USER MOD reduce.3.24.130724 H: found=0, std=0, add=1015, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1013 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 NoAdj-H: A 20 HIS HE2 : A 20 HIS NE2 : A 83 ZNZN :(H bumps) USER MOD NoAdj-H: A 24 HIS HE2 : A 24 HIS NE2 : A 83 ZNZN :(H bumps) USER MOD NoAdj-H: A 48 HIS HE2 : A 48 HIS NE2 : A 84 ZNZN :(H bumps) USER MOD NoAdj-H: A 52 HIS HE2 : A 52 HIS NE2 : A 84 ZNZN :(H bumps) USER MOD NoAdj-H: A 76 HIS HE2 : A 76 HIS NE2 : A 85 ZNZN :(H bumps) USER MOD NoAdj-H: A 80 HIS HE2 : A 80 HIS NE2 : A 85 ZNZN :(H bumps) USER MOD Set 1.1: A 69 GLN : amide:sc= 0.251 K(o=0.32,f=-4.6!) USER MOD Set 1.2: A 72 ASN : amide:sc= 0.0683 K(o=0.32,f=-2.3!) USER MOD Set 2.1: A 19 THR OG1 : rot 150:sc= 0.345 USER MOD Set 2.2: A 41 GLN : amide:sc= -0.0952 K(o=0.25,f=1.1) USER MOD Set 3.1: A 16 THR OG1 : rot -177:sc= -1.34 USER MOD Set 3.2: B 111 DT C7 :methyl -30:sc= -2.92 (180deg=-1.65) USER MOD Single : A 1 SER N :NH3+ -148:sc= 0.142 (180deg=0.00479) USER MOD Single : A 1 SER OG : rot 60:sc= 0.197 USER MOD Single : A 5 LYS NZ :NH3+ 163:sc=-0.00168 (180deg=-0.129) USER MOD Single : A 9 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0231) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.109) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot -141:sc= 0.041 USER MOD Single : A 18 SER OG : rot -68:sc= -0.159! USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 27 THR OG1 : rot -160:sc= -0.355 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -1.62! C(o=-1.6!,f=-4.9!) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 163:sc= -0.0912 (180deg=-0.549) USER MOD Single : A 40 HIS : no HD1:sc= -3.72! K(o=-3.7!,f=-0.035) USER MOD Single : A 42 LYS NZ :NH3+ 133:sc= -0.21 (180deg=-1.39!) USER MOD Single : A 43 SER OG : rot 180:sc= 0.0183 USER MOD Single : A 45 MET CE :methyl 153:sc= -0.179 (180deg=-1.11) USER MOD Single : A 46 LYS NZ :NH3+ -167:sc= -1.83 (180deg=-2.49!) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 13:sc= -3.39! USER MOD Single : A 53 THR OG1 : rot -10:sc= -0.87 USER MOD Single : A 56 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0153) USER MOD Single : A 58 HIS : no HD1:sc= -0.136 X(o=-0.14,f=0.021) USER MOD Single : A 59 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0279) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 143:sc= -0.421 (180deg=-1.59!) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0976 USER MOD Single : A 71 SER OG : rot 108:sc= -3.24! USER MOD Single : A 75 THR OG1 : rot 80:sc= 0.026 USER MOD Single : A 77 SER OG : rot -10:sc= -1.69! USER MOD Single : A 79 LYS NZ :NH3+ -175:sc= 0.835 (180deg=0.7!) USER MOD Single : A 81 THR OG1 : rot -130:sc= -1.08 USER MOD Single : B 101 DC O5' : rot 31:sc=0.000211 USER MOD Single : B 103 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 107 DT C7 :methyl -30:sc= -0.0441 (180deg=-1.62) USER MOD Single : B 115 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 116 DA O3' : rot 180:sc= 0 USER MOD Single : C 201 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 201 DT O5' : rot 180:sc= 0 USER MOD Single : C 208 DT C7 :methyl 150:sc=-0.00588 (180deg=-0.00588) USER MOD Single : C 211 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 212 DT C7 :methyl 150:sc= -0.0446 (180deg=-0.0446) USER MOD Single : C 213 DT C7 :methyl 150:sc= -0.256 (180deg=-0.256) USER MOD Single : C 215 DT C7 :methyl 150:sc= -0.0294 (180deg=-0.0294) USER MOD Single : C 216 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 -9.763 -8.137 38.781 1.00 65.13 N ATOM 2 CA SER A 1 -10.899 -8.658 37.972 1.00 65.13 C ATOM 3 C SER A 1 -11.931 -7.547 37.768 1.00 65.13 C ATOM 4 O SER A 1 -12.989 -7.548 38.366 1.00 65.13 O ATOM 5 CB SER A 1 -11.538 -9.840 38.702 1.00 65.13 C ATOM 6 OG SER A 1 -11.716 -9.505 40.071 1.00 65.13 O ATOM 0 H1 SER A 1 -8.884 -8.613 38.492 1.00 65.13 H new ATOM 0 H2 SER A 1 -9.669 -7.113 38.628 1.00 65.13 H new ATOM 0 H3 SER A 1 -9.941 -8.321 39.789 1.00 65.13 H new ATOM 0 HA SER A 1 -10.538 -8.990 36.999 1.00 65.13 H new ATOM 0 HB2 SER A 1 -12.498 -10.087 38.248 1.00 65.13 H new ATOM 0 HB3 SER A 1 -10.906 -10.723 38.611 1.00 65.13 H new ATOM 0 HG SER A 1 -12.301 -8.722 40.143 1.00 65.13 H new ATOM 14 N PHE A 2 -11.628 -6.600 36.917 1.00 70.07 N ATOM 15 CA PHE A 2 -12.587 -5.483 36.658 1.00 70.07 C ATOM 16 C PHE A 2 -13.283 -5.719 35.311 1.00 70.07 C ATOM 17 O PHE A 2 -12.652 -5.848 34.281 1.00 70.07 O ATOM 18 CB PHE A 2 -11.836 -4.148 36.657 1.00 70.07 C ATOM 19 CG PHE A 2 -10.752 -4.181 37.714 1.00 70.07 C ATOM 20 CD1 PHE A 2 -11.075 -3.945 39.056 1.00 70.07 C ATOM 21 CD2 PHE A 2 -9.427 -4.455 37.353 1.00 70.07 C ATOM 22 CE1 PHE A 2 -10.075 -3.981 40.035 1.00 70.07 C ATOM 23 CE2 PHE A 2 -8.430 -4.493 38.333 1.00 70.07 C ATOM 24 CZ PHE A 2 -8.752 -4.257 39.674 1.00 70.07 C ATOM 0 H PHE A 2 -10.756 -6.552 36.389 1.00 70.07 H new ATOM 0 HA PHE A 2 -13.342 -5.450 37.443 1.00 70.07 H new ATOM 0 HB2 PHE A 2 -11.397 -3.965 35.676 1.00 70.07 H new ATOM 0 HB3 PHE A 2 -12.527 -3.329 36.855 1.00 70.07 H new ATOM 0 HD1 PHE A 2 -12.097 -3.735 39.336 1.00 70.07 H new ATOM 0 HD2 PHE A 2 -9.175 -4.637 36.319 1.00 70.07 H new ATOM 0 HE1 PHE A 2 -10.325 -3.796 41.069 1.00 70.07 H new ATOM 0 HE2 PHE A 2 -7.408 -4.705 38.054 1.00 70.07 H new ATOM 0 HZ PHE A 2 -7.980 -4.288 40.429 1.00 70.07 H new ATOM 34 N ASP A 3 -14.596 -5.804 35.339 1.00 83.59 N ATOM 35 CA ASP A 3 -15.379 -6.065 34.089 1.00 83.59 C ATOM 36 C ASP A 3 -16.143 -4.812 33.656 1.00 83.59 C ATOM 37 O ASP A 3 -17.149 -4.446 34.222 1.00 83.59 O ATOM 38 CB ASP A 3 -16.363 -7.208 34.325 1.00 83.59 C ATOM 39 CG ASP A 3 -17.013 -7.046 35.691 1.00 83.59 C ATOM 40 OD1 ASP A 3 -18.025 -6.370 35.765 1.00 83.59 O ATOM 41 OD2 ASP A 3 -16.488 -7.597 36.642 1.00 83.59 O ATOM 0 H ASP A 3 -15.160 -5.702 36.182 1.00 83.59 H new ATOM 0 HA ASP A 3 -14.682 -6.339 33.297 1.00 83.59 H new ATOM 0 HB2 ASP A 3 -17.125 -7.212 33.546 1.00 83.59 H new ATOM 0 HB3 ASP A 3 -15.845 -8.165 34.269 1.00 83.59 H new ATOM 46 N CYS A 4 -15.616 -4.177 32.664 1.00 50.89 N ATOM 47 CA CYS A 4 -16.208 -2.912 32.108 1.00 50.89 C ATOM 48 C CYS A 4 -17.651 -2.730 32.652 1.00 50.89 C ATOM 49 O CYS A 4 -18.321 -3.692 32.957 1.00 50.89 O ATOM 50 CB CYS A 4 -16.270 -3.043 30.585 1.00 50.89 C ATOM 51 SG CYS A 4 -17.200 -1.676 29.864 1.00 50.89 S ATOM 0 H CYS A 4 -14.767 -4.482 32.187 1.00 50.89 H new ATOM 0 HA CYS A 4 -15.599 -2.056 32.399 1.00 50.89 H new ATOM 0 HB2 CYS A 4 -15.260 -3.058 30.175 1.00 50.89 H new ATOM 0 HB3 CYS A 4 -16.738 -3.990 30.315 1.00 50.89 H new ATOM 56 N LYS A 5 -18.177 -1.530 32.676 1.00 99.16 N ATOM 57 CA LYS A 5 -19.616 -1.384 33.098 1.00 99.16 C ATOM 58 C LYS A 5 -20.341 -0.754 31.935 1.00 99.16 C ATOM 59 O LYS A 5 -21.389 -0.155 32.075 1.00 99.16 O ATOM 60 CB LYS A 5 -19.805 -0.529 34.359 1.00 99.16 C ATOM 61 CG LYS A 5 -19.150 -1.220 35.560 1.00 99.16 C ATOM 62 CD LYS A 5 -18.077 -0.310 36.155 1.00 99.16 C ATOM 63 CE LYS A 5 -17.173 -1.127 37.073 1.00 99.16 C ATOM 64 NZ LYS A 5 -16.206 -1.899 36.244 1.00 99.16 N ATOM 0 H LYS A 5 -17.694 -0.665 32.431 1.00 99.16 H new ATOM 0 HA LYS A 5 -20.010 -2.367 33.355 1.00 99.16 H new ATOM 0 HB2 LYS A 5 -19.364 0.457 34.210 1.00 99.16 H new ATOM 0 HB3 LYS A 5 -20.867 -0.377 34.550 1.00 99.16 H new ATOM 0 HG2 LYS A 5 -19.903 -1.452 36.314 1.00 99.16 H new ATOM 0 HG3 LYS A 5 -18.707 -2.167 35.250 1.00 99.16 H new ATOM 0 HD2 LYS A 5 -17.489 0.146 35.359 1.00 99.16 H new ATOM 0 HD3 LYS A 5 -18.542 0.503 36.713 