM 0 HG LEU B 25 1.972 12.521 -0.722 1.00 0.00 H new ATOM 0 HD11 LEU B 25 0.911 11.986 1.453 1.00 0.00 H new ATOM 0 HD12 LEU B 25 -0.244 11.793 0.113 1.00 0.00 H new ATOM 0 HD13 LEU B 25 0.506 10.360 0.855 1.00 0.00 H new ATOM 0 HD21 LEU B 25 3.336 11.512 1.091 1.00 0.00 H new ATOM 0 HD22 LEU B 25 2.931 9.887 0.490 1.00 0.00 H new ATOM 0 HD23 LEU B 25 3.912 10.987 -0.508 1.00 0.00 H new ATOM 414 N VAL B 26 2.197 10.736 -5.216 1.00 0.00 N ATOM 415 CA VAL B 26 2.359 9.857 -6.393 1.00 0.00 C ATOM 416 C VAL B 26 2.903 10.688 -7.553 1.00 0.00 C ATOM 417 O VAL B 26 2.260 11.602 -8.030 1.00 0.00 O ATOM 418 CB VAL B 26 0.933 9.350 -6.654 1.00 0.00 C ATOM 419 CG1 VAL B 26 0.572 9.479 -8.136 1.00 0.00 C ATOM 420 CG2 VAL B 26 0.854 7.888 -6.226 1.00 0.00 C ATOM 0 H VAL B 26 1.969 11.705 -5.440 1.00 0.00 H new ATOM 0 HA VAL B 26 3.056 9.030 -6.257 1.00 0.00 H new ATOM 0 HB VAL B 26 0.225 9.951 -6.083 1.00 0.00 H new ATOM 0 HG11 VAL B 26 -0.442 9.114 -8.297 1.00 0.00 H new ATOM 0 HG12 VAL B 26 0.633 10.525 -8.436 1.00 0.00 H new ATOM 0 HG13 VAL B 26 1.268 8.890 -8.733 1.00 0.00 H new ATOM 0 HG21 VAL B 26 -0.153 7.511 -6.404 1.00 0.00 H new ATOM 0 HG22 VAL B 26 1.569 7.301 -6.803 1.00 0.00 H new ATOM 0 HG23 VAL B 26 1.089 7.806 -5.165 1.00 0.00 H new ATOM 430 N GLY B 27 4.088 10.396 -7.995 1.00 0.00 N ATOM 431 CA GLY B 27 4.677 11.195 -9.107 1.00 0.00 C ATOM 432 C GLY B 27 5.082 12.570 -8.563 1.00 0.00 C ATOM 433 O GLY B 27 6.231 12.958 -8.633 1.00 0.00 O ATOM 0 H GLY B 27 4.676 9.642 -7.639 1.00 0.00 H new ATOM 0 HA2 GLY B 27 5.545 10.682 -9.522 1.00 0.00 H new ATOM 0 HA3 GLY B 27 3.955 11.306 -9.916 1.00 0.00 H new ATOM 437 N VAL B 28 4.146 13.307 -8.011 1.00 0.00 N ATOM 438 CA VAL B 28 4.479 14.651 -7.452 1.00 0.00 C ATOM 439 C VAL B 28 5.642 14.540 -6.465 1.00 0.00 C ATOM 440 O VAL B 28 5.731 13.604 -5.695 1.00 0.00 O ATOM 441 CB VAL B 28 3.217 15.124 -6.730 1.00 0.00 C ATOM 442 CG1 VAL B 28 3.510 16.437 -5.990 1.00 0.00 C ATOM 443 CG2 VAL B 28 2.102 15.354 -7.754 1.00 0.00 C ATOM 0 H VAL B 28 3.167 13.033 -7.925 1.00 0.00 H new ATOM 0 HA VAL B 28 4.782 15.348 -8.233 1.00 0.00 H new ATOM 0 HB VAL B 28 2.903 14.366 -6.012 1.00 0.00 H new ATOM 0 HG11 VAL B 28 2.610 16.773 -5.476 1.00 0.00 H new ATOM 0 HG12 VAL B 28 4.305 16.275 -5.262 1.00 0.00 H new ATOM 0 HG13 VAL B 28 3.824 17.196 -6.706 1.00 0.00 H new ATOM 0 HG21 VAL B 28 1.201 15.691 -7.241 1.00 0.00 H new ATOM 0 HG22 VAL B 28 2.417 16.112 -8.471 1.00 0.00 H new ATOM 0 HG23 VAL B 28 1.893 14.422 -8.280 1.00 0.00 H new ATOM 453 N SER B 29 6.526 15.500 -6.482 1.00 0.00 N ATOM 454 CA SER B 29 7.692 15.486 -5.553 1.00 0.00 C ATOM 455 C SER B 29 8.325 14.096 -5.486 1.00 0.00 C ATOM 456 O SER B 29 8.635 13.592 -4.423 1.00 0.00 O ATOM 457 CB SER B 29 7.133 15.875 -4.189 1.00 0.00 C ATOM 458 OG SER B 29 6.699 17.229 -4.225 1.00 0.00 O ATOM 0 H SER B 29 6.489 16.304 -7.109 1.00 0.00 H new ATOM 0 HA SER B 29 8.472 16.170 -5.888 1.00 0.00 H new ATOM 0 HB2 SER B 29 6.301 15.222 -3.925 1.00 0.00 H new ATOM 0 HB3 SER B 29 7.896 15.746 -3.421 1.00 0.00 H new ATOM 0 HG SER B 29 6.338 17.480 -3.349 1.00 0.00 H new ATOM 464 N ALA B 30 8.517 13.478 -6.612 1.00 0.00 N ATOM 465 CA ALA B 30 9.130 12.120 -6.627 1.00 0.00 C ATOM 466 C ALA B 30 9.973 11.953 -7.887 1.00 0.00 C ATOM 467 O ALA B 30 9.841 10.987 -8.615 1.00 0.00 O ATOM 468 CB ALA B 30 7.952 11.145 -6.632 1.00 0.00 C ATOM 0 H ALA B 30 8.276 13.854 -7.529 1.00 0.00 H new ATOM 0 HA ALA B 30 9.786 11.949 -5.773 1.00 0.00 H new ATOM 0 HB1 ALA B 30 8.327 10.122 -6.643 1.00 0.00 H new ATOM 0 HB2 ALA B 30 7.347 11.300 -5.739 1.00 0.00 H new ATOM 0 HB3 ALA B 30 7.341 11.317 -7.518 1.00 0.00 H new ATOM 474 N LYS B 31 10.838 12.891 -8.149 1.00 0.00 N ATOM 475 CA LYS B 31 11.694 12.797 -9.367 1.00 0.00 C ATOM 476 C LYS B 31 13.146 13.149 -9.029 1.00 0.00 C ATOM 477 O LYS B 31 13.404 13.886 -8.097 1.00 0.00 O ATOM 478 CB LYS B 31 11.108 13.816 -10.344 1.00 0.00 C ATOM 479 CG LYS B 31 9.783 13.290 -10.904 1.00 0.00 C ATOM 480 CD LYS B 31 9.776 13.432 -12.428 1.00 0.00 C ATOM 481 CE LYS B 31 8.350 13.713 -12.908 1.00 0.00 C ATOM 482 NZ LYS B 31 8.453 13.806 -14.392 1.00 0.00 N ATOM 0 H LYS B 31 10.991 13.719 -7.574 1.00 0.00 H new ATOM 0 HA LYS B 31 11.704 11.790 -9.785 1.00 0.00 H new ATOM 0 HB2 LYS B 31 10.948 14.769 -9.839 1.00 0.00 H new ATOM 0 HB3 LYS B 31 11.810 14.000 -11.157 1.00 0.00 H new ATOM 0 HG2 LYS B 31 9.649 12.245 -10.626 1.00 0.00 H new ATOM 0 HG3 LYS B 31 8.949 13.844 -10.473 1.00 0.00 H new ATOM 0 HD2 LYS B 31 10.439 14.242 -12.731 1.00 0.00 H new ATOM 0 HD3 LYS B 31 10.154 12.520 -12.891 1.00 0.00 H new ATOM 0 HE2 LYS B 31 7.669 12.916 -12.609 1.00 0.00 H new ATOM 0 HE3 LYS B 31 7.965 14.639 -12.480 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 7.513 13.998 -14.