1.00 99.16 H new ATOM 0 HE2 LYS A 5 -16.639 -0.468 37.758 1.00 99.16 H new ATOM 0 HE3 LYS A 5 -17.770 -1.805 37.683 1.00 99.16 H new ATOM 0 HZ1 LYS A 5 -15.419 -2.223 36.841 1.00 99.16 H new ATOM 0 HZ2 LYS A 5 -16.686 -2.722 35.827 1.00 99.16 H new ATOM 0 HZ3 LYS A 5 -15.837 -1.292 35.485 1.00 99.16 H new ATOM 78 N ILE A 6 -19.749 -0.870 30.780 1.00112.28 N ATOM 79 CA ILE A 6 -20.338 -0.269 29.567 1.00112.28 C ATOM 80 C ILE A 6 -20.488 -1.326 28.467 1.00112.28 C ATOM 81 O ILE A 6 -21.558 -1.860 28.267 1.00112.28 O ATOM 82 CB ILE A 6 -19.421 0.852 29.091 1.00112.28 C ATOM 83 CG1 ILE A 6 -18.970 1.719 30.286 1.00112.28 C ATOM 84 CG2 ILE A 6 -20.160 1.721 28.071 1.00112.28 C ATOM 85 CD1 ILE A 6 -20.106 2.641 30.744 1.00112.28 C ATOM 0 H ILE A 6 -18.869 -1.364 30.630 1.00112.28 H new ATOM 0 HA ILE A 6 -21.328 0.127 29.795 1.00112.28 H new ATOM 0 HB ILE A 6 -18.539 0.413 28.624 1.00112.28 H new ATOM 0 HG12 ILE A 6 -18.660 1.078 31.111 1.00112.28 H new ATOM 0 HG13 ILE A 6 -18.103 2.315 30.003 1.00112.28 H new ATOM 0 HG21 ILE A 6 -19.503 2.522 27.732 1.00112.28 H new ATOM 0 HG22 ILE A 6 -20.457 1.109 27.219 1.00112.28 H new ATOM 0 HG23 ILE A 6 -21.047 2.152 28.535 1.00112.28 H new ATOM 0 HD11 ILE A 6 -19.768 3.244 31.587 1.00112.28 H new ATOM 0 HD12 ILE A 6 -20.396 3.296 29.923 1.00112.28 H new ATOM 0 HD13 ILE A 6 -20.963 2.039 31.048 1.00112.28 H new ATOM 97 N CYS A 7 -19.443 -1.651 27.747 1.00 82.08 N ATOM 98 CA CYS A 7 -19.604 -2.680 26.678 1.00 82.08 C ATOM 99 C CYS A 7 -19.539 -4.079 27.304 1.00 82.08 C ATOM 100 O CYS A 7 -20.271 -4.967 26.914 1.00 82.08 O ATOM 101 CB CYS A 7 -18.539 -2.499 25.591 1.00 82.08 C ATOM 102 SG CYS A 7 -16.889 -2.822 26.251 1.00 82.08 S ATOM 0 H CYS A 7 -18.507 -1.259 27.850 1.00 82.08 H new ATOM 0 HA CYS A 7 -20.576 -2.560 26.200 1.00 82.08 H new ATOM 0 HB2 CYS A 7 -18.742 -3.175 24.760 1.00 82.08 H new ATOM 0 HB3 CYS A 7 -18.585 -1.484 25.195 1.00 82.08 H new ATOM 107 N GLY A 8 -18.713 -4.272 28.310 1.00195.93 N ATOM 108 CA GLY A 8 -18.670 -5.613 28.993 1.00195.93 C ATOM 109 C GLY A 8 -17.370 -6.402 28.721 1.00195.93 C ATOM 110 O GLY A 8 -17.410 -7.597 28.505 1.00195.93 O ATOM 0 H GLY A 8 -18.074 -3.570 28.685 1.00195.93 H new ATOM 0 HA2 GLY A 8 -18.779 -5.468 30.068 1.00195.93 H new ATOM 0 HA3 GLY A 8 -19.522 -6.207 28.663 1.00195.93 H new ATOM 114 N LYS A 9 -16.218 -5.770 28.765 1.00114.22 N ATOM 115 CA LYS A 9 -14.924 -6.515 28.546 1.00114.22 C ATOM 116 C LYS A 9 -14.158 -6.523 29.869 1.00114.22 C ATOM 117 O LYS A 9 -14.490 -5.787 30.776 1.00114.22 O ATOM 118 CB LYS A 9 -14.098 -5.839 27.457 1.00114.22 C ATOM 119 CG LYS A 9 -12.765 -6.569 27.278 1.00114.22 C ATOM 120 CD LYS A 9 -11.928 -5.821 26.240 1.00114.22 C ATOM 121 CE LYS A 9 -10.885 -6.760 25.634 1.00114.22 C ATOM 122 NZ LYS A 9 -9.885 -7.134 26.673 1.00114.22 N ATOM 0 H LYS A 9 -16.114 -4.771 28.943 1.00114.22 H new ATOM 0 HA LYS A 9 -15.127 -7.536 28.221 1.00114.22 H new ATOM 0 HB2 LYS A 9 -14.651 -5.840 26.518 1.00114.22 H new ATOM 0 HB3 LYS A 9 -13.918 -4.797 27.720 1.00114.22 H new ATOM 0 HG2 LYS A 9 -12.232 -6.619 28.227 1.00114.22 H new ATOM 0 HG3 LYS A 9 -12.938 -7.596 26.955 1.00114.22 H new ATOM 0 HD2 LYS A 9 -12.574 -5.427 25.455 1.00114.22 H new ATOM 0 HD3 LYS A 9 -11.434 -4.968 26.705 1.00114.22 H new ATOM 0 HE2 LYS A 9 -11.370 -7.654 25.243 1.00114.22 H new ATOM 0 HE3 LYS A 9 -10.388 -6.274 24.795 1.00114.22 H new ATOM 0 HZ1 LYS A 9 -9.096 -7.645 26.228 1.00114.22 H new ATOM 0 HZ2 LYS A 9 -9.524 -6.274 27.133 1.00114.22 H new ATOM 0 HZ3 LYS A 9 -10.335 -7.744 27.384 1.00114.22 H new ATOM 136 N SER A 10 -13.207 -7.423 30.049 1.00 78.05 N ATOM 137 CA SER A 10 -12.552 -7.515 31.395 1.00 78.05 C ATOM 138 C SER A 10 -11.085 -7.088 31.422 1.00 78.05 C ATOM 139 O SER A 10 -10.318 -7.263 30.495 1.00 78.05 O ATOM 140 CB SER A 10 -12.650 -8.954 31.881 0.50 78.05 C ATOM 141 OG SER A 10 -12.066 -9.792 30.878 1.00 78.05 O ATOM 0 H SER A 10 -12.868 -8.077 29.343 1.00 78.05 H new ATOM 0 HA SER A 10 -13.082 -6.816 32.042 1.00 78.05 H new ATOM 0 HB2 SER A 10 -12.128 -9.073 32.831 0.50 78.05 H new ATOM 0 HB3 SER A 10 -13.691 -9.230 32.052 0.50 78.05 H new ATOM 0 HG SER A 10 -12.113 -10.728 31.165 1.00 78.05 H new ATOM 147 N PHE A 11 -10.727 -6.521 32.556 1.00 54.66 N ATOM 148 CA PHE A 11 -9.342 -6.042 32.807 1.00 54.66 C ATOM 149 C PHE A 11 -8.840 -6.572 34.147 1.00 54.66 C ATOM 150 O PHE A 11 -9.448 -6.389 35.179 1.00 54.66 O ATOM 151 CB PHE A 11 -9.360 -4.525 32.835 1.00 54.66 C ATOM 152 CG PHE A 11 -10.064 -4.091 31.596 1.00 54.66 C ATOM 153 CD1 PHE A 11 -9.369 -4.051 30.389 1.00 54.66 C ATOM 154 CD2 PHE A 11 -11.425 -3.789 31.637 1.00 54.66 C ATOM 155 CE1 PHE A 11 -10.038 -3.720 29.214 1.00 54.66 C ATOM 156 CE2 PHE A 11 -12.091 -3.442 30.468 1.00 54.66 C ATOM 157 CZ PHE A 11 -11.400 -3.410 29.255 1.00 54.66 C ATOM 0 H PHE A 11 -11.366 -6.370 33.337 1.00 54.66 H new ATOM 0 HA PHE A 11 -8.678 -6.399 32.020 1.00 54.66 H new ATOM 0 HB2 PHE A 11 -9.875 -4.159 33.723 1.00 54.66 H new ATOM 0 HB3 PHE A 11 -8.347 -4.125 32.867 1.00 54.66 H new ATOM 0 HD1 PHE A 11 -8.313 -4.276 30.365 1.00 54.66 H new ATOM 0 HD2 PHE A 11 -11.960 -3.825 32.575 1.00 54.66 H new ATOM 0 HE1 PHE A 11 -9.506 -3.703 28.274 1.00 54.66 H new ATOM 0 HE2 PHE A 11 -13.142 -3.197 30.497 1.00 54.66 H new ATOM 0 HZ PHE A 11 -11.920 -3.145 28.346 1.00 54.66 H new ATOM 167 N LYS A 12 -7.714 -7.219 34.114 1.00101.13 N ATOM 168 CA LYS A 12 -7.115 -7.764 35.358 1.00101.13 C ATOM 169 C LYS A 12 -6.606 -6.598 36.202 1.00101.13 C ATOM 170 O LYS A 12 -6.372 -6.702 37.390 1.00101.13 O ATOM 171 CB LYS A 12 -5.913 -8.625 34.974 1.00101.13 C ATOM 172 CG LYS A 12 -6.364 -9.727 34.013 1.00101.13 C ATOM 173 CD LYS A 12 -5.141 -10.502 33.515 1.00101.13 C ATOM 174 CE LYS A 12 -5.517 -11.309 32.270 1.00101.13 C ATOM 175 NZ LYS A 12 -5.573 -10.405 31.086 1.00101.13 N ATOM 0 H LYS A 12 -7.176 -7.396 33.266 1.00101.13 H new ATOM 0 HA LYS A 12 -7.852 -8.347 35.910 1.00101.13 H new ATOM 0 HB2 LYS A 12 -5.146 -8.009 34.505 1.00101.13 H new ATOM 0 HB3 LYS A 12 -5.467 -9.065 35.866 1.00101.13 H new ATOM 0 HG2 LYS A 12 -7.056 -10.403 34.516 1.00101.13 H new ATOM 0 HG3 LYS A 12 -6.900 -9.292 33.170 1.00101.13 H new ATOM 0 HD2 LYS A 12 -4.330 -9.812 33.282 1.00101.13 H new ATOM 0 HD3 LYS A 12 -4.777 -11.169 34.297 1.00101.13 H new ATOM 0 HE2 LYS A 12 -4.786 -12.100 32.102 1.00101.13 H new ATOM 0 HE3 LYS A 12 -6.482 -11.794 32.416 1.00101.13 H new ATOM 0 HZ1 LYS A 12 -5.575 -10.973 30.215 1.00101.13 H new ATOM 0 HZ2 LYS A 12 -6.440 -9.832 31.127 1.00101.13 H new ATOM 0 HZ3 LYS A 12 -4.743 -9.778 31.089 1.00101.13 H new ATOM 189 N ARG A 13 -6.388 -5.491 35.538 1.00 74.89 N ATOM 190 CA ARG A 13 -5.833 -4.272 36.184 1.00 74.89 C ATOM 191 C ARG A 13 -6.869 -3.146 36.165 1.00 74.89 C ATOM 192 O ARG A 13 -7.533 -2.905 35.171 1.00 74.89 O ATOM 193 CB ARG A 13 -4.607 -3.835 35.373 1.00 74.89 C ATOM 194 CG ARG A 13 -3.317 -4.217 36.108 1.00 74.89 C ATOM 195 CD ARG A 13 -2.842 -3.025 36.936 1.00 74.89 C ATOM 196 NE ARG A 13 -3.988 -2.474 37.716 1.00 74.89 N ATOM 197 CZ ARG A 13 -4.235 -2.916 38.920 1.00 74.89 C ATOM 198 NH1 ARG A 13 -3.511 -3.878 39.424 1.00 74.89 N ATOM 199 NH2 ARG A 13 -5.213 -2.403 39.615 1.00 74.89 N ATOM 0 H ARG A 13 -6.580 -5.383 34.542 1.00 74.89 H new ATOM 0 HA ARG A 13 -5.567 -4.485 37.219 1.00 74.89 H new ATOM 0 HB2 ARG A 13 -4.626 -4.306 34.390 1.00 74.89 H new ATOM 0 HB3 ARG A 13 -4.635 -2.758 35.211 1.00 74.89 H new ATOM 0 HG2 ARG A 13 -3.493 -5.077 36.754 1.00 74.89 H new ATOM 0 HG3 ARG A 13 -2.548 -4.508 35.392 1.00 74.89 H new ATOM 0 HD2 ARG A 13 -2.043 -3.332 37.611 1.00 74.89 H new ATOM 0 HD3 ARG A 13 -2.429 -2.256 36.283 1.00 74.89 H new ATOM 0 HE ARG A 13 -4.580 -1.750 37.308 1.00 74.89 H new ATOM 0 HH11 ARG A 13 -2.752 -4.285 38.878 1.00 74.89 H new ATOM 0 HH12 ARG A 13 -3.704 -4.223 40.364 1.00 74.89 H new ATOM 0 HH21 ARG A 13 -5.784 -1.657 39.218 1.00 74.89 H new ATOM 0 HH22 ARG A 13 -5.406 -2.748 40.555 1.00 74.89 H new ATOM 213 N SER A 14 -7.007 -2.440 37.254 1.00 25.87 N ATOM 214 CA SER A 14 -7.992 -1.331 37.279 1.00 25.87 C ATOM 215 C SER A 14 -7.542 -0.241 36.295 1.00 25.87 C ATOM 216 O SER A 14 -8.344 0.400 35.658 1.00 25.87 O ATOM 217 CB SER A 14 -8.081 -0.761 38.696 1.00 25.87 C ATOM 218 OG SER A 14 -9.164 0.159 38.775 1.00 25.87 O ATOM 0 H SER A 14 -6.484 -2.584 38.118 1.00 25.87 H new ATOM 0 HA SER A 14 -8.976 -1.697 36.985 1.00 25.87 H new ATOM 0 HB2 SER A 14 -8.223 -1.568 39.415 1.00 25.87 H new ATOM 0 HB3 SER A 14 -7.148 -0.262 38.957 1.00 25.87 H new ATOM 0 HG SER A 14 -9.220 0.521 39.684 1.00 25.87 H new ATOM 224 N SER A 15 -6.253 -0.016 36.188 1.00 23.45 N ATOM 225 CA SER A 15 -5.736 1.040 35.264 1.00 23.45 C ATOM 226 C SER A 15 -6.026 0.662 33.812 1.00 23.45 C ATOM 227 O SER A 15 -6.387 1.498 33.009 1.00 23.45 O ATOM 228 CB SER A 15 -4.230 1.196 35.474 1.00 23.45 C ATOM 229 OG SER A 15 -3.558 1.203 34.220 1.00 23.45 O ATOM 0 H SER A 15 -5.534 -0.523 36.705 1.00 23.45 H new ATOM 0 HA SER A 15 -6.235 1.985 35.480 1.00 23.45 H new ATOM 0 HB2 SER A 15 -4.024 2.122 36.010 1.00 23.45 H new ATOM 0 HB3 SER A 15 -3.855 0.380 36.091 1.00 23.45 H new ATOM 0 HG SER A 15 -2.720 0.700 34.295 1.00 23.45 H new ATOM 235 N THR A 16 -5.900 -0.586 33.464 1.00 32.27 N ATOM 236 CA THR A 16 -6.210 -0.985 32.075 1.00 32.27 C ATOM 237 C THR A 16 -7.705 -0.761 31.902 1.00 32.27 C ATOM 238 O THR A 16 -8.182 -0.381 30.846 1.00 32.27 O ATOM 239 CB THR A 16 -5.831 -2.454 31.906 1.00 32.27 C ATOM 240 OG1 THR A 16 -4.598 -2.684 32.562 1.00 32.27 O ATOM 241 CG2 THR A 16 -5.694 -2.804 30.440 1.00 32.27 C ATOM 0 H THR A 16 -5.597 -1.340 34.081 1.00 32.27 H new ATOM 0 HA THR A 16 -5.661 -0.414 31.326 1.00 32.27 H new ATOM 0 HB THR A 16 -6.613 -3.078 32.339 1.00 32.27 H new ATOM 0 HG1 THR A 16 -4.321 -3.613 32.421 1.00 32.27 H new ATOM 0 HG21 THR A 16 -5.423 -3.855 30.341 1.00 32.27 H new ATOM 0 HG22 THR A 16 -6.642 -2.624 29.933 1.00 32.27 H new ATOM 0 HG23 THR A 16 -4.918 -2.185 29.989 1.00 32.27 H new ATOM 249 N LEU A 17 -8.440 -0.924 32.975 1.00 97.78 N ATOM 250 CA LEU A 17 -9.900 -0.648 32.925 1.00 97.78 C ATOM 251 C LEU A 17 -10.058 0.867 32.868 1.00 97.78 C ATOM 252 O LEU A 17 -10.951 1.368 32.240 1.00 97.78 O ATOM 253 CB LEU A 17 -10.600 -1.185 34.180 1.00 97.78 C ATOM 254 CG LEU A 17 -11.982 -0.520 34.360 1.00 97.78 C ATOM 255 CD1 LEU A 17 -12.892 -0.866 33.178 1.00 97.78 C ATOM 256 CD2 LEU A 17 -12.639 -1.022 35.651 1.00 97.78 C ATOM 0 H LEU A 17 -8.088 -1.236 33.880 1.00 97.78 H new ATOM 0 HA LEU A 17 -10.349 -1.135 32.059 1.00 97.78 H new ATOM 0 HB2 LEU A 17 -10.718 -2.266 34.102 1.00 97.78 H new ATOM 0 HB3 LEU A 17 -9.982 -0.994 35.057 1.00 97.78 H new ATOM 0 HG LEU A 17 -11.842 0.560 34.411 1.00 97.78 H new ATOM 0 HD11 LEU A 17 -13.864 -0.392 33.316 1.00 97.78 H new ATOM 0 HD12 LEU A 17 -12.440 -0.506 32.254 1.00 97.78 H new ATOM 0 HD13 LEU A 17 -13.021 -1.947 33.122 1.00 97.78 H new ATOM 0 HD21 LEU A 17 -13.613 -0.549 35.771 1.00 97.78 H new ATOM 0 HD22 LEU A 17 -12.765 -2.103 35.598 1.00 97.78 H new ATOM 0 HD23 LEU A 17 -12.006 -0.771 36.502 1.00 97.78 H new ATOM 268 N SER A 18 -9.204 1.610 33.530 1.00 34.23 N ATOM 269 CA SER A 18 -9.336 3.092 33.487 1.00 34.23 C ATOM 270 C SER A 18 -9.261 3.538 32.029 1.00 34.23 C ATOM 271 O SER A 18 -10.172 4.149 31.513 1.00 34.23 O ATOM 272 CB SER A 18 -8.201 3.747 34.293 0.50 34.23 C ATOM 273 OG SER A 18 -6.992 3.704 33.546 1.00 34.23 O ATOM 0 H SER A 18 -8.430 1.255 34.092 1.00 34.23 H new ATOM 0 HA SER A 18 -10.288 3.394 33.924 1.00 34.23 H new ATOM 0 HB2 SER A 18 -8.458 4.780 34.527 0.50 34.23 H new ATOM 0 HB3 SER A 18 -8.071 3.228 35.243 0.50 34.23 H new ATOM 0 HG SER A 18 -6.692 2.775 33.463 1.00 34.23 H new ATOM 279 N THR A 19 -8.192 3.201 31.354 1.00 30.69 N ATOM 280 CA THR A 19 -8.054 3.569 29.913 1.00 30.69 C ATOM 281 C THR A 19 -9.279 3.075 29.160 1.00 30.69 C ATOM 282 O THR A 19 -9.846 3.750 28.323 1.00 30.69 O ATOM 283 CB THR A 19 -6.828 2.861 29.340 1.00 30.69 C ATOM 284 OG1 THR A 19 -5.670 3.230 30.075 1.00 30.69 O ATOM 285 CG2 THR A 19 -6.653 3.234 27.868 1.00 30.69 C ATOM 0 H THR A 19 -7.404 2.683 31.742 1.00 30.69 H new ATOM 0 HA THR A 19 -7.954 4.650 29.814 1.00 30.69 H new ATOM 0 HB THR A 19 -6.970 1.783 29.418 1.00 30.69 H new ATOM 0 HG1 THR A 19 -5.027 2.491 30.065 1.00 30.69 H new ATOM 0 HG21 THR A 19 -5.777 2.726 27.466 1.00 30.69 H new ATOM 0 HG22 THR A 19 -7.538 2.931 27.308 1.00 30.69 H new ATOM 0 HG23 THR A 19 -6.520 4.312 27.779 1.00 30.69 H new ATOM 293 N HIS A 20 -9.702 1.905 29.491 1.00 81.83 N ATOM 294 CA HIS A 20 -10.901 1.352 28.835 1.00 81.83 C ATOM 295 C HIS A 20 -12.100 2.256 29.172 1.00 81.83 C ATOM 296 O HIS A 20 -12.878 2.672 28.312 1.00 81.83 O ATOM 297 CB HIS A 20 -11.135 -0.062 29.359 1.00 81.83 C ATOM 298 CG HIS A 20 -12.322 -0.624 28.667 1.00 81.83 C ATOM 299 ND1 HIS A 20 -12.222 -1.352 27.477 1.00 81.83 N ATOM 300 CD2 HIS A 20 -13.653 -0.502 28.932 1.00 81.83 C ATOM 301 CE1 HIS A 20 -13.474 -1.629 27.071 1.00 81.83 C ATOM 302 NE2 HIS A 20 -14.347 -1.128 27.930 1.00 81.83 N ATOM 0 H HIS A 20 -9.269 1.302 30.191 1.00 81.83 H new ATOM 0 HA HIS A 20 -10.773 1.313 27.753 1.00 81.83 H new ATOM 0 HB2 HIS A 20 -10.259 -0.684 29.177 1.00 81.83 H new ATOM 0 HB3 HIS A 20 -11.296 -0.046 30.437 1.00 81.83 H new ATOM 0 HD1 HIS A 20 -11.359 -1.623 27.005 1.00 81.83 H new ATOM 0 HD2 HIS A 20 -14.086 0.001 29.784 1.00 81.83 H new ATOM 0 HE1 HIS A 20 -13.729 -2.179 26.177 1.00 81.83 H new ATOM 310 N LEU A 21 -12.243 2.588 30.428 1.00156.93 N ATOM 311 CA LEU A 21 -13.363 3.464 30.834 1.00156.93 C ATOM 312 C LEU A 21 -13.225 4.756 30.047 1.00156.93 C ATOM 313 O LEU A 21 -14.190 5.413 29.711 1.00156.93 O ATOM 314 CB LEU A 21 -13.277 3.760 32.334 1.00156.93 C ATOM 315 CG LEU A 21 -13.799 2.563 33.140 1.00156.93 C ATOM 316 CD1 LEU A 21 -13.464 2.770 34.618 1.00156.93 C ATOM 317 CD2 LEU A 21 -15.324 2.434 32.978 1.00156.93 C ATOM 0 H LEU A 21 -11.629 2.287 31.185 1.00156.93 H new ATOM 0 HA LEU A 21 -14.322 2.985 30.636 1.00156.93 H new ATOM 0 HB2 LEU A 21 -12.245 3.973 32.612 1.00156.93 H new ATOM 0 HB3 LEU A 21 -13.860 4.650 32.571 1.00156.93 H new ATOM 0 HG LEU A 21 -13.326 1.652 32.772 1.00156.93 H new ATOM 0 HD11 LEU A 21 -13.832 1.923 35.197 1.00156.93 H new ATOM 0 HD12 LEU A 21 -12.384 2.850 34.739 1.00156.93 H new ATOM 0 HD13 LEU A 21 -13.937 3.685 34.974 1.00156.93 H new ATOM 0 HD21 LEU A 21 -15.680 1.581 33.555 1.00156.93 H new ATOM 0 HD22 LEU A 21 -15.806 3.343 33.338 1.00156.93 H new ATOM 0 HD23 LEU A 21 -15.567 2.287 31.926 1.00156.93 H new ATOM 329 N LEU A 22 -11.998 5.107 29.740 1.00 64.07 N ATOM 330 CA LEU A 22 -11.743 6.333 28.950 1.00 64.07 C ATOM 331 C LEU A 22 -12.174 6.065 27.515 1.00 64.07 C ATOM 332 O LEU A 22 -12.550 6.969 26.812 1.00 64.07 O ATOM 333 CB LEU A 22 -10.256 6.709 28.974 1.00 64.07 C ATOM 334 CG LEU A 22 -9.772 6.905 30.421 1.00 64.07 C ATOM 335 CD1 LEU A 22 -8.322 7.398 30.410 1.00 64.07 C ATOM 336 CD2 LEU A 22 -10.653 7.934 31.146 1.00 64.07 C ATOM 0 H LEU A 22 -11.163 