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 9.102 14.577 -14.647 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 8.815 12.908 -14.772 1.00 0.00 H new ATOM 496 N PRO B 32 14.052 12.610 -9.804 1.00 0.00 N ATOM 497 CA PRO B 32 15.494 12.875 -9.582 1.00 0.00 C ATOM 498 C PRO B 32 15.842 14.304 -10.003 1.00 0.00 C ATOM 499 O PRO B 32 14.974 15.133 -10.200 1.00 0.00 O ATOM 500 CB PRO B 32 16.190 11.856 -10.480 1.00 0.00 C ATOM 501 CG PRO B 32 15.195 11.540 -11.549 1.00 0.00 C ATOM 502 CD PRO B 32 13.826 11.713 -10.945 1.00 0.00 C ATOM 0 HA PRO B 32 15.792 12.785 -8.537 1.00 0.00 H new ATOM 0 HB2 PRO B 32 17.108 12.264 -10.903 1.00 0.00 H new ATOM 0 HB3 PRO B 32 16.467 10.962 -9.922 1.00 0.00 H new ATOM 0 HG2 PRO B 32 15.325 12.203 -12.404 1.00 0.00 H new ATOM 0 HG3 PRO B 32 15.330 10.521 -11.912 1.00 0.00 H new ATOM 0 HD2 PRO B 32 13.126 12.145 -11.660 1.00 0.00 H new ATOM 0 HD3 PRO B 32 13.407 10.759 -10.626 1.00 0.00 H new ATOM 510 N VAL B 33 17.106 14.599 -10.136 1.00 0.00 N ATOM 511 CA VAL B 33 17.516 15.978 -10.540 1.00 0.00 C ATOM 512 C VAL B 33 17.396 16.165 -12.059 1.00 0.00 C ATOM 513 O VAL B 33 17.813 17.171 -12.595 1.00 0.00 O ATOM 514 CB VAL B 33 18.972 16.114 -10.088 1.00 0.00 C ATOM 515 CG1 VAL B 33 19.831 15.044 -10.770 1.00 0.00 C ATOM 516 CG2 VAL B 33 19.497 17.503 -10.465 1.00 0.00 C ATOM 0 H VAL B 33 17.874 13.946 -9.983 1.00 0.00 H new ATOM 0 HA VAL B 33 16.878 16.737 -10.088 1.00 0.00 H new ATOM 0 HB VAL B 33 19.025 15.983 -9.007 1.00 0.00 H new ATOM 0 HG11 VAL B 33 20.866 15.146 -10.444 1.00 0.00 H new ATOM 0 HG12 VAL B 33 19.462 14.055 -10.500 1.00 0.00 H new ATOM 0 HG13 VAL B 33 19.777 15.169 -11.851 1.00 0.00 H new ATOM 0 HG21 VAL B 33 20.534 17.600 -10.143 1.00 0.00 H new ATOM 0 HG22 VAL B 33 19.439 17.633 -11.546 1.00 0.00 H new ATOM 0 HG23 VAL B 33 18.892 18.266 -9.975 1.00 0.00 H new ATOM 526 N ASN B 34 16.826 15.213 -12.756 1.00 0.00 N ATOM 527 CA ASN B 34 16.678 15.362 -14.234 1.00 0.00 C ATOM 528 C ASN B 34 15.637 16.444 -14.532 1.00 0.00 C ATOM 529 O ASN B 34 14.556 16.171 -15.016 1.00 0.00 O ATOM 530 CB ASN B 34 16.201 13.996 -14.731 1.00 0.00 C ATOM 531 CG ASN B 34 16.886 13.668 -16.061 1.00 0.00 C ATOM 532 OD1 ASN B 34 17.810 12.880 -16.102 1.00 0.00 O ATOM 533 ND2 ASN B 34 16.468 14.242 -17.155 1.00 0.00 N ATOM 0 H ASN B 34 16.459 14.344 -12.367 1.00 0.00 H new ATOM 0 HA ASN B 34 17.606 15.659 -14.723 1.00 0.00 H new ATOM 0 HB2 ASN B 34 16.431 13.228 -13.992 1.00 0.00 H new ATOM 0 HB3 ASN B 34 15.119 14.001 -14.859 1.00 0.00 H new ATOM 0 HD21 ASN B 34 16.917 14.030 -18.046 1.00 0.00 H new ATOM 0 HD22 ASN B 34 15.692 14.903 -17.120 1.00 0.00 H new ATOM 540 N ARG B 35 15.956 17.671 -14.223 1.00 0.00 N ATOM 541 CA ARG B 35 14.994 18.788 -14.457 1.00 0.00 C ATOM 542 C ARG B 35 15.064 19.278 -15.914 1.00 0.00 C ATOM 543 O ARG B 35 14.039 19.481 -16.536 1.00 0.00 O ATOM 544 CB ARG B 35 15.408 19.906 -13.484 1.00 0.00 C ATOM 545 CG ARG B 35 15.869 19.306 -12.146 1.00 0.00 C ATOM 546 CD ARG B 35 15.198 20.039 -10.981 1.00 0.00 C ATOM 547 NE ARG B 35 15.966 21.309 -10.825 1.00 0.00 N ATOM 548 CZ ARG B 35 15.793 22.068 -9.770 1.00 0.00 C ATOM 549 NH1 ARG B 35 14.946 21.729 -8.832 1.00 0.00 N ATOM 550 NH2 ARG B 35 16.475 23.175 -9.652 1.00 0.00 N ATOM 0 H ARG B 35 16.848 17.951 -13.815 1.00 0.00 H new ATOM 0 HA ARG B 35 13.965 18.470 -14.288 1.00 0.00 H new ATOM 0 HB2 ARG B 35 16.212 20.498 -13.921 1.00 0.00 H new ATOM 0 HB3 ARG B 35 14.569 20.581 -13.317 1.00 0.00 H new ATOM 0 HG2 ARG B 35 15.621 18.245 -12.110 1.00 0.00 H new ATOM 0 HG3 ARG B 35 16.953 19.383 -12.058 1.00 0.00 H new ATOM 0 HD2 ARG B 35 14.147 20.237 -11.193 1.00 0.00 H new ATOM 0 HD3 ARG B 35 15.232 19.443 -10.069 1.00 0.00 H new ATOM 0 HE ARG B 35 16.631 21.589 -11.546 1.00 0.00 H new ATOM 0 HH11 ARG B 35 14.411 20.865 -8.916 1.00 0.00 H new ATOM 0 HH12 ARG B 35 14.821 22.329 -8.016 1.00 0.00 H new ATOM 0 HH21 ARG B 35 17.138 23.445 -10.378 1.00 0.00 H new ATOM 0 HH22 ARG B 35 16.345 23.770 -8.834 1.00 0.00 H new ATOM 564 N PRO B 36 16.263 19.462 -16.423 1.00 0.00 N ATOM 565 CA PRO B 36 16.413 19.937 -17.820 1.00 0.00 C ATOM 566 C PRO B 36 16.166 18.790 -18.804 1.00 0.00 C ATOM 567 O PRO B 36 16.347 19.006 -19.991 1.00 0.00 O ATOM 568 CB PRO B 36 17.862 20.408 -17.887 1.00 0.00 C ATOM 569 CG PRO B 36 18.579 19.641 -16.821 1.00 0.00 C ATOM 570 CD PRO B 36 17.566 19.252 -15.773 1.00 0.00 C ATOM 571 OXT PRO B 36 15.803 17.717 -18.354 1.00 0.00 O ATOM 0 HA PRO B 36 15.704 20.722 -18.083 1.00 0.00 H new ATOM 0 HB2 PRO B 36 18.293 20.213 -18.869 1.00 0.00 H new ATOM 0 HB3 PRO B 36 17.934 21.482 -17.714 1.00 0.00 H new ATOM 0 HG2 PRO B 36 19.053 18.754 -17.242 1.00 0.00 H new ATOM 0 HG3 PRO B 36 19.371 20.247 -16.381 1.00 0.00 H new ATOM 0 HD2 PRO B 36 17.693 18.214 -15.465 1.00 0.00 H new ATOM 0 HD3 PRO B 36 17.666 19.865 -14.877 1.00 0.00 H new TER 579 PRO B 36 ATOM 580 P G A 1 12.852 -14.944 -1.344 1.00 1.31 P ATOM 581 OP1 G A 1 12.758 -13.574 -1.911 1.00 1.51 O ATOM 582 OP2 G A 1 14.122 -15.393 -0.720 1.00 1.52 O ATOM 583 O5' G A 1 11.680 -15.121 -0.280 1.00 1.09 O ATOM 584 C5' G A 1 11.913 -14.891 1.122 1.00 1.03 C ATOM 585 C4' G A 1 11.172 -15.916 1.948 1.00 0.94 C ATOM 586 O4' G A 1 11.663 -15.851 3.309 1.00 1.02 O ATOM 587 C3' G A 1 9.680 -15.665 2.083 1.00 0.80 C ATOM 588 O3' G A 1 8.972 -16.246 0.991 1.00 0.75 O ATOM 589 C2' G A 1 9.337 -16.366 3.393 1.00 0.78 C ATOM 590 O2' G A 1 9.079 -17.747 3.226 1.00 0.77 O ATOM 591 C1' G A 1 10.614 -16.164 4.208 1.00 0.90 C ATOM 592 N9 G A 1 10.468 -15.056 5.141 1.00 0.90 N ATOM 593 C8 G A 1 10.951 -13.780 4.997 1.00 0.97 C ATOM 594 N7 G A 1 10.635 -12.999 5.993 1.00 0.99 N ATOM 595 C5 G A 1 9.901 -13.814 6.845 1.00 0.90 C ATOM 596 C6 G A 1 9.289 -13.524 8.087 1.00 0.88 C ATOM 597 O6 G A 1 9.276 -12.456 8.701 1.00 0.94 O ATOM 598 N1 G A 1 8.640 -14.638 8.616 1.00 0.82 N ATOM 599 C2 G A 1 8.593 -15.874 8.016 1.00 0.81 C ATOM 600 N2 G A 1 7.921 -16.830 8.678 1.00 0.83 N ATOM 601 N3 G A 1 9.160 -16.156 6.858 1.00 0.83 N ATOM 602 C4 G A 1 9.792 -15.086 6.333 1.00 0.86 C ATOM 0 H5' G A 1 11.584 -13.888 1.393 1.00 1.03 H new ATOM 0 H5'' G A 1 12.981 -14.945 1.334 1.00 1.03 H new ATOM 0 H4' G A 1 11.335 -16.863 1.434 1.00 0.94 H new ATOM 0 H3' G A 1 9.413 -14.608 2.079 1.00 0.80 H new ATOM 0 H2' G A 1 8.431 -15.970 3.851 1.00 0.78 H new ATOM 0 HO2' G A 1 8.959 -17.944 2.274 1.00 0.77 H new ATOM 0 H1' G A 1 10.823 -17.073 4.772 1.00 0.90 H new ATOM 0 H8 G A 1 11.533 -13.456 4.147 1.00 0.97 H new ATOM 0 H1 G A 1 8.166 -14.528 9.512 1.00 0.82 H new ATOM 0 H21 G A 1 7.850 -17.769 8.285 1.00 0.83 H new ATOM 0 H22 G A 1 7.482 -16.617 9.574 1.00 0.83 H new ATOM 614 P C A 2 7.376 -16.088 0.899 1.00 0.69 P ATOM 615 OP1 C A 2 6.864 -17.083 -0.077 1.00 0.84 O ATOM 616 OP2 C A 2 7.085 -14.646 0.699 1.00 0.82 O ATOM 617 O5' C A 2 6.864 -16.501 2.351 1.00 0.58 O ATOM 618 C5' C A 2 6.267 -17.790 2.584 1.00 0.57 C ATOM 619 C4' C A 2 5.049 -17.647 3.467 1.00 0.55 C ATOM 620 O4' C A 2 5.480 -17.213 4.780 1.00 0.54 O ATOM 621 C3' C A 2 4.074 -16.569 3.027 1.00 0.51 C ATOM 622 O3' C A 2 3.151 -17.088 2.073 1.00 0.59 O ATOM 623 C2' C A 2 3.367 -16.203 4.327 1.00 0.53 C ATOM 624 O2' C A 2 2.259 -17.040 4.602 1.00 0.67 O ATOM 625 C1' C A 2 4.463 -16.429 5.374 1.00 0.51 C ATOM 626 N1 C A 2 5.071 -15.177 5.848 1.00 0.45 N ATOM 627 C2 C A 2 4.707 -14.703 7.107 1.00 0.44 C ATOM 628 O2 C A 2 3.889 -15.352 7.774 1.00 0.49 O ATOM 629 N3 C A 2 5.252 -13.554 7.566 1.00 0.43 N ATOM 630 C4 C A 2 6.129 -12.887 6.815 1.00 0.45 C ATOM 631 N4 C A 2 6.642 -11.757 7.310 1.00 0.49 N ATOM 632 C5 C A 2 6.519 -13.348 5.524 1.00 0.47 C ATOM 633 C6 C A 2 5.970 -14.489 5.082 1.00 0.46 C ATOM 0 H5' C A 2 6.991 -18.455 3.055 1.00 0.57 H new ATOM 0 H5'' C A 2 5.986 -18.246 1.635 1.00 0.57 H new ATOM 0 H4' C A 2 4.558 -18.620 3.433 1.00 0.55 H new ATOM 0 H3' C A 2 4.553 -15.718 2.544 1.00 0.51 H new ATOM 0 H2' C A 2 2.958 -15.193 4.302 1.00 0.53 H new ATOM 0 HO2' C A 2 2.076 -17.607 3.824 1.00 0.67 H new ATOM 0 H1' C A 2 4.004 -16.918 6.233 1.00 0.51 H new ATOM 0 H41 C A 2 7.316 -11.220 6.764 1.00 0.49 H new ATOM 0 H42 C A 2 6.360 -11.431 8.234 1.00 0.49 H new ATOM 0 H5 C A 2 7.230 -12.799 4.924 1.00 0.47 H new ATOM 0 H6 C A 2 6.242 -14.869 4.108 1.00 0.46 H new ATOM 645 P C A 3 2.022 -16.128 1.451 1.00 0.67 P ATOM 646 OP1 C A 3 0.712 -16.801 1.640 1.00 1.00 