4.587 30.009 1.00 64.07 H new ATOM 0 HA LEU A 22 -12.305 7.162 29.380 1.00 64.07 H new ATOM 0 HB2 LEU A 22 -9.670 5.927 28.491 1.00 64.07 H new ATOM 0 HB3 LEU A 22 -10.097 7.625 28.404 1.00 64.07 H new ATOM 0 HG LEU A 22 -9.837 5.952 30.946 1.00 64.07 H new ATOM 0 HD11 LEU A 22 -7.977 7.537 31.435 1.00 64.07 H new ATOM 0 HD12 LEU A 22 -7.691 6.662 29.912 1.00 64.07 H new ATOM 0 HD13 LEU A 22 -8.264 8.346 29.876 1.00 64.07 H new ATOM 0 HD21 LEU A 22 -10.297 8.061 32.168 1.00 64.07 H new ATOM 0 HD22 LEU A 22 -10.603 8.889 30.623 1.00 64.07 H new ATOM 0 HD23 LEU A 22 -11.685 7.583 31.162 1.00 64.07 H new ATOM 348 N ILE A 23 -12.164 4.837 27.056 1.00150.10 N ATOM 349 CA ILE A 23 -12.640 4.604 25.669 1.00150.10 C ATOM 350 C ILE A 23 -14.109 4.978 25.635 1.00150.10 C ATOM 351 O ILE A 23 -14.614 5.473 24.648 1.00150.10 O ATOM 352 CB ILE A 23 -12.512 3.127 25.291 1.00150.10 C ATOM 353 CG1 ILE A 23 -11.038 2.764 25.123 1.00150.10 C ATOM 354 CG2 ILE A 23 -13.262 2.861 23.974 1.00150.10 C ATOM 355 CD1 ILE A 23 -10.917 1.284 24.752 1.00150.10 C ATOM 0 H ILE A 23 -11.855 4.011 27.569 1.00150.10 H new ATOM 0 HA ILE A 23 -12.047 5.194 24.971 1.00150.10 H new ATOM 0 HB ILE A 23 -12.946 2.516 26.083 1.00150.10 H new ATOM 0 HG12 ILE A 23 -10.586 3.383 24.348 1.00150.10 H new ATOM 0 HG13 ILE A 23 -10.495 2.964 26.047 1.00150.10 H new ATOM 0 HG21 ILE A 23 -13.168 1.808 23.708 1.00150.10 H new ATOM 0 HG22 ILE A 23 -14.315 3.112 24.098 1.00150.10 H new ATOM 0 HG23 ILE A 23 -12.834 3.475 23.181 1.00150.10 H new ATOM 0 HD11 ILE A 23 -9.865 1.024 24.632 1.00150.10 H new ATOM 0 HD12 ILE A 23 -11.354 0.674 25.543 1.00150.10 H new ATOM 0 HD13 ILE A 23 -11.446 1.099 23.817 1.00150.10 H new ATOM 367 N HIS A 24 -14.805 4.744 26.716 1.00 55.94 N ATOM 368 CA HIS A 24 -16.253 5.099 26.726 1.00 55.94 C ATOM 369 C HIS A 24 -16.436 6.589 27.009 1.00 55.94 C ATOM 370 O HIS A 24 -17.318 7.215 26.455 1.00 55.94 O ATOM 371 CB HIS A 24 -17.002 4.304 27.793 1.00 55.94 C ATOM 372 CG HIS A 24 -17.041 2.856 27.418 1.00 55.94 C ATOM 373 ND1 HIS A 24 -17.651 2.388 26.246 1.00 55.94 N ATOM 374 CD2 HIS A 24 -16.546 1.754 28.048 1.00 55.94 C ATOM 375 CE1 HIS A 24 -17.498 1.041 26.218 1.00 55.94 C ATOM 376 NE2 HIS A 24 -16.839 0.641 27.291 1.00 55.94 N ATOM 0 H HIS A 24 -14.443 4.331 27.575 1.00 55.94 H new ATOM 0 HA HIS A 24 -16.657 4.856 25.743 1.00 55.94 H new ATOM 0 HB2 HIS A 24 -16.512 4.425 28.759 1.00 55.94 H new ATOM 0 HB3 HIS A 24 -18.016 4.688 27.899 1.00 55.94 H new ATOM 0 HD1 HIS A 24 -18.123 2.956 25.543 1.00 55.94 H new ATOM 0 HD2 HIS A 24 -16.012 1.753 28.987 1.00 55.94 H new ATOM 0 HE1 HIS A 24 -17.861 0.392 25.435 1.00 55.94 H new ATOM 384 N SER A 25 -15.637 7.183 27.865 1.00 89.10 N ATOM 385 CA SER A 25 -15.827 8.634 28.152 1.00 89.10 C ATOM 386 C SER A 25 -14.915 9.449 27.231 1.00 89.10 C ATOM 387 O SER A 25 -14.847 10.659 27.312 1.00 89.10 O ATOM 388 CB SER A 25 -15.457 8.909 29.614 1.00 89.10 C ATOM 389 OG SER A 25 -16.307 8.145 30.465 1.00 89.10 O ATOM 0 H SER A 25 -14.874 6.731 28.368 1.00 89.10 H new ATOM 0 HA SER A 25 -16.866 8.915 27.980 1.00 89.10 H new ATOM 0 HB2 SER A 25 -14.414 8.648 29.793 1.00 89.10 H new ATOM 0 HB3 SER A 25 -15.562 9.971 29.834 1.00 89.10 H new ATOM 0 HG SER A 25 -16.073 8.317 31.401 1.00 89.10 H new ATOM 395 N ASP A 26 -14.198 8.773 26.374 1.00 62.89 N ATOM 396 CA ASP A 26 -13.253 9.457 25.443 1.00 62.89 C ATOM 397 C ASP A 26 -12.668 10.705 26.108 1.00 62.89 C ATOM 398 O ASP A 26 -12.808 11.808 25.619 1.00 62.89 O ATOM 399 CB ASP A 26 -13.981 9.838 24.155 1.00 62.89 C ATOM 400 CG ASP A 26 -15.315 10.499 24.496 1.00 62.89 C ATOM 401 OD1 ASP A 26 -15.299 11.662 24.861 1.00 62.89 O ATOM 402 OD2 ASP A 26 -16.330 9.831 24.384 1.00 62.89 O ATOM 0 H ASP A 26 -14.228 7.758 26.278 1.00 62.89 H new ATOM 0 HA ASP A 26 -12.437 8.776 25.201 1.00 62.89 H new ATOM 0 HB2 ASP A 26 -13.367 10.519 23.566 1.00 62.89 H new ATOM 0 HB3 ASP A 26 -14.149 8.951 23.544 1.00 62.89 H new ATOM 407 N THR A 27 -11.995 10.528 27.212 1.00115.68 N ATOM 408 CA THR A 27 -11.376 11.694 27.905 1.00115.68 C ATOM 409 C THR A 27 -10.199 12.183 27.054 1.00115.68 C ATOM 410 O THR A 27 -10.127 13.335 26.674 1.00115.68 O ATOM 411 CB THR A 27 -10.879 11.257 29.287 1.00115.68 C ATOM 412 OG1 THR A 27 -11.965 10.723 30.031 1.00115.68 O ATOM 413 CG2 THR A 27 -10.293 12.456 30.033 1.00115.68 C ATOM 0 H THR A 27 -11.847 9.626 27.664 1.00115.68 H new ATOM 0 HA THR A 27 -12.103 12.497 28.032 1.00115.68 H new ATOM 0 HB THR A 27 -10.106 10.498 29.167 1.00115.68 H new ATOM 0 HG1 THR A 27 -11.746 10.739 30.986 1.00115.68 H new ATOM 0 HG21 THR A 27 -9.942 12.138 31.015 1.00115.68 H new ATOM 0 HG22 THR A 27 -9.458 12.866 29.464 1.00115.68 H new ATOM 0 HG23 THR A 27 -11.061 13.221 30.153 1.00115.68 H new ATOM 421 N ARG A 28 -9.290 11.298 26.741 1.00115.33 N ATOM 422 CA ARG A 28 -8.115 11.670 25.897 1.00115.33 C ATOM 423 C ARG A 28 -7.575 13.044 26.292 1.00115.33 C ATOM 424 O ARG A 28 -7.667 13.992 25.538 1.00115.33 O ATOM 425 CB ARG A 28 -8.543 11.691 24.432 1.00115.33 C ATOM 426 CG ARG A 28 -8.957 10.277 24.016 1.00115.33 C ATOM 427 CD ARG A 28 -9.639 10.300 22.643 1.00115.33 C ATOM 428 NE ARG A 28 -10.683 9.236 22.593 1.00115.33 N ATOM 429 CZ ARG A 28 -10.345 7.978 22.699 1.00115.33 C ATOM 430 NH1 ARG A 28 -9.089 7.647 22.820 1.00115.33 N ATOM 431 NH2 ARG A 28 -11.264 7.051 22.675 1.00115.33 N ATOM 0 H ARG A 28 -9.311 10.322 27.037 1.00115.33 H new ATOM 0 HA ARG A 28 -7.325 10.935 26.048 1.00115.33 H new ATOM 0 HB2 ARG A 28 -9.373 12.383 24.292 1.00115.33 H new ATOM 0 HB3 ARG A 28 -7.724 12.044 23.805 1.00115.33 H new ATOM 0 HG2 ARG A 28 -8.080 9.630 23.983 1.00115.33 H new ATOM 0 HG3 ARG A 28 -9.635 9.857 24.759 1.00115.33 H new ATOM 0 HD2 ARG A 28 -10.090 11.276 22.464 1.00115.33 H new ATOM 0 HD3 ARG A 28 -8.902 10.140 21.856 1.00115.33 H new ATOM 0 HE ARG A 28 -11.664 9.491 22.476 1.00115.33 H new ATOM 0 HH11 ARG A 28 -8.370 8.370 22.832 1.00115.33 H new ATOM 0 HH12 ARG A 28 -8.826 6.665 22.903 1.00115.33 H new ATOM 0 HH21 ARG A 28 -12.246 7.309 22.574 1.00115.33 H new ATOM 0 HH22 ARG A 28 -11.000 6.069 22.758 1.00115.33 H new ATOM 445 N PRO A 29 -7.019 13.153 27.467 1.00 90.27 N ATOM 446 CA PRO A 29 -6.461 14.428 27.971 1.00 90.27 C ATOM 447 C PRO A 29 -4.983 14.649 27.603 1.00 90.27 C ATOM 448 O PRO A 29 -4.276 15.359 28.289 1.00 90.27 O ATOM 449 CB PRO A 29 -6.626 14.289 29.481 1.00 90.27 C ATOM 450 CG PRO A 29 -6.494 12.819 29.754 1.00 90.27 C ATOM 451 CD PRO A 29 -6.873 12.078 28.458 1.00 90.27 C ATOM 0 HA PRO A 29 -6.967 15.289 27.534 1.00 90.27 H new ATOM 0 HB2 PRO A 29 -5.866 14.859 30.015 1.00 90.27 H new ATOM 0 HB3 PRO A 29 -7.595 14.665 29.808 1.00 90.27 H new ATOM 0 HG2 PRO A 29 -5.475 12.573 30.053 1.00 90.27 H new ATOM 0 HG3 PRO A 29 -7.148 12.520 30.573 1.00 90.27 H new ATOM 0 HD2 PRO A 29 -6.102 11.366 28.165 1.00 90.27 H new ATOM 0 HD3 PRO A 29 -7.799 11.515 28.576 1.00 90.27 H new ATOM 459 N TYR A 30 -4.505 14.065 26.528 1.00131.19 N ATOM 460 CA TYR A 30 -3.078 14.282 26.138 1.00131.19 C ATOM 461 C TYR A 30 -3.067 14.849 24.719 1.00131.19 C ATOM 462 O TYR A 30 -2.836 14.142 23.760 1.00131.19 O ATOM 463 CB TYR A 30 -2.333 12.951 26.195 1.00131.19 C ATOM 464 CG TYR A 30 -2.132 12.583 27.645 1.00131.19 C ATOM 465 CD1 TYR A 30 -1.157 13.243 28.400 1.00131.19 C ATOM 466 CD2 TYR A 30 -2.928 11.596 28.239 1.00131.19 C ATOM 467 CE1 TYR A 30 -0.974 12.917 29.746 1.00131.19 C ATOM 468 CE2 TYR A 30 -2.744 11.268 29.588 1.00131.19 C ATOM 469 CZ TYR A 30 -1.766 11.928 30.342 1.00131.19 C ATOM 470 OH TYR A 30 -1.582 11.605 31.671 1.00131.19 O ATOM 0 H TYR A 30 -5.038 13.453 25.910 1.00131.19 H new ATOM 0 HA TYR A 30 -2.584 14.977 26.816 1.00131.19 H new ATOM 0 HB2 TYR A 30 -2.901 12.175 25.682 1.00131.19 H new ATOM 0 HB3 TYR A 30 -1.372 13.031 25.687 1.00131.19 H new ATOM 0 HD1 TYR A 30 -0.545 14.006 27.942 1.00131.19 H new ATOM 0 HD2 TYR A 30 -3.683 11.088 27.657 1.00131.19 H new ATOM 0 HE1 TYR A 30 -0.221 13.428 30.327 1.00131.19 H new ATOM 0 HE2 TYR A 30 -3.356 10.506 30.047 1.00131.19 H new ATOM 0 HH TYR A 30 -2.214 10.901 31.927 1.00131.19 H new ATOM 480 N PRO A 31 -3.381 16.115 24.592 1.00108.54 N ATOM 481 CA PRO A 31 -3.488 16.790 23.265 1.00108.54 C ATOM 482 C PRO A 31 -2.147 16.996 22.545 1.00108.54 C ATOM 483 O PRO A 31 -1.236 17.599 23.075 1.00108.54 O ATOM 484 CB PRO A 31 -4.133 18.143 23.592 0.50108.54 C ATOM 485 CG PRO A 31 -3.800 18.404 25.025 0.50108.54 C ATOM 486 CD PRO A 31 -3.670 17.039 25.702 0.50108.54 C ATOM 0 HA PRO A 31 -4.061 16.174 22.573 1.00108.54 H new ATOM 0 HB2 PRO A 31 -3.742 18.931 22.948 0.50108.54 H new ATOM 0 HB3 PRO A 31 -5.212 18.112 23.439 0.50108.54 H new ATOM 0 HG2 PRO A 31 -2.871 18.968 25.110 0.50108.54 H new ATOM 0 HG3 PRO A 31 -4.579 18.999 25.501 0.50108.54 H new ATOM 0 HD2 PRO A 31 -2.870 17.036 26.442 0.50108.54 H new ATOM 0 HD3 PRO A 31 -4.587 16.763 26.222 0.50108.54 H new ATOM 494 N CYS A 32 -2.041 16.536 21.328 1.00 43.40 N ATOM 495 CA CYS A 32 -0.785 16.742 20.555 1.00 43.40 C ATOM 496 C CYS A 32 -0.443 18.231 20.567 1.00 43.40 C ATOM 497 O CYS A 32 -1.287 19.077 20.361 1.00 43.40 O ATOM 498 CB CYS A 32 -1.003 16.300 19.109 1.00 43.40 C ATOM 499 SG CYS A 32 0.184 17.124 18.019 1.00 43.40 S ATOM 0 H CYS A 32 -2.773 16.025 20.835 1.00 43.40 H new ATOM 0 HA CYS A 32 0.023 16.162 21.000 1.00 43.40 H new ATOM 0 HB2 CYS A 32 -0.890 15.219 19.030 1.00 43.40 H new ATOM 0 HB3 CYS A 32 -2.020 16.538 18.798 1.00 43.40 H new ATOM 504 N GLN A 33 0.797 18.554 20.800 1.00113.04 N ATOM 505 CA GLN A 33 1.186 19.989 20.817 1.00113.04 C ATOM 506 C GLN A 33 1.426 20.474 19.386 1.00113.04 C ATOM 507 O GLN A 33 1.580 21.656 19.149 1.00113.04 O ATOM 508 CB GLN A 33 2.459 20.190 21.652 1.00113.04 C ATOM 509 CG GLN A 33 3.242 18.879 21.769 1.00113.04 C ATOM 510 CD GLN A 33 2.653 18.016 22.890 1.00113.04 C ATOM 511 OE1 GLN A 33 1.929 17.076 22.630 1.00113.04 O ATOM 512 NE2 GLN A 33 2.939 18.293 24.134 1.00113.04 N ATOM 0 H GLN A 33 1.552 17.892 20.978 1.00113.04 H new ATOM 0 HA GLN A 33 0.378 20.566 21.267 1.00113.04 H new ATOM 0 HB2 GLN A 33 3.085 20.954 21.191 1.00113.04 H new ATOM 0 HB3 GLN A 33 2.195 20.552 22.646 1.00113.04 H new ATOM 0 HG2 GLN A 33 3.204 18.338 20.824 1.00113.04 H new ATOM 0 HG3 GLN A 33 4.292 19.090 21.974 1.00113.04 H new ATOM 0 HE21 GLN A 33 3.547 19.082 24.354 1.00113.04 H new ATOM 0 HE22 GLN A 33 2.555 17.720 24.885 1.00113.04 H new ATOM 521 N TYR A 34 1.496 19.584 18.429 1.00118.47 N ATOM 522 CA TYR A 34 1.763 20.015 17.026 1.00118.47 C ATOM 523 C TYR A 34 0.495 19.962 16.167 1.00118.47 C ATOM 524 O TYR A 34 -0.068 20.983 15.828 1.00118.47 O ATOM 525 CB TYR A 34 2.819 19.092 16.441 1.00118.47 C ATOM 526 CG TYR A 34 4.027 19.154 17.331 1.00118.47 C ATOM 527 CD1 TYR A 34 4.943 20.200 17.192 1.00118.47 C ATOM 528 CD2 TYR A 34 4.213 18.181 18.311 1.00118.47 C ATOM 529 CE1 TYR A 34 6.056 20.273 18.038 1.00118.47 C ATOM 530 CE2 TYR A 34 5.325 18.252 19.164 1.00118.47 C ATOM 531 CZ TYR A 34 6.247 19.298 19.025 1.00118.47 C ATOM 532 OH TYR A 34 7.340 19.374 19.865 1.00118.47 O ATOM 0 H TYR A 34 1.380 18.579 18.559 1.00118.47 H new ATOM 0 HA TYR A 34 2.109 21.049 17.032 1.00118.47 H new ATOM 0 HB2 TYR A 34 2.442 18.071 16.379 1.00118.47 H new ATOM 0 HB3 TYR A 34 3.075 19.399 15.427 1.00118.47 H new ATOM 0 HD1 TYR A 34 4.792 20.952 16.432 1.00118.47 H new ATOM 0 HD2 TYR A 34 3.503 17.374 18.414 1.00118.47 H new ATOM 0 HE1 TYR A 34 6.766 21.080 17.930 1.00118.47 H new ATOM 0 HE2 TYR A 34 5.470 17.501 19.927 1.00118.47 H new ATOM 0 HH TYR A 34 7.323 18.622 20.493 1.00118.47 H new ATOM 542 N CYS A 35 0.049 18.789 15.786 1.00 56.06 N ATOM 543 CA CYS A 35 -1.181 18.732 14.915 1.00 56.06 C ATOM 544 C CYS A 35 -2.466 18.745 15.755 1.00 56.06 C ATOM 545 O CYS A 35 -3.509 19.146 15.278 1.00 56.06 O ATOM 546 CB CYS A 35 -1.162 17.539 13.938 1.00 56.06 C ATOM 547 SG CYS A 35 -1.263 15.940 14.782 1.00 56.06 S ATOM 0 H CYS A 35 0.465 17.890 16.028 1.00 56.06 H new ATOM 0 HA CYS A 35 -1.170 19.635 14.305 1.00 56.06 H new ATOM 0 HB2 CYS A 35 -1.996 17.631 13.243 1.00 56.06 H new ATOM 0 HB3 CYS A 35 -0.248 17.575 13.345 1.00 56.06 H new ATOM 552 N GLY A 36 -2.401 18.410 17.018 1.00 19.15 N ATOM 553 CA GLY A 36 -3.626 18.523 17.872 1.00 19.15 C ATOM 554 C GLY A 36 -4.365 17.198 18.121 1.00 19.15 C ATOM 555 O GLY A 36 -5.376 17.205 18.793 1.00 19.15 O ATOM 0 H GLY A 36 -1.565 18.067 17.492 1.00 19.15 H new ATOM 0 HA2 GLY A 36 -3.343 18.951 18.834 1.00 19.15 H new ATOM 0 HA3 GLY A 36 -4.316 19.224 17.402 1.00 19.15 H new ATOM 559 N LYS A 37 -3.942 16.076 17.623 1.00 73.47 N ATOM 560 CA LYS A 37 -4.745 14.853 17.934 1.00 73.47 C ATOM 561 C LYS A 37 -4.873 14.763 19.464 1.00 73.47 C ATOM 562 O LYS A 37 -4.155 15.428 20.173 1.00 73.47 O ATOM 563 CB LYS A 37 -4.051 13.595 17.389 1.00 73.47 C ATOM 564 CG LYS A 37 -4.651 13.219 16.034 1.00 73.47 C ATOM 565 CD LYS A 37 -3.848 12.073 15.423 1.00 73.47 C ATOM 566 CE LYS A 37 -4.586 11.529 14.197 1.00 73.47 C ATOM 567 NZ LYS A 37 -4.969 12.657 13.295 1.00 73.47 N ATOM 0 H LYS A 37 -3.115 15.945 17.040 1.00 73.47 H new ATOM 0 HA LYS A 37 -5.727 14.918 17.465 1.00 73.47 H new ATOM 0 HB2 LYS A 37 -2.981 13.775 17.286 1.00 73.47 H new ATOM 0 HB3 LYS A 37 -4.170 12.770 18.091 1.00 73.47 H new ATOM 0 HG2 LYS A 37 -5.693 12.923 16.155 1.00 73.47 H new ATOM 0 HG3 LYS A 37 -4.640 14.081 15.367 1.00 73.47 H new ATOM 0 HD2 LYS A 37 -2.855 12.422 15.138 1.00 73.47 H new ATOM 0 HD3 LYS A 37 -3.708 11.280 16.158 1.00 73.47 H new ATOM 0 HE2 LYS A 37 -3.950 10.823 13.662 1.00 73.47 H new ATOM 0 HE3 LYS A 37 -5.476 10.983 14.510 1.00 73.47 H new ATOM 0 HZ1 LYS A 37 -5.202 12.284 12.353 1.00 73.47 H new ATOM 0 HZ2 LYS A 37 -5.797 13.149 13.687 1.00 73.47 H new ATOM 0 HZ3 LYS A 37 -4.175 13.324 13.217 1.00 73.47 H new ATOM 581 N ARG A 38 -5.765 13.966 19.987 1.00160.56 N ATOM 582 CA ARG A 38 -5.894 13.872 21.484 1.00160.56 C ATOM 583 C ARG A 38 -5.727 12.416 21.910 1.00160.56 C ATOM 584 O ARG A 38 -6.582 11.584 21.682 1.00160.56 O ATOM 585 CB ARG A 38 -7.262 14.395 21.963 1.00160.56 C ATOM 586 CG ARG A 38 -7.730 15.585 21.104 1.00160.56 C ATOM 587 CD ARG A 38 -7.097 16.891 21.602 1.00160.56 C ATOM 588 NE ARG A 38 -7.730 18.055 20.901 1.00160.56 N ATOM 589 CZ ARG A 38 -8.967 18.400 21.165 1.00160.56 C ATOM 590 NH1 ARG A 38 -9.649 17.755 22.070 1.00160.56 N ATOM 591 NH2 ARG A 38 -9.521 19.400 20.528 1.00160.56 N ATOM 0 H ARG A 38 -6.407 13.378 19.455 1.00160.56 H new ATOM 0 HA ARG A 38 -5.119 14.490 21.937 1.00160.56 H new ATOM 0 HB2 ARG A 38 -7.999 13.594 21.913 1.00160.56 H new ATOM 0 HB3 ARG A 38 -7.193 14.700 23.007 1.00160.56 H new ATOM 0 HG2 ARG A 38 -7.459 15.417 20.062 1.00160.56 H new ATOM 0 HG3 ARG A 38 -8.817 15.663 21.142 1.00160.56 H new ATOM 0 HD2 ARG A 38 -7.232 16.985 22.679 1.00160.56 H new ATOM 0 HD3 ARG A 38 -6.023 16.881 21.415 1.00160.56 H new ATOM 0 HE ARG A 38 -7.194 18.583 20.213 1.00160.56 H new ATOM 0 HH11 ARG A 38 -9.220 16.979 22.575 1.00160.56 H new ATOM 0 HH12 ARG A 38 -10.611 18.026 