O ATOM 647 OP2 C A 3 2.451 -15.726 0.088 1.00 1.20 O ATOM 648 O5' C A 3 2.056 -14.840 2.387 1.00 0.89 O ATOM 649 C5' C A 3 0.999 -13.862 2.344 1.00 0.68 C ATOM 650 C4' C A 3 0.361 -13.728 3.705 1.00 0.61 C ATOM 651 O4' C A 3 1.418 -13.762 4.695 1.00 0.67 O ATOM 652 C3' C A 3 -0.335 -12.399 3.936 1.00 0.56 C ATOM 653 O3' C A 3 -1.693 -12.445 3.474 1.00 0.57 O ATOM 654 C2' C A 3 -0.222 -12.203 5.445 1.00 0.57 C ATOM 655 O2' C A 3 -1.250 -12.823 6.191 1.00 0.64 O ATOM 656 C1' C A 3 1.107 -12.888 5.763 1.00 0.62 C ATOM 657 N1 C A 3 2.212 -11.926 5.890 1.00 0.61 N ATOM 658 C2 C A 3 2.264 -11.106 7.018 1.00 0.56 C ATOM 659 O2 C A 3 1.379 -11.216 7.879 1.00 0.55 O ATOM 660 N3 C A 3 3.276 -10.215 7.143 1.00 0.58 N ATOM 661 C4 C A 3 4.208 -10.129 6.192 1.00 0.65 C ATOM 662 N4 C A 3 5.188 -9.237 6.356 1.00 0.71 N ATOM 663 C5 C A 3 4.178 -10.954 5.031 1.00 0.71 C ATOM 664 C6 C A 3 3.171 -11.831 4.919 1.00 0.68 C ATOM 0 H5' C A 3 0.249 -14.157 1.610 1.00 0.68 H new ATOM 0 H5'' C A 3 1.397 -12.899 2.024 1.00 0.68 H new ATOM 0 H4' C A 3 -0.371 -14.533 3.775 1.00 0.61 H new ATOM 0 H3' C A 3 0.106 -11.568 3.387 1.00 0.56 H new ATOM 0 H2' C A 3 -0.293 -11.148 5.708 1.00 0.57 H new ATOM 0 HO2' C A 3 -1.329 -13.762 5.921 1.00 0.64 H new ATOM 0 H1' C A 3 0.997 -13.413 6.712 1.00 0.62 H new ATOM 0 H41 C A 3 5.917 -9.145 5.649 1.00 0.71 H new ATOM 0 H42 C A 3 5.207 -8.648 7.189 1.00 0.71 H new ATOM 0 H5 C A 3 4.939 -10.875 4.269 1.00 0.71 H new ATOM 0 H6 C A 3 3.116 -12.471 4.051 1.00 0.68 H new ATOM 676 P C A 4 -2.828 -13.170 4.352 1.00 0.57 P ATOM 677 OP1 C A 4 -2.199 -14.326 5.042 1.00 0.60 O ATOM 678 OP2 C A 4 -4.006 -13.397 3.477 1.00 0.73 O ATOM 679 O5' C A 4 -3.230 -12.071 5.434 1.00 0.61 O ATOM 680 C5' C A 4 -3.280 -10.675 5.079 1.00 0.51 C ATOM 681 C4' C A 4 -3.323 -9.814 6.318 1.00 0.47 C ATOM 682 O4' C A 4 -2.052 -9.932 7.004 1.00 0.55 O ATOM 683 C3' C A 4 -3.465 -8.330 6.032 1.00 0.45 C ATOM 684 O3' C A 4 -4.846 -7.981 5.888 1.00 0.51 O ATOM 685 C2' C A 4 -2.794 -7.676 7.238 1.00 0.47 C ATOM 686 O2' C A 4 -3.648 -7.491 8.350 1.00 0.57 O ATOM 687 C1' C A 4 -1.709 -8.690 7.594 1.00 0.48 C ATOM 688 N1 C A 4 -0.384 -8.303 7.088 1.00 0.43 N ATOM 689 C2 C A 4 0.337 -7.304 7.751 1.00 0.39 C ATOM 690 O2 C A 4 -0.162 -6.760 8.748 1.00 0.43 O ATOM 691 N3 C A 4 1.557 -6.957 7.286 1.00 0.38 N ATOM 692 C4 C A 4 2.055 -7.566 6.210 1.00 0.45 C ATOM 693 N4 C A 4 3.257 -7.198 5.784 1.00 0.51 N ATOM 694 C5 C A 4 1.343 -8.581 5.519 1.00 0.51 C ATOM 695 C6 C A 4 0.139 -8.915 5.984 1.00 0.48 C ATOM 0 H5' C A 4 -4.159 -10.482 4.464 1.00 0.51 H new ATOM 0 H5'' C A 4 -2.408 -10.415 4.479 1.00 0.51 H new ATOM 0 H4' C A 4 -4.186 -10.160 6.887 1.00 0.47 H new ATOM 0 H3' C A 4 -3.006 -8.005 5.098 1.00 0.45 H new ATOM 0 H2' C A 4 -2.446 -6.671 6.998 1.00 0.47 H new ATOM 0 HO2' C A 4 -4.071 -8.344 8.583 1.00 0.57 H new ATOM 0 H1' C A 4 -1.653 -8.746 8.681 1.00 0.48 H new ATOM 0 H41 C A 4 3.666 -7.645 4.963 1.00 0.51 H new ATOM 0 H42 C A 4 3.772 -6.468 6.277 1.00 0.51 H new ATOM 0 H5 C A 4 1.761 -9.065 4.649 1.00 0.51 H new ATOM 0 H6 C A 4 -0.432 -9.681 5.480 1.00 0.48 H new ATOM 707 P U A 5 -5.802 -7.886 7.177 1.00 0.57 P ATOM 708 OP1 U A 5 -5.312 -8.836 8.208 1.00 0.77 O ATOM 709 OP2 U A 5 -7.202 -7.990 6.694 1.00 0.62 O ATOM 710 O5' U A 5 -5.572 -6.396 7.688 1.00 0.49 O ATOM 711 C5' U A 5 -4.848 -5.451 6.877 1.00 0.45 C ATOM 712 C4' U A 5 -4.216 -4.391 7.745 1.00 0.41 C ATOM 713 O4' U A 5 -2.871 -4.814 8.064 1.00 0.47 O ATOM 714 C3' U A 5 -4.013 -3.047 7.067 1.00 0.35 C ATOM 715 O3' U A 5 -5.199 -2.257 7.173 1.00 0.36 O ATOM 716 C2' U A 5 -2.869 -2.439 7.870 1.00 0.41 C ATOM 717 O2' U A 5 -3.312 -1.745 9.021 1.00 0.50 O ATOM 718 C1' U A 5 -2.066 -3.675 8.283 1.00 0.43 C ATOM 719 N1 U A 5 -0.826 -3.833 7.513 1.00 0.43 N ATOM 720 C2 U A 5 0.195 -2.955 7.787 1.00 0.40 C ATOM 721 O2 U A 5 0.093 -2.069 8.622 1.00 0.39 O ATOM 722 N3 U A 5 1.336 -3.147 7.052 1.00 0.43 N ATOM 723 C4 U A 5 1.551 -4.104 6.088 1.00 0.50 C ATOM 724 O4 U A 5 2.640 -4.145 5.511 1.00 0.54 O ATOM 725 C5 U A 5 0.443 -4.978 5.860 1.00 0.55 C ATOM 726 C6 U A 5 -0.686 -4.818 6.561 1.00 0.51 C ATOM 0 H5' U A 5 -5.523 -4.987 6.158 1.00 0.45 H new ATOM 0 H5'' U A 5 -4.078 -5.968 6.304 1.00 0.45 H new ATOM 0 H4' U A 5 -4.896 -4.275 8.589 1.00 0.41 H new ATOM 0 H3' U A 5 -3.796 -3.115 6.001 1.00 0.35 H new ATOM 0 H2' U A 5 -2.312 -1.699 7.295 1.00 0.41 H new ATOM 0 HO2' U A 5 -4.290 -1.784 9.070 1.00 0.50 H new ATOM 0 H1' U A 5 -1.790 -3.557 9.331 1.00 0.43 H new ATOM 0 H3 U A 5 2.110 -2.510 7.241 1.00 0.43 H new ATOM 0 H5 U A 5 0.517 -5.765 5.124 1.00 0.55 H new ATOM 0 H6 U A 5 -1.515 -5.484 6.374 1.00 0.51 H new ATOM 737 P G A 6 -5.094 -0.652 7.229 1.00 0.43 P ATOM 738 OP1 G A 6 -5.138 -0.252 8.658 1.00 0.54 O ATOM 739 OP2 G A 6 -6.087 -0.089 6.280 1.00 0.65 O ATOM 740 O5' G A 6 -3.637 -0.335 6.668 1.00 0.43 O ATOM 741 C5' G A 6 -2.750 0.566 7.363 1.00 0.47 C ATOM 742 C4' G A 6 -1.944 1.368 6.368 1.00 0.47 C ATOM 743 O4' G A 6 -0.607 0.814 6.282 1.00 0.53 O ATOM 744 C3' G A 6 -2.457 1.279 4.943 1.00 0.39 C ATOM 745 O3' G A 6 -3.484 2.241 4.724 1.00 0.41 O ATOM 746 C2' G A 6 -1.218 1.600 4.117 1.00 0.48 C ATOM 747 O2' G A 6 -1.037 2.989 3.915 1.00 0.59 O ATOM 748 C1' G A 6 -0.086 1.043 4.983 1.00 0.49 C ATOM 749 N9 G A 6 0.438 -0.220 4.472 1.00 0.50 N ATOM 750 C8 G A 6 -0.216 -1.427 4.432 1.00 0.60 C ATOM 751 N7 G A 6 0.503 -2.383 3.912 1.00 0.63 N ATOM 752 C5 G A 6 1.708 -1.773 3.591 1.00 0.54 C ATOM 753 C6 G A 6 2.881 -2.309 2.994 1.00 0.55 C ATOM 754 O6 G A 6 3.094 -3.470 2.621 1.00 0.61 O ATOM 755 N1 G A 6 3.872 -1.342 2.842 1.00 0.55 N ATOM 756 C2 G A 6 3.745 -0.025 3.218 1.00 0.57 C ATOM 757 N2 G A 6 4.811 0.763 2.993 1.00 0.70 N ATOM 758 N3 G A 6 2.657 0.485 3.775 1.00 0.53 N ATOM 759 C4 G A 6 1.686 -0.438 3.931 1.00 0.49 C ATOM 0 H5' G A 6 -2.082 0.002 8.014 1.00 0.47 H new ATOM 0 H5'' G A 6 -3.326 1.236 8.001 1.00 0.47 H new ATOM 0 H4' G A 6 -1.998 2.396 6.728 1.00 0.47 H new ATOM 0 H3' G A 6 -2.897 0.313 4.694 1.00 0.39 H new ATOM 0 H2' G A 6 -1.274 1.177 3.114 1.00 0.48 H new ATOM 0 HO2' G A 6 -0.153 3.150 3.523 1.00 0.59 H new ATOM 0 H1' G A 6 0.730 1.766 4.983 1.00 0.49 H new ATOM 0 H8 G A 6 -1.223 -1.570 4.794 1.00 0.60 H new ATOM 0 H1 G A 6 4.755 -1.631 2.422 1.00 0.55 H new ATOM 0 H21 G A 6 4.779 1.750 3.250 1.00 0.70 H new ATOM 0 H22 G A 6 5.652 0.374 2.566 1.00 0.70 H new ATOM 771 P A A 7 -4.420 2.121 3.424 1.00 0.43 P ATOM 772 OP1 A A 7 -5.497 3.136 3.554 1.00 0.74 O ATOM 773 OP2 A A 7 -4.778 0.692 3.237 1.00 0.66 O ATOM 774 O5' A A 7 -3.466 2.558 2.227 1.00 0.33 O ATOM 775 C5' A A 7 -3.613 1.982 0.917 1.00 0.29 C ATOM 776 C4' A A 7 -2.379 2.239 0.095 1.00 0.23 C ATOM 777 O4' A A 7 -2.267 3.669 -0.102 1.00 0.23 O ATOM 778 C3' A A 7 -1.055 1.889 0.745 1.00 0.25 C ATOM 779 O3' A A 7 -0.750 0.492 0.668 1.00 0.27 O ATOM 780 C2' A A 7 -0.080 2.766 -0.039 1.00 0.24 C ATOM 781 O2' A A 7 0.292 2.223 -1.287 1.00 0.25 O ATOM 782 C1' A A 7 -0.911 4.017 -0.277 1.00 0.21 C ATOM 783 N9 A A 7 -0.550 5.048 0.694 1.00 0.24 N ATOM 784 C8 A A 7 -1.187 5.379 1.864 1.00 0.29 C ATOM 785 N7 A A 7 -0.596 6.337 2.535 1.00 0.33 N ATOM 786 C5 A A 7 0.506 6.659 1.753 1.00 0.30 C ATOM 787 C6 A A 7 1.540 7.598 1.914 1.00 0.34 C ATOM 788 N6 A A 7 1.635 8.424 2.958 1.00 0.39 N ATOM 789 N1 A A 7 2.486 7.658 0.951 1.00 0.35 N ATOM 790 C2 A A 7 2.390 6.827 -0.095 1.00 0.32 C ATOM 791 N3 A A 7 1.469 5.906 -0.356 1.00 0.27 N ATOM 792 C4 A A 7 0.545 5.873 0.618 1.00 0.25 C ATOM 0 H5' A A 7 -4.485 2.408 0.420 1.00 0.29 H new ATOM 0 H5'' A A 7 -3.786 0.909 1.001 1.00 0.29 H new ATOM 0 H4' A A 7 -2.517 1.620 -0.791 1.00 0.23 H new ATOM 0 H3' A A 7 -1.031 2.073 1.819 1.00 0.25 H new ATOM 0 H2' A A 7 0.858 2.905 0.499 1.00 0.24 H new ATOM 0 HO2' A A 7 1.182 2.551 -1.534 1.00 0.25 H new ATOM 0 H1' A A 7 -0.733 4.404 -1.281 1.00 0.21 H new ATOM 0 H8 A A 7 -2.092 4.895 2.200 1.00 0.29 H new ATOM 0 H61 A A 7 2.410 9.084 3.017 1.00 0.39 H new ATOM 0 H62 A A 7 0.932 8.395 3.697 1.00 0.39 H new ATOM 0 H2 A A 7 3.174 6.919 -0.832 1.00 0.32 H new ATOM 804 P A A 8 -0.596 -0.231 -0.754 1.00 0.37 P ATOM 805 OP1 A A 8 -1.775 0.139 -1.574 1.00 0.47 O ATOM 806 OP2 A A 8 -0.302 -1.664 -0.502 1.00 0.44 O ATOM 807 O5' A A 8 0.720 0.425 -1.363 1.00 0.38 O ATOM 808 C5' A A 8 2.014 -0.068 -0.996 1.00 0.39 C ATOM 809 C4' A A 8 3.032 1.045 -1.001 1.00 0.43 C ATOM 810 O4' A A 8 2.452 2.234 -0.414 1.00 0.37 O ATOM 811 C3' A A 8 4.232 0.754 -0.119 1.00 0.53 C ATOM 812 O3' A A 8 5.231 0.008 -0.818 1.00 0.66 O ATOM 813 C2' A A 8 4.743 2.144 0.240 1.00 0.50 C ATOM 814 O2' A A 8 5.627 2.668 -0.731 1.00 0.58 O ATOM 815 C1' A A 8 3.455 2.969 0.264 1.00 0.38 C ATOM 816 N9 A A 8 2.976 3.242 1.618 1.00 0.36 N ATOM 817 C8 A A 8 1.971 2.598 2.295 1.00 0.42 C ATOM 818 N7 A A 