22.273 1.00160.56 H new ATOM 0 HH21 ARG A 38 -8.990 19.913 19.824 1.00160.56 H new ATOM 0 HH22 ARG A 38 -10.484 19.666 20.735 1.00160.56 H new ATOM 605 N PHE A 39 -4.607 12.096 22.519 1.00 72.45 N ATOM 606 CA PHE A 39 -4.333 10.698 22.950 1.00 72.45 C ATOM 607 C PHE A 39 -4.851 10.446 24.362 1.00 72.45 C ATOM 608 O PHE A 39 -5.243 11.360 25.079 1.00 72.45 O ATOM 609 CB PHE A 39 -2.819 10.507 22.969 1.00 72.45 C ATOM 610 CG PHE A 39 -2.280 10.670 21.576 1.00 72.45 C ATOM 611 CD1 PHE A 39 -2.219 11.941 20.990 1.00 72.45 C ATOM 612 CD2 PHE A 39 -1.854 9.547 20.864 1.00 72.45 C ATOM 613 CE1 PHE A 39 -1.739 12.086 19.688 1.00 72.45 C ATOM 614 CE2 PHE A 39 -1.368 9.693 19.565 1.00 72.45 C ATOM 615 CZ PHE A 39 -1.314 10.960 18.976 1.00 72.45 C ATOM 0 H PHE A 39 -3.864 12.760 22.736 1.00 72.45 H new ATOM 0 HA PHE A 39 -4.828 10.011 22.264 1.00 72.45 H new ATOM 0 HB2 PHE A 39 -2.358 11.234 23.637 1.00 72.45 H new ATOM 0 HB3 PHE A 39 -2.571 9.518 23.354 1.00 72.45 H new ATOM 0 HD1 PHE A 39 -2.543 12.808 21.546 1.00 72.45 H new ATOM 0 HD2 PHE A 39 -1.901 8.568 21.318 1.00 72.45 H new ATOM 0 HE1 PHE A 39 -1.696 13.064 19.232 1.00 72.45 H new ATOM 0 HE2 PHE A 39 -1.033 8.827 19.014 1.00 72.45 H new ATOM 0 HZ PHE A 39 -0.943 11.069 17.968 1.00 72.45 H new ATOM 625 N HIS A 40 -4.830 9.196 24.760 1.00 97.77 N ATOM 626 CA HIS A 40 -5.301 8.811 26.116 1.00 97.77 C ATOM 627 C HIS A 40 -4.161 8.210 26.944 1.00 97.77 C ATOM 628 O HIS A 40 -4.368 7.276 27.683 1.00 97.77 O ATOM 629 CB HIS A 40 -6.423 7.780 25.992 1.00 97.77 C ATOM 630 CG HIS A 40 -6.006 6.668 25.066 1.00 97.77 C ATOM 631 ND1 HIS A 40 -6.871 5.641 24.728 1.00 97.77 N ATOM 632 CD2 HIS A 40 -4.832 6.401 24.402 1.00 97.77 C ATOM 633 CE1 HIS A 40 -6.216 4.811 23.898 1.00 97.77 C ATOM 634 NE2 HIS A 40 -4.968 5.227 23.665 1.00 97.77 N ATOM 0 H HIS A 40 -4.500 8.418 24.188 1.00 97.77 H new ATOM 0 HA HIS A 40 -5.664 9.707 26.619 1.00 97.77 H new ATOM 0 HB2 HIS A 40 -6.664 7.374 26.974 1.00 97.77 H new ATOM 0 HB3 HIS A 40 -7.327 8.258 25.614 1.00 97.77 H new ATOM 0 HD2 HIS A 40 -3.940 7.009 24.445 1.00 97.77 H new ATOM 0 HE1 HIS A 40 -6.646 3.917 23.471 1.00 97.77 H new ATOM 0 HE2 HIS A 40 -4.266 4.781 23.075 1.00 97.77 H new ATOM 642 N GLN A 41 -2.975 8.757 26.855 1.00106.11 N ATOM 643 CA GLN A 41 -1.837 8.235 27.680 1.00106.11 C ATOM 644 C GLN A 41 -0.583 9.063 27.359 1.00106.11 C ATOM 645 O GLN A 41 0.006 8.942 26.301 1.00106.11 O ATOM 646 CB GLN A 41 -1.586 6.747 27.389 1.00106.11 C ATOM 647 CG GLN A 41 -2.315 5.863 28.426 1.00106.11 C ATOM 648 CD GLN A 41 -2.587 4.476 27.820 1.00106.11 C ATOM 649 OE1 GLN A 41 -1.876 4.044 26.937 1.00106.11 O ATOM 650 NE2 GLN A 41 -3.592 3.754 28.256 1.00106.11 N ATOM 0 H GLN A 41 -2.743 9.543 26.247 1.00106.11 H new ATOM 0 HA GLN A 41 -2.083 8.326 28.738 1.00106.11 H new ATOM 0 HB2 GLN A 41 -1.934 6.503 26.385 1.00106.11 H new ATOM 0 HB3 GLN A 41 -0.516 6.541 27.414 1.00106.11 H new ATOM 0 HG2 GLN A 41 -1.708 5.765 29.326 1.00106.11 H new ATOM 0 HG3 GLN A 41 -3.253 6.332 28.723 1.00106.11 H new ATOM 0 HE21 GLN A 41 -4.193 4.112 28.998 1.00106.11 H new ATOM 0 HE22 GLN A 41 -3.772 2.835 27.853 1.00106.11 H new ATOM 659 N LYS A 42 -0.204 9.923 28.261 1.00136.29 N ATOM 660 CA LYS A 42 0.983 10.817 28.050 1.00136.29 C ATOM 661 C LYS A 42 2.068 10.161 27.206 1.00136.29 C ATOM 662 O LYS A 42 2.373 10.602 26.118 1.00136.29 O ATOM 663 CB LYS A 42 1.601 11.170 29.400 1.00136.29 C ATOM 664 CG LYS A 42 2.512 12.381 29.212 1.00136.29 C ATOM 665 CD LYS A 42 3.193 12.724 30.533 1.00136.29 C ATOM 666 CE LYS A 42 3.713 14.159 30.470 1.00136.29 C ATOM 667 NZ LYS A 42 2.569 15.091 30.261 1.00136.29 N ATOM 0 H LYS A 42 -0.673 10.051 29.157 1.00136.29 H new ATOM 0 HA LYS A 42 0.620 11.701 27.526 1.00136.29 H new ATOM 0 HB2 LYS A 42 0.821 11.392 30.128 1.00136.29 H new ATOM 0 HB3 LYS A 42 2.169 10.325 29.789 1.00136.29 H new ATOM 0 HG2 LYS A 42 3.262 12.169 28.450 1.00136.29 H new ATOM 0 HG3 LYS A 42 1.931 13.233 28.859 1.00136.29 H new ATOM 0 HD2 LYS A 42 2.489 12.615 31.358 1.00136.29 H new ATOM 0 HD3 LYS A 42 4.015 12.034 30.722 1.00136.29 H new ATOM 0 HE2 LYS A 42 4.236 14.409 31.393 1.00136.29 H new ATOM 0 HE3 LYS A 42 4.433 14.261 29.658 1.00136.29 H new ATOM 0 HZ1 LYS A 42 2.644 15.887 30.926 1.00136.29 H new ATOM 0 HZ2 LYS A 42 2.589 15.451 29.286 1.00136.29 H new ATOM 0 HZ3 LYS A 42 1.675 14.586 30.425 1.00136.29 H new ATOM 681 N SER A 43 2.666 9.123 27.710 1.00 65.22 N ATOM 682 CA SER A 43 3.751 8.427 26.970 1.00 65.22 C ATOM 683 C SER A 43 3.301 8.049 25.562 1.00 65.22 C ATOM 684 O SER A 43 4.045 8.185 24.613 1.00 65.22 O ATOM 685 CB SER A 43 4.108 7.170 27.743 1.00 65.22 C ATOM 686 OG SER A 43 4.326 7.529 29.101 1.00 65.22 O ATOM 0 H SER A 43 2.445 8.720 28.620 1.00 65.22 H new ATOM 0 HA SER A 43 4.612 9.089 26.878 1.00 65.22 H new ATOM 0 HB2 SER A 43 3.305 6.437 27.668 1.00 65.22 H new ATOM 0 HB3 SER A 43 5.002 6.707 27.324 1.00 65.22 H new ATOM 0 HG SER A 43 4.556 6.729 29.618 1.00 65.22 H new ATOM 692 N ASP A 44 2.086 7.623 25.404 1.00 40.66 N ATOM 693 CA ASP A 44 1.628 7.297 24.032 1.00 40.66 C ATOM 694 C ASP A 44 1.631 8.594 23.233 1.00 40.66 C ATOM 695 O ASP A 44 2.094 8.634 22.108 1.00 40.66 O ATOM 696 CB ASP A 44 0.238 6.669 24.043 1.00 40.66 C ATOM 697 CG ASP A 44 -0.207 6.429 22.601 1.00 40.66 C ATOM 698 OD1 ASP A 44 0.624 6.561 21.716 1.00 40.66 O ATOM 699 OD2 ASP A 44 -1.369 6.117 22.404 1.00 40.66 O ATOM 0 H ASP A 44 1.401 7.488 26.148 1.00 40.66 H new ATOM 0 HA ASP A 44 2.295 6.564 23.579 1.00 40.66 H new ATOM 0 HB2 ASP A 44 0.253 5.729 24.594 1.00 40.66 H new ATOM 0 HB3 ASP A 44 -0.468 7.325 24.551 1.00 40.66 H new ATOM 704 N MET A 45 1.182 9.679 23.799 1.00 31.66 N ATOM 705 CA MET A 45 1.248 10.941 23.031 1.00 31.66 C ATOM 706 C MET A 45 2.719 11.241 22.783 1.00 31.66 C ATOM 707 O MET A 45 3.121 11.609 21.707 1.00 31.66 O ATOM 708 CB MET A 45 0.659 12.099 23.836 0.50 31.66 C ATOM 709 CG MET A 45 0.925 13.405 23.081 0.50 31.66 C ATOM 710 SD MET A 45 0.214 14.804 23.980 1.00 31.66 S ATOM 711 CE MET A 45 1.306 14.737 25.423 1.00 31.66 C ATOM 0 H MET A 45 0.783 9.743 24.736 1.00 31.66 H new ATOM 0 HA MET A 45 0.685 10.835 22.104 1.00 31.66 H new ATOM 0 HB2 MET A 45 -0.412 11.955 23.977 0.50 31.66 H new ATOM 0 HB3 MET A 45 1.109 12.137 24.828 0.50 31.66 H new ATOM 0 HG2 MET A 45 1.998 13.550 22.958 0.50 31.66 H new ATOM 0 HG3 MET A 45 0.494 13.349 22.081 0.50 31.66 H new ATOM 0 HE1 MET A 45 1.388 15.731 25.863 1.00 31.66 H new ATOM 0 HE2 MET A 45 0.894 14.047 26.159 1.00 31.66 H new ATOM 0 HE3 MET A 45 2.294 14.393 25.116 1.00 31.66 H new ATOM 721 N LYS A 46 3.536 11.097 23.798 1.00103.12 N ATOM 722 CA LYS A 46 4.974 11.389 23.611 1.00103.12 C ATOM 723 C LYS A 46 5.443 10.616 22.393 1.00103.12 C ATOM 724 O LYS A 46 6.148 11.129 21.551 1.00103.12 O ATOM 725 CB LYS A 46 5.779 10.971 24.840 1.00103.12 C ATOM 726 CG LYS A 46 5.551 11.978 25.973 1.00103.12 C ATOM 727 CD LYS A 46 6.513 11.664 27.120 1.00103.12 C ATOM 728 CE LYS A 46 6.341 12.683 28.256 1.00103.12 C ATOM 729 NZ LYS A 46 5.766 13.950 27.724 1.00103.12 N ATOM 0 H LYS A 46 3.265 10.793 24.733 1.00103.12 H new ATOM 0 HA LYS A 46 5.122 12.460 23.471 1.00103.12 H new ATOM 0 HB2 LYS A 46 5.479 9.973 25.161 1.00103.12 H new ATOM 0 HB3 LYS A 46 6.839 10.921 24.593 1.00103.12 H new ATOM 0 HG2 LYS A 46 5.714 12.994 25.612 1.00103.12 H new ATOM 0 HG3 LYS A 46 4.520 11.925 26.322 1.00103.12 H new ATOM 0 HD2 LYS A 46 6.327 10.657 27.494 1.00103.12 H new ATOM 0 HD3 LYS A 46 7.541 11.684 