8 1.755 3.075 3.498 1.00 0.47 N ATOM 819 C5 A A 8 2.682 4.101 3.621 1.00 0.41 C ATOM 820 C6 A A 8 2.966 5.000 4.664 1.00 0.44 C ATOM 821 N6 A A 8 2.316 5.011 5.830 1.00 0.54 N ATOM 822 N1 A A 8 3.954 5.898 4.467 1.00 0.40 N ATOM 823 C2 A A 8 4.606 5.888 3.297 1.00 0.36 C ATOM 824 N3 A A 8 4.430 5.095 2.242 1.00 0.35 N ATOM 825 C4 A A 8 3.441 4.214 2.471 1.00 0.35 C ATOM 0 H5' A A 8 2.320 -0.850 -1.690 1.00 0.39 H new ATOM 0 H5'' A A 8 1.968 -0.521 -0.006 1.00 0.39 H new ATOM 0 H4' A A 8 3.332 1.159 -2.043 1.00 0.43 H new ATOM 0 H3' A A 8 3.978 0.148 0.751 1.00 0.53 H new ATOM 0 H2' A A 8 5.310 2.146 1.171 1.00 0.50 H new ATOM 0 HO2' A A 8 5.186 2.674 -1.606 1.00 0.58 H new ATOM 0 H1' A A 8 3.668 3.927 -0.211 1.00 0.38 H new ATOM 0 H8 A A 8 1.410 1.775 1.877 1.00 0.42 H new ATOM 0 H61 A A 8 2.569 5.689 6.549 1.00 0.54 H new ATOM 0 H62 A A 8 1.566 4.341 6.002 1.00 0.54 H new ATOM 0 H2 A A 8 5.385 6.629 3.195 1.00 0.36 H new ATOM 837 P A A 9 5.259 0.013 -2.426 1.00 1.47 P ATOM 838 OP1 A A 9 5.353 1.420 -2.884 1.00 2.35 O ATOM 839 OP2 A A 9 4.138 -0.839 -2.896 1.00 2.33 O ATOM 840 O5' A A 9 6.624 -0.725 -2.785 1.00 1.08 O ATOM 841 C5' A A 9 7.760 -0.634 -1.910 1.00 1.04 C ATOM 842 C4' A A 9 8.595 0.568 -2.267 1.00 1.09 C ATOM 843 O4' A A 9 8.090 1.126 -3.505 1.00 1.26 O ATOM 844 C3' A A 9 8.491 1.715 -1.281 1.00 0.99 C ATOM 845 O3' A A 9 9.416 1.549 -0.214 1.00 1.17 O ATOM 846 C2' A A 9 8.842 2.926 -2.136 1.00 1.26 C ATOM 847 O2' A A 9 10.238 3.129 -2.245 1.00 1.57 O ATOM 848 C1' A A 9 8.266 2.531 -3.499 1.00 1.29 C ATOM 849 N9 A A 9 6.960 3.141 -3.752 1.00 0.00 N ATOM 850 C8 A A 9 6.274 4.014 -2.949 1.00 0.00 C ATOM 851 N7 A A 9 5.123 4.397 -3.446 1.00 0.00 N ATOM 852 C5 A A 9 5.045 3.725 -4.657 1.00 0.00 C ATOM 853 C6 A A 9 4.064 3.697 -5.660 1.00 0.00 C ATOM 854 N6 A A 9 2.929 4.397 -5.604 1.00 0.00 N ATOM 855 N1 A A 9 4.289 2.915 -6.738 1.00 0.00 N ATOM 856 C2 A A 9 5.428 2.214 -6.791 1.00 0.00 C ATOM 857 N3 A A 9 6.426 2.159 -5.915 1.00 0.00 N ATOM 858 C4 A A 9 6.170 2.946 -4.858 1.00 0.00 C ATOM 0 H5' A A 9 8.361 -1.540 -1.987 1.00 1.04 H new ATOM 0 H5'' A A 9 7.426 -0.560 -0.875 1.00 1.04 H new ATOM 0 H4' A A 9 9.622 0.205 -2.302 1.00 1.09 H new ATOM 0 H3' A A 9 7.513 1.796 -0.806 1.00 0.99 H new ATOM 0 H2' A A 9 8.453 3.856 -1.721 1.00 1.26 H new ATOM 0 HO2' A A 9 10.699 2.615 -1.550 1.00 1.57 H new ATOM 0 H1' A A 9 8.958 2.874 -4.269 1.00 1.29 H new ATOM 0 H8 A A 9 6.647 4.355 -1.995 1.00 0.00 H new ATOM 0 H61 A A 9 2.253 4.335 -6.366 1.00 0.00 H new ATOM 0 H62 A A 9 2.737 4.994 -4.799 1.00 0.00 H new ATOM 0 H2 A A 9 5.554 1.605 -7.674 1.00 0.00 H new ATOM 870 P A A 10 8.968 0.764 1.116 1.00 1.33 P ATOM 871 OP1 A A 10 9.476 -0.628 1.025 1.00 2.11 O ATOM 872 OP2 A A 10 7.509 1.004 1.331 1.00 2.10 O ATOM 873 O5' A A 10 9.769 1.508 2.275 1.00 0.79 O ATOM 874 C5' A A 10 9.316 1.441 3.634 1.00 0.59 C ATOM 875 C4' A A 10 9.327 2.815 4.260 1.00 0.54 C ATOM 876 O4' A A 10 8.048 3.441 4.007 1.00 0.50 O ATOM 877 C3' A A 10 9.456 2.797 5.771 1.00 0.50 C ATOM 878 O3' A A 10 10.826 2.802 6.163 1.00 0.61 O ATOM 879 C2' A A 10 8.732 4.064 6.207 1.00 0.50 C ATOM 880 O2' A A 10 9.572 5.203 6.197 1.00 0.61 O ATOM 881 C1' A A 10 7.650 4.204 5.132 1.00 0.48 C ATOM 882 N9 A A 10 6.369 3.661 5.568 1.00 0.45 N ATOM 883 C8 A A 10 5.701 2.606 5.004 1.00 0.45 C ATOM 884 N7 A A 10 4.571 2.315 5.599 1.00 0.51 N ATOM 885 C5 A A 10 4.489 3.244 6.628 1.00 0.54 C ATOM 886 C6 A A 10 3.528 3.464 7.631 1.00 0.64 C ATOM 887 N6 A A 10 2.417 2.736 7.764 1.00 0.72 N ATOM 888 N1 A A 10 3.752 4.470 8.504 1.00 0.69 N ATOM 889 C2 A A 10 4.867 5.199 8.370 1.00 0.66 C ATOM 890 N3 A A 10 5.844 5.088 7.472 1.00 0.58 N ATOM 891 C4 A A 10 5.590 4.080 6.619 1.00 0.51 C ATOM 0 H5' A A 10 9.957 0.769 4.205 1.00 0.59 H new ATOM 0 H5'' A A 10 8.308 1.027 3.668 1.00 0.59 H new ATOM 0 H4' A A 10 10.183 3.334 3.828 1.00 0.54 H new ATOM 0 H3' A A 10 9.033 1.903 6.230 1.00 0.50 H new ATOM 0 H2' A A 10 8.360 3.998 7.229 1.00 0.50 H new ATOM 0 HO2' A A 10 10.509 4.919 6.244 1.00 0.61 H new ATOM 0 H1' A A 10 7.535 5.266 4.913 1.00 0.48 H new ATOM 0 H8 A A 10 6.072 2.064 4.147 1.00 0.45 H new ATOM 0 H61 A A 10 1.757 2.945 8.513 1.00 0.72 H new ATOM 0 H62 A A 10 2.228 1.971 7.116 1.00 0.72 H new ATOM 0 H2 A A 10 4.992 5.991 9.094 1.00 0.66 H new ATOM 903 P A A 11 11.214 2.558 7.704 1.00 0.62 P ATOM 904 OP1 A A 11 12.108 3.660 8.140 1.00 0.77 O ATOM 905 OP2 A A 11 11.670 1.150 7.830 1.00 0.65 O ATOM 906 O5' A A 11 9.828 2.700 8.478 1.00 0.58 O ATOM 907 C5' A A 11 9.628 3.746 9.447 1.00 0.56 C ATOM 908 C4' A A 11 8.263 3.614 10.084 1.00 0.49 C ATOM 909 O4' A A 11 7.289 3.369 9.040 1.00 0.46 O ATOM 910 C3' A A 11 8.116 2.433 11.031 1.00 0.47 C ATOM 911 O3' A A 11 8.537 2.814 12.345 1.00 0.51 O ATOM 912 C2' A A 11 6.622 2.131 10.965 1.00 0.43 C ATOM 913 O2' A A 11 5.861 2.922 11.857 1.00 0.47 O ATOM 914 C1' A A 11 6.269 2.517 9.526 1.00 0.42 C ATOM 915 N9 A A 11 6.183 1.375 8.615 1.00 0.41 N ATOM 916 C8 A A 11 7.148 0.927 7.748 1.00 0.46 C ATOM 917 N7 A A 11 6.772 -0.100 7.025 1.00 0.47 N ATOM 918 C5 A A 11 5.475 -0.350 7.449 1.00 0.42 C ATOM 919 C6 A A 11 4.522 -1.314 7.071 1.00 0.43 C ATOM 920 N6 A A 11 4.728 -2.251 6.136 1.00 0.49 N ATOM 921 N1 A A 11 3.325 -1.286 7.695 1.00 0.40 N ATOM 922 C2 A A 11 3.106 -0.356 8.628 1.00 0.37 C ATOM 923 N3 A A 11 3.917 0.602 9.070 1.00 0.37 N ATOM 924 C4 A A 11 5.100 0.549 8.432 1.00 0.39 C ATOM 0 H5' A A 11 9.720 4.720 8.966 1.00 0.56 H new ATOM 0 H5'' A A 11 10.401 3.695 10.213 1.00 0.56 H new ATOM 0 H4' A A 11 8.119 4.538 10.643 1.00 0.49 H new ATOM 0 H3' A A 11 8.721 1.564 10.772 1.00 0.47 H new ATOM 0 H2' A A 11 6.406 1.098 11.237 1.00 0.43 H new ATOM 0 HO2' A A 11 5.891 2.526 12.753 1.00 0.47 H new ATOM 0 H1' A A 11 5.288 2.990 9.555 1.00 0.42 H new ATOM 0 H8 A A 11 8.126 1.378 7.669 1.00 0.46 H new ATOM 0 H61 A A 11 3.991 -2.919 5.913 1.00 0.49 H new ATOM 0 H62 A A 11 5.622 -2.296 5.648 1.00 0.49 H new ATOM 0 H2 A A 11 2.130 -0.386 9.090 1.00 0.37 H new ATOM 936 P G A 12 7.966 2.044 13.642 1.00 0.56 P ATOM 937 OP1 G A 12 6.528 1.775 13.419 1.00 0.68 O ATOM 938 OP2 G A 12 8.381 2.820 14.837 1.00 0.65 O ATOM 939 O5' G A 12 8.769 0.665 13.679 1.00 0.50 O ATOM 940 C5' G A 12 8.305 -0.517 12.981 1.00 0.47 C ATOM 941 C4' G A 12 6.801 -0.630 13.061 1.00 0.42 C ATOM 942 O4' G A 12 6.278 -0.428 11.727 1.00 0.40 O ATOM 943 C3' G A 12 6.274 -1.997 13.456 1.00 0.39 C ATOM 944 O3' G A 12 6.198 -2.120 14.873 1.00 0.43 O ATOM 945 C2' G A 12 4.886 -2.014 12.826 1.00 0.35 C ATOM 946 O2' G A 12 3.909 -1.395 13.641 1.00 0.37 O ATOM 947 C1' G A 12 5.101 -1.193 11.552 1.00 0.35 C ATOM 948 N9 G A 12 5.300 -2.046 10.386 1.00 0.33 N ATOM 949 C8 G A 12 6.399 -2.075 9.564 1.00 0.36 C ATOM 950 N7 G A 12 6.296 -2.952 8.604 1.00 0.36 N ATOM 951 C5 G A 12 5.054 -3.537 8.805 1.00 0.33 C ATOM 952 C6 G A 12 4.393 -4.554 8.077 1.00 0.36 C ATOM 953 O6 G A 12 4.789 -5.163 7.077 1.00 0.40 O ATOM 954 N1 G A 12 3.144 -4.848 8.617 1.00 0.36 N ATOM 955 C2 G A 12 2.608 -4.239 9.726 1.00 0.34 C ATOM 956 N2 G A 12 1.390 -4.664 10.099 1.00 0.37 N ATOM 957 N3 G A 12 3.215 -3.288 10.415 1.00 0.31 N ATOM 958 C4 G A 12 4.426 -2.988 9.901 1.00 0.31 C ATOM 0 H5' G A 12 8.765 -1.405 13.415 1.00 0.47 H new ATOM 0 H5'' G A 12 8.616 -0.474 11.937 1.00 0.47 H new ATOM 0 H4' G A 12 6.498 0.095 13.816 1.00 0.42 H new ATOM 0 H3' G A 12 6.907 -2.821 13.126 1.00 0.39 H new ATOM 0 H2' G A 12 4.516 -3.026 12.665 1.00 0.35 H new ATOM 0 HO2' G A 12 4.223 -1.374 14.569 1.00 0.37 H new ATOM 0 H1' G A 12 4.219 -0.575 11.385 1.00 0.35 H new ATOM 0 H8 G A 12 7.260 -1.437 9.698 1.00 0.36 H new ATOM 0 H1 G A 12 2.587 -5.567 8.156 1.00 0.36 H new ATOM 0 H21 G A 12 0.934 -4.254 10.914 1.00 0.37 H new ATOM 0 H22 G A 12 0.921 -5.397 9.567 1.00 0.37 H new ATOM 970 P G A 13 6.891 -3.375 15.601 1.00 0.51 P ATOM 971 OP1 G A 13 7.249 -2.948 16.978 1.00 0.59 O ATOM 972 OP2 G A 13 7.945 -3.912 14.703 1.00 0.57 O ATOM 973 O5' G A 13 5.724 -4.454 15.706 1.00 0.57 O ATOM 974 C5' G A 13 4.488 -4.142 16.374 1.00 0.62 C ATOM 975 C4' G A 13 3.408 -5.102 15.950 1.00 0.60 C ATOM 976 O4' G A 13 3.059 -4.815 14.573 1.00 0.59 O ATOM 977 C3' G A 13 3.832 -6.556 15.939 1.00 0.59 C ATOM 978 O3' G A 13 3.635 -7.146 17.220 1.00 0.66 O ATOM 979 C2' G A 13 2.895 -7.167 14.905 1.00 0.57 C ATOM 980 O2' G A 13 1.650 -7.559 15.454 1.00 0.63 O ATOM 981 C1' G A 13 2.697 -6.016 13.918 1.00 0.54 C ATOM 982 N9 G A 13 3.535 -6.157 12.733 1.00 0.50 N ATOM 983 C8 G A 13 4.678 -5.458 12.434 1.00 0.54 C ATOM 984 N7 G A 13 5.212 -5.813 11.297 1.00 0.56 N ATOM 985 C5 G A 13 4.371 -6.809 10.820 1.00 0.50 C ATOM 986 C6 G A 13 4.439 -7.576 9.629 1.00 0.53 C ATOM 987 O6 G A 13 5.284 -7.526 8.727 1.00 0.60 O ATOM 988 N1 G A 13 3.382 -8.478 9.536 1.00 0.51 N ATOM 989 C2 G