26.757 1.00103.12 H new ATOM 0 HE2 LYS A 46 5.688 12.273 29.027 1.00103.12 H new ATOM 0 HE3 LYS A 46 7.304 12.881 28.727 1.00103.12 H new ATOM 0 HZ1 LYS A 46 5.856 14.700 28.439 1.00103.12 H new ATOM 0 HZ2 LYS A 46 6.278 14.229 26.863 1.00103.12 H new ATOM 0 HZ3 LYS A 46 4.761 13.807 27.498 1.00103.12 H new ATOM 743 N LYS A 47 5.018 9.388 22.272 1.00 48.51 N ATOM 744 CA LYS A 47 5.407 8.605 21.076 1.00 48.51 C ATOM 745 C LYS A 47 4.874 9.376 19.863 1.00 48.51 C ATOM 746 O LYS A 47 5.484 9.421 18.806 1.00 48.51 O ATOM 747 CB LYS A 47 4.816 7.181 21.162 1.00 48.51 C ATOM 748 CG LYS A 47 5.645 6.362 22.168 1.00 48.51 C ATOM 749 CD LYS A 47 5.326 4.863 22.062 1.00 48.51 C ATOM 750 CE LYS A 47 3.921 4.567 22.601 1.00 48.51 C ATOM 751 NZ LYS A 47 3.728 3.090 22.693 1.00 48.51 N ATOM 0 H LYS A 47 4.425 8.901 22.944 1.00 48.51 H new ATOM 0 HA LYS A 47 6.488 8.486 20.998 1.00 48.51 H new ATOM 0 HB2 LYS A 47 3.773 7.223 21.477 1.00 48.51 H new ATOM 0 HB3 LYS A 47 4.834 6.705 20.182 1.00 48.51 H new ATOM 0 HG2 LYS A 47 6.707 6.524 21.985 1.00 48.51 H new ATOM 0 HG3 LYS A 47 5.439 6.709 23.181 1.00 48.51 H new ATOM 0 HD2 LYS A 47 5.396 4.544 21.022 1.00 48.51 H new ATOM 0 HD3 LYS A 47 6.064 4.289 22.622 1.00 48.51 H new ATOM 0 HE2 LYS A 47 3.792 5.024 23.582 1.00 48.51 H new ATOM 0 HE3 LYS A 47 3.168 5.003 21.945 1.00 48.51 H new ATOM 0 HZ1 LYS A 47 2.776 2.886 23.058 1.00 48.51 H new ATOM 0 HZ2 LYS A 47 3.835 2.667 21.749 1.00 48.51 H new ATOM 0 HZ3 LYS A 47 4.439 2.686 23.336 1.00 48.51 H new ATOM 765 N HIS A 48 3.774 10.065 20.045 1.00 65.66 N ATOM 766 CA HIS A 48 3.234 10.906 18.939 1.00 65.66 C ATOM 767 C HIS A 48 4.180 12.114 18.773 1.00 65.66 C ATOM 768 O HIS A 48 4.868 12.267 17.766 1.00 65.66 O ATOM 769 CB HIS A 48 1.818 11.371 19.312 1.00 65.66 C ATOM 770 CG HIS A 48 1.267 12.246 18.234 1.00 65.66 C ATOM 771 ND1 HIS A 48 0.642 11.743 17.082 1.00 65.66 N ATOM 772 CD2 HIS A 48 1.273 13.598 18.096 1.00 65.66 C ATOM 773 CE1 HIS A 48 0.313 12.800 16.309 1.00 65.66 C ATOM 774 NE2 HIS A 48 0.682 13.917 16.904 1.00 65.66 N ATOM 0 H HIS A 48 3.231 10.080 20.908 1.00 65.66 H new ATOM 0 HA HIS A 48 3.177 10.350 18.003 1.00 65.66 H new ATOM 0 HB2 HIS A 48 1.169 10.507 19.458 1.00 65.66 H new ATOM 0 HB3 HIS A 48 1.842 11.915 20.256 1.00 65.66 H new ATOM 0 HD1 HIS A 48 0.469 10.761 16.868 1.00 65.66 H new ATOM 0 HD2 HIS A 48 1.677 14.303 18.808 1.00 65.66 H new ATOM 0 HE1 HIS A 48 -0.178 12.740 15.349 1.00 65.66 H new ATOM 782 N THR A 49 4.255 12.963 19.766 1.00 47.02 N ATOM 783 CA THR A 49 5.173 14.133 19.708 1.00 47.02 C ATOM 784 C THR A 49 6.531 13.704 19.163 1.00 47.02 C ATOM 785 O THR A 49 7.226 14.463 18.510 1.00 47.02 O ATOM 786 CB THR A 49 5.388 14.626 21.137 1.00 47.02 C ATOM 787 OG1 THR A 49 5.695 13.518 21.962 1.00 47.02 O ATOM 788 CG2 THR A 49 4.121 15.316 21.653 1.00 47.02 C ATOM 0 H THR A 49 3.710 12.891 20.625 1.00 47.02 H new ATOM 0 HA THR A 49 4.744 14.904 19.068 1.00 47.02 H new ATOM 0 HB THR A 49 6.209 15.343 21.155 1.00 47.02 H new ATOM 0 HG1 THR A 49 5.900 12.740 21.402 1.00 47.02 H new ATOM 0 HG21 THR A 49 4.286 15.664 22.673 1.00 47.02 H new ATOM 0 HG22 THR A 49 3.884 16.166 21.014 1.00 47.02 H new ATOM 0 HG23 THR A 49 3.291 14.610 21.640 1.00 47.02 H new ATOM 796 N PHE A 50 6.912 12.486 19.421 1.00 54.63 N ATOM 797 CA PHE A 50 8.218 11.988 18.923 1.00 54.63 C ATOM 798 C PHE A 50 8.138 11.795 17.401 1.00 54.63 C ATOM 799 O PHE A 50 9.089 12.050 16.690 1.00 54.63 O ATOM 800 CB PHE A 50 8.543 10.662 19.624 1.00 54.63 C ATOM 801 CG PHE A 50 9.244 10.918 20.952 1.00 54.63 C ATOM 802 CD1 PHE A 50 8.937 12.056 21.721 1.00 54.63 C ATOM 803 CD2 PHE A 50 10.195 10.001 21.422 1.00 54.63 C ATOM 804 CE1 PHE A 50 9.590 12.272 22.945 1.00 54.63 C ATOM 805 CE2 PHE A 50 10.843 10.221 22.644 1.00 54.63 C ATOM 806 CZ PHE A 50 10.539 11.352 23.406 1.00 54.63 C ATOM 0 H PHE A 50 6.369 11.811 19.960 1.00 54.63 H new ATOM 0 HA PHE A 50 9.009 12.706 19.141 1.00 54.63 H new ATOM 0 HB2 PHE A 50 7.625 10.099 19.793 1.00 54.63 H new ATOM 0 HB3 PHE A 50 9.178 10.051 18.983 1.00 54.63 H new ATOM 0 HD1 PHE A 50 8.200 12.763 21.370 1.00 54.63 H new ATOM 0 HD2 PHE A 50 10.429 9.122 20.840 1.00 54.63 H new ATOM 0 HE1 PHE A 50 9.360 13.149 23.532 1.00 54.63 H new ATOM 0 HE2 PHE A 50 11.579 9.515 22.998 1.00 54.63 H new ATOM 0 HZ PHE A 50 11.036 11.516 24.351 1.00 54.63 H new ATOM 816 N ILE A 51 6.996 11.406 16.881 1.00 99.09 N ATOM 817 CA ILE A 51 6.903 11.295 15.391 1.00 99.09 C ATOM 818 C ILE A 51 7.039 12.711 14.788 1.00 99.09 C ATOM 819 O ILE A 51 7.664 12.872 13.761 1.00 99.09 O ATOM 820 CB ILE A 51 5.606 10.607 14.908 1.00 99.09 C ATOM 821 CG1 ILE A 51 4.417 11.574 14.954 1.00 99.09 C ATOM 822 CG2 ILE A 51 5.298 9.382 15.771 1.00 99.09 C ATOM 823 CD1 ILE A 51 3.204 10.914 14.297 1.00 99.09 C ATOM 0 H ILE A 51 6.152 11.168 17.403 1.00 99.09 H new ATOM 0 HA ILE A 51 7.714 10.653 15.047 1.00 99.09 H new ATOM 0 HB ILE A 51 5.763 10.294 13.876 1.00 99.09 H new ATOM 0 HG12 ILE A 51 4.187 11.838 15.986 1.00 99.09 H new ATOM 0 HG13 ILE A 51 4.666 12.500 14.436 1.00 99.09 H new ATOM 0 HG21 ILE A 51 4.382 8.909 15.418 1.00 99.09 H new ATOM 0 HG22 ILE A 51 6.122 8.672 15.703 1.00 99.09 H new ATOM 0 HG23 ILE A 51 5.170 9.691 16.809 1.00 99.09 H new ATOM 0 HD11 ILE A 51 2.356 11.598 14.328 1.00 99.09 H new ATOM 0 HD12 ILE A 51 3.438 10.673 13.260 1.00 99.09 H new ATOM 0 HD13 ILE A 51 2.952 10.000 14.834 1.00 99.09 H new ATOM 835 N HIS A 52 6.509 13.744 15.408 1.00 59.33 N ATOM 836 CA HIS A 52 6.702 15.129 14.803 1.00 59.33 C ATOM 837 C HIS A 52 8.162 15.564 14.925 1.00 59.33 C ATOM 838 O HIS A 52 8.679 16.297 14.106 1.00 59.33 O ATOM 839 CB HIS A 52 5.933 16.206 15.558 1.00 59.33 C ATOM 840 CG HIS A 52 4.471 16.172 15.263 1.00 59.33 C ATOM 841 ND1 HIS A 52 3.904 16.625 14.057 1.00 59.33 N ATOM 842 CD2 HIS A 52 3.435 15.841 16.067 1.00 59.33 C ATOM 843 CE1 HIS A 52 2.555 16.556 14.200 1.00 59.33 C ATOM 844 NE2 HIS A 52 2.260 16.089 15.406 1.00 59.33 N ATOM 0 H HIS A 52 5.970 13.706 16.273 1.00 59.33 H new ATOM 0 HA HIS A 52 6.359 15.042 13.772 1.00 59.33 H new ATOM 0 HB2 HIS A 52 6.088 16.076 16.629 1.00 59.33 H new ATOM 0 HB3 HIS A 52 6.332 17.186 15.295 1.00 59.33 H new ATOM 0 HD1 HIS A 52 4.411 16.945 13.231 1.00 59.33 H new ATOM 0 HD2 HIS A 52 3.520 15.445 17.068 1.00 59.33 H new ATOM 0 HE1 HIS A 52 1.833 16.838 13.447 1.00 59.33 H new ATOM 852 N THR A 53 8.820 15.135 15.969 1.00 97.33 N ATOM 853 CA THR A 53 10.237 15.544 16.181 1.00 97.33 C ATOM 854 C THR A 53 11.153 14.658 15.352 1.00 97.33 C ATOM 855 O THR A 53 12.311 14.960 15.140 1.00 97.33 O ATOM 856 CB THR A 53 10.589 15.369 17.664 1.00 97.33 C ATOM 857 OG1 THR A 53 10.351 14.024 18.042 1.00 97.33 O ATOM 858 CG2 THR A 53 9.733 16.303 18.524 1.00 97.33 C ATOM 0 H THR A 53 8.436 14.518 16.685 1.00 97.33 H new ATOM 0 HA THR A 53 10.365 16.584 15.882 1.00 97.33 H new ATOM 0 HB THR A 53 11.640 15.616 17.816 1.00 97.33 H new ATOM 0 HG1 THR A 53 9.864 13.564 17.327 1.00 97.33 H new ATOM 0 HG21 THR A 53 9.992 16.170 19.574 1.00 97.33 H new ATOM 0 HG22 THR A 53 9.918 17.337 18.233 1.00 97.33 H new ATOM 0 HG23 THR A 53 8.679 16.068 18.378 1.00 97.33 H new ATOM 866 N GLY A 54 10.653 13.541 14.916 1.00 23.68 N ATOM 867 CA GLY A 54 11.491 12.595 14.143 1.00 23.68 C ATOM 868 C GLY A 54 12.256 11.743 15.145 1.00 23.68 C ATOM 869 O GLY A 54 13.258 11.136 14.828 1.00 23.68 O ATOM 0 H GLY A 54 9.689 13.241 15.064 1.00 23.68 H new ATOM 0 HA2 GLY A 54 10.871 11.969 13.501 1.00 23.68 H new ATOM 0 HA3 