A 13 2.389 -8.620 10.477 1.00 0.48 C ATOM 990 N2 G A 13 1.454 -9.545 10.215 1.00 0.52 N ATOM 991 N3 G A 13 2.316 -7.913 11.591 1.00 0.47 N ATOM 992 C4 G A 13 3.332 -7.032 11.696 1.00 0.47 C ATOM 0 H5' G A 13 4.188 -3.120 16.140 1.00 0.62 H new ATOM 0 H5'' G A 13 4.627 -4.194 17.454 1.00 0.62 H new ATOM 0 H4' G A 13 2.601 -4.969 16.671 1.00 0.60 H new ATOM 0 H3' G A 13 4.887 -6.704 15.706 1.00 0.59 H new ATOM 0 H2' G A 13 3.304 -8.078 14.468 1.00 0.57 H new ATOM 0 HO2' G A 13 1.661 -7.418 16.424 1.00 0.63 H new ATOM 0 H1' G A 13 1.655 -6.015 13.597 1.00 0.54 H new ATOM 0 H8 G A 13 5.093 -4.693 13.074 1.00 0.54 H new ATOM 0 H1 G A 13 3.341 -9.076 8.711 1.00 0.51 H new ATOM 0 H21 G A 13 0.690 -9.699 10.873 1.00 0.52 H new ATOM 0 H22 G A 13 1.506 -10.094 9.357 1.00 0.52 H new ATOM 1004 P G A 14 4.786 -8.069 17.857 1.00 0.74 P ATOM 1005 OP1 G A 14 4.792 -7.826 19.321 1.00 0.80 O ATOM 1006 OP2 G A 14 6.032 -7.866 17.075 1.00 0.90 O ATOM 1007 O5' G A 14 4.271 -9.555 17.604 1.00 0.68 O ATOM 1008 C5' G A 14 2.909 -9.923 17.890 1.00 0.70 C ATOM 1009 C4' G A 14 2.517 -11.140 17.083 1.00 0.68 C ATOM 1010 O4' G A 14 2.220 -10.725 15.726 1.00 0.67 O ATOM 1011 C3' G A 14 3.614 -12.169 16.901 1.00 0.67 C ATOM 1012 O3' G A 14 3.685 -13.039 18.024 1.00 0.77 O ATOM 1013 C2' G A 14 3.153 -12.911 15.652 1.00 0.67 C ATOM 1014 O2' G A 14 2.192 -13.910 15.930 1.00 0.80 O ATOM 1015 C1' G A 14 2.509 -11.788 14.836 1.00 0.61 C ATOM 1016 N9 G A 14 3.403 -11.285 13.797 1.00 0.50 N ATOM 1017 C8 G A 14 4.169 -10.146 13.833 1.00 0.50 C ATOM 1018 N7 G A 14 4.881 -9.975 12.753 1.00 0.47 N ATOM 1019 C5 G A 14 4.562 -11.065 11.955 1.00 0.41 C ATOM 1020 C6 G A 14 5.025 -11.425 10.661 1.00 0.40 C ATOM 1021 O6 G A 14 5.835 -10.829 9.941 1.00 0.45 O ATOM 1022 N1 G A 14 4.444 -12.612 10.218 1.00 0.41 N ATOM 1023 C2 G A 14 3.536 -13.354 10.937 1.00 0.46 C ATOM 1024 N2 G A 14 3.084 -14.469 10.350 1.00 0.55 N ATOM 1025 N3 G A 14 3.100 -13.029 12.141 1.00 0.49 N ATOM 1026 C4 G A 14 3.650 -11.881 12.585 1.00 0.44 C ATOM 0 H5' G A 14 2.243 -9.092 17.656 1.00 0.70 H new ATOM 0 H5'' G A 14 2.797 -10.131 18.954 1.00 0.70 H new ATOM 0 H4' G A 14 1.688 -11.579 17.639 1.00 0.68 H new ATOM 0 H3' G A 14 4.612 -11.741 16.809 1.00 0.67 H new ATOM 0 H2' G A 14 3.970 -13.437 15.158 1.00 0.67 H new ATOM 0 HO2' G A 14 1.930 -14.353 15.096 1.00 0.80 H new ATOM 0 H1' G A 14 1.614 -12.178 14.350 1.00 0.61 H new ATOM 0 H8 G A 14 4.181 -9.462 14.669 1.00 0.50 H new ATOM 0 H1 G A 14 4.711 -12.955 9.295 1.00 0.41 H new ATOM 0 H21 G A 14 2.409 -15.062 10.833 1.00 0.55 H new ATOM 0 H22 G A 14 3.415 -14.726 9.420 1.00 0.55 H new ATOM 1038 P C A 15 5.083 -13.736 18.400 1.00 0.87 P ATOM 1039 OP1 C A 15 4.897 -14.438 19.695 1.00 0.91 O ATOM 1040 OP2 C A 15 6.161 -12.724 18.261 1.00 1.02 O ATOM 1041 O5' C A 15 5.274 -14.835 17.263 1.00 0.85 O ATOM 1042 C5' C A 15 4.268 -15.838 17.037 1.00 0.94 C ATOM 1043 C4' C A 15 4.622 -16.673 15.829 1.00 0.97 C ATOM 1044 O4' C A 15 4.433 -15.886 14.630 1.00 0.84 O ATOM 1045 C3' C A 15 6.082 -17.074 15.752 1.00 1.09 C ATOM 1046 O3' C A 15 6.331 -18.251 16.532 1.00 1.31 O ATOM 1047 C2' C A 15 6.273 -17.355 14.266 1.00 1.09 C ATOM 1048 O2' C A 15 5.939 -18.684 13.912 1.00 1.30 O ATOM 1049 C1' C A 15 5.294 -16.375 13.617 1.00 0.89 C ATOM 1050 N1 C A 15 5.983 -15.237 12.995 1.00 0.75 N ATOM 1051 C2 C A 15 6.615 -15.431 11.764 1.00 0.77 C ATOM 1052 O2 C A 15 6.566 -16.549 11.232 1.00 0.89 O ATOM 1053 N3 C A 15 7.261 -14.403 11.186 1.00 0.70 N ATOM 1054 C4 C A 15 7.293 -13.216 11.784 1.00 0.66 C ATOM 1055 N4 C A 15 7.946 -12.237 11.169 1.00 0.71 N ATOM 1056 C5 C A 15 6.659 -12.984 13.038 1.00 0.64 C ATOM 1057 C6 C A 15 6.019 -14.014 13.605 1.00 0.66 C ATOM 0 H5' C A 15 3.298 -15.363 16.888 1.00 0.94 H new ATOM 0 H5'' C A 15 4.178 -16.477 17.915 1.00 0.94 H new ATOM 0 H4' C A 15 3.988 -17.556 15.914 1.00 0.97 H new ATOM 0 H3' C A 15 6.762 -16.316 16.141 1.00 1.09 H new ATOM 0 H2' C A 15 7.311 -17.237 13.955 1.00 1.09 H new ATOM 0 HO2' C A 15 5.877 -19.233 14.722 1.00 1.30 H new ATOM 0 HO3' C A 15 7.279 -18.493 16.466 1.00 1.31 H new ATOM 0 H1' C A 15 4.746 -16.899 12.834 1.00 0.89 H new ATOM 0 H41 C A 15 7.995 -11.311 11.594 1.00 0.71 H new ATOM 0 H42 C A 15 8.399 -12.411 10.272 1.00 0.71 H new ATOM 0 H5 C A 15 6.693 -12.015 13.513 1.00 0.64 H new ATOM 0 H6 C A 15 5.525 -13.877 14.556 1.00 0.66 H new TER 1069 C A 15