GLY A 54 12.180 13.135 13.493 1.00 23.68 H new ATOM 873 N GLU A 55 11.810 11.731 16.366 1.00 47.26 N ATOM 874 CA GLU A 55 12.532 10.962 17.409 1.00 47.26 C ATOM 875 C GLU A 55 12.245 9.468 17.262 1.00 47.26 C ATOM 876 O GLU A 55 11.129 9.009 17.392 1.00 47.26 O ATOM 877 CB GLU A 55 12.100 11.481 18.788 1.00 47.26 C ATOM 878 CG GLU A 55 13.022 12.640 19.194 1.00 47.26 C ATOM 879 CD GLU A 55 12.537 13.258 20.502 1.00 47.26 C ATOM 880 OE1 GLU A 55 11.518 12.815 21.004 1.00 47.26 O ATOM 881 OE2 GLU A 55 13.193 14.170 20.984 1.00 47.26 O ATOM 0 H GLU A 55 10.975 12.222 16.687 1.00 47.26 H new ATOM 0 HA GLU A 55 13.608 11.098 17.298 1.00 47.26 H new ATOM 0 HB2 GLU A 55 11.064 11.817 18.757 1.00 47.26 H new ATOM 0 HB3 GLU A 55 12.153 10.680 19.526 1.00 47.26 H new ATOM 0 HG2 GLU A 55 14.044 12.279 19.309 1.00 47.26 H new ATOM 0 HG3 GLU A 55 13.037 13.396 18.409 1.00 47.26 H new ATOM 888 N LYS A 56 13.271 8.712 16.986 1.00 86.79 N ATOM 889 CA LYS A 56 13.109 7.240 16.817 1.00 86.79 C ATOM 890 C LYS A 56 14.080 6.527 17.759 1.00 86.79 C ATOM 891 O LYS A 56 15.129 6.069 17.351 1.00 86.79 O ATOM 892 CB LYS A 56 13.408 6.865 15.365 1.00 86.79 C ATOM 893 CG LYS A 56 12.598 7.769 14.423 1.00 86.79 C ATOM 894 CD LYS A 56 11.111 7.386 14.476 1.00 86.79 C ATOM 895 CE LYS A 56 10.360 8.043 13.308 1.00 86.79 C ATOM 896 NZ LYS A 56 8.969 8.378 13.732 1.00 86.79 N ATOM 0 H LYS A 56 14.225 9.054 16.869 1.00 86.79 H new ATOM 0 HA LYS A 56 12.089 6.940 17.056 1.00 86.79 H new ATOM 0 HB2 LYS A 56 14.474 6.973 15.163 1.00 86.79 H new ATOM 0 HB3 LYS A 56 13.155 5.819 15.189 1.00 86.79 H new ATOM 0 HG2 LYS A 56 12.723 8.813 14.711 1.00 86.79 H new ATOM 0 HG3 LYS A 56 12.971 7.672 13.403 1.00 86.79 H new ATOM 0 HD2 LYS A 56 11.004 6.302 14.425 1.00 86.79 H new ATOM 0 HD3 LYS A 56 10.678 7.705 15.424 1.00 86.79 H new ATOM 0 HE2 LYS A 56 10.881 8.946 12.989 1.00 86.79 H new ATOM 0 HE3 LYS A 56 10.338 7.369 12.452 1.00 86.79 H new ATOM 0 HZ1 LYS A 56 8.478 8.868 12.957 1.00 86.79 H new ATOM 0 HZ2 LYS A 56 8.458 7.503 13.967 1.00 86.79 H new ATOM 0 HZ3 LYS A 56 9.000 8.996 14.568 1.00 86.79 H new ATOM 910 N PRO A 57 13.735 6.451 19.019 1.00151.44 N ATOM 911 CA PRO A 57 14.591 5.803 20.045 1.00151.44 C ATOM 912 C PRO A 57 14.762 4.304 19.812 1.00151.44 C ATOM 913 O PRO A 57 15.593 3.683 20.443 1.00151.44 O ATOM 914 CB PRO A 57 13.885 6.063 21.380 1.00151.44 C ATOM 915 CG PRO A 57 12.482 6.457 21.039 1.00151.44 C ATOM 916 CD PRO A 57 12.487 6.975 19.597 1.00151.44 C ATOM 0 HA PRO A 57 15.600 6.213 20.015 1.00151.44 H new ATOM 0 HB2 PRO A 57 13.898 5.172 22.007 1.00151.44 H new ATOM 0 HB3 PRO A 57 14.387 6.853 21.939 1.00151.44 H new ATOM 0 HG2 PRO A 57 11.810 5.605 21.138 1.00151.44 H new ATOM 0 HG3 PRO A 57 12.123 7.227 21.722 1.00151.44 H new ATOM 0 HD2 PRO A 57 11.616 6.621 19.046 1.00151.44 H new ATOM 0 HD3 PRO A 57 12.463 8.064 19.567 1.00151.44 H new ATOM 924 N HIS A 58 14.018 3.700 18.922 1.00 42.67 N ATOM 925 CA HIS A 58 14.229 2.239 18.717 1.00 42.67 C ATOM 926 C HIS A 58 14.818 2.000 17.325 1.00 42.67 C ATOM 927 O HIS A 58 14.107 1.943 16.345 1.00 42.67 O ATOM 928 CB HIS A 58 12.904 1.507 18.869 1.00 42.67 C ATOM 929 CG HIS A 58 12.309 1.838 20.206 1.00 42.67 C ATOM 930 ND1 HIS A 58 12.774 1.274 21.382 1.00 42.67 N ATOM 931 CD2 HIS A 58 11.278 2.664 20.566 1.00 42.67 C ATOM 932 CE1 HIS A 58 12.028 1.763 22.388 1.00 42.67 C ATOM 933 NE2 HIS A 58 11.100 2.617 21.945 1.00 42.67 N ATOM 0 H HIS A 58 13.298 4.137 18.347 1.00 42.67 H new ATOM 0 HA HIS A 58 14.926 1.858 19.463 1.00 42.67 H new ATOM 0 HB2 HIS A 58 12.220 1.798 18.071 1.00 42.67 H new ATOM 0 HB3 HIS A 58 13.057 0.431 18.782 1.00 42.67 H new ATOM 0 HD2 HIS A 58 10.692 3.261 19.883 1.00 42.67 H new ATOM 0 HE1 HIS A 58 12.162 1.498 23.426 1.00 42.67 H new ATOM 0 HE2 HIS A 58 10.410 3.125 22.499 1.00 42.67 H new ATOM 941 N LYS A 59 16.115 1.883 17.228 1.00 72.96 N ATOM 942 CA LYS A 59 16.748 1.678 15.896 1.00 72.96 C ATOM 943 C LYS A 59 17.037 0.193 15.671 1.00 72.96 C ATOM 944 O LYS A 59 17.646 -0.468 16.487 1.00 72.96 O ATOM 945 CB LYS A 59 18.051 2.488 15.811 1.00 72.96 C ATOM 946 CG LYS A 59 17.783 3.948 16.226 1.00 72.96 C ATOM 947 CD LYS A 59 19.105 4.726 16.335 1.00 72.96 C ATOM 948 CE LYS A 59 18.817 6.193 16.694 1.00 72.96 C ATOM 949 NZ LYS A 59 18.416 6.299 18.128 1.00 72.96 N ATOM 0 H LYS A 59 16.763 1.921 18.015 1.00 72.96 H new ATOM 0 HA LYS A 59 16.063 2.021 15.121 1.00 72.96 H new ATOM 0 HB2 LYS A 59 18.807 2.048 16.461 1.00 72.96 H new ATOM 0 HB3 LYS A 59 18.445 2.455 14.795 1.00 72.96 H new ATOM 0 HG2 LYS A 59 17.131 4.427 15.495 1.00 72.96 H new ATOM 0 HG3 LYS A 59 17.260 3.971 17.182 1.00 72.96 H new ATOM 0 HD2 LYS A 59 19.742 4.274 17.095 1.00 72.96 H new ATOM 0 HD3 LYS A 59 19.648 4.673 15.391 1.00 72.96 H new ATOM 0 HE2 LYS A 59 19.702 6.802 16.510 1.00 72.96 H new ATOM 0 HE3 LYS A 59 18.024 6.583 16.056 1.00 72.96 H new ATOM 0 HZ1 LYS A 59 18.338 7.302 18.394 1.00 72.96 H new ATOM 0 HZ2 LYS A 59 17.497 5.832 18.267 1.00 72.96 H new ATOM 0 HZ3 LYS A 59 19.133 5.837 18.724 1.00 72.96 H new ATOM 963 N CYS A 60 16.622 -0.327 14.551 1.00 38.91 N ATOM 964 CA CYS A 60 16.903 -1.763 14.259 1.00 38.91 C ATOM 965 C CYS A 60 18.395 -1.878 13.962 1.00 38.91 C ATOM 966 O CYS A 60 18.915 -1.237 13.070 1.00 38.91 O ATOM 967 CB CYS A 60 16.054 -2.269 13.067 1.00 38.91 C ATOM 968 SG CYS A 60 17.014 -3.443 12.078 1.00 38.91 S ATOM 0 H CYS A 60 16.104 0.174 13.829 1.00 38.91 H new ATOM 0 HA CYS A 60 16.635 -2.385 15.113 1.00 38.91 H new ATOM 0 HB2 CYS A 60 15.146 -2.747 13.434 1.00 38.91 H new ATOM 0 HB3 CYS A 60 15.744 -1.427 12.448 1.00 38.91 H new ATOM 973 N GLN A 61 19.083 -2.665 14.734 1.00124.00 N ATOM 974 CA GLN A 61 20.553 -2.830 14.547 1.00124.00 C ATOM 975 C GLN A 61 20.783 -3.949 13.548 1.00124.00 C ATOM 976 O GLN A 61 21.887 -4.423 13.365 1.00124.00 O ATOM 977 CB GLN A 61 21.194 -3.218 15.885 1.00124.00 C ATOM 978 CG GLN A 61 20.457 -2.525 17.043 1.00124.00 C ATOM 979 CD GLN A 61 21.460 -2.160 18.143 1.00124.00 C ATOM 980 OE1 GLN A 61 21.462 -2.755 19.202 1.00124.00 O ATOM 981 NE2 GLN A 61 22.321 -1.201 17.932 1.00124.00 N ATOM 0 H GLN A 61 18.686 -3.211 15.499 1.00124.00 H new ATOM 0 HA GLN A 61 20.993 -1.900 14.188 1.00124.00 H new ATOM 0 HB2 GLN A 61 21.157 -4.300 16.015 1.00124.00 H new ATOM 0 HB3 GLN A 61 22.246 -2.932 15.890 1.00124.00 H new ATOM 0 HG2 GLN A 61 19.954 -1.628 16.683 1.00124.00 H new ATOM 0 HG3 GLN A 61 19.686 -3.184 17.443 1.00124.00 H new ATOM 0 HE21 GLN A 61 22.320 -0.701 17.043 1.00124.00 H new ATOM 0 HE22 GLN A 61 22.995 -0.952 18.656 1.00124.00 H new ATOM 990 N VAL A 62 19.738 -4.394 12.921 1.00 56.07 N ATOM 991 CA VAL A 62 19.875 -5.506 11.954 1.00 56.07 C ATOM 992 C VAL A 62 20.042 -4.978 10.533 1.00 56.07 C ATOM 993 O VAL A 62 21.011 -5.278 9.862 1.00 56.07 O ATOM 994 CB VAL A 62 18.620 -6.377 12.008 1.00 56.07 C ATOM 995 CG1 VAL A 62 18.869 -7.661 11.219 1.00 56.07 C ATOM 996 CG2 VAL A 62 18.290 -6.719 13.463 1.00 56.07 C ATOM 0 H VAL A 62 18.791 -4.033 13.038 1.00 56.07 H new ATOM 0 HA VAL A 62 20.758 -6.086 12.221 1.00 56.07 H new ATOM 0 HB VAL A 62 17.780 -5.837 11.572 1.00 56.07 H new ATOM 0 HG11 VAL A 62 17.978 -8.288 11.253 1.00 56.07 H new ATOM 0 HG12 VAL A 62 19.099 -7.413 10.183 1.00 56.07 H new ATOM 0 HG13 VAL A 62 19.709 -8.200 11.657 1.00 56.07 H new ATOM 0 HG21 VAL A 62 17.395 -7.340 13.497 1.00 56.07 H new ATOM 0 HG22 VAL A 62 19.125 -7.261 13.908 1.00 56.07 H new ATOM 0 HG23 VAL A 62 18.115 -5.800 14.022 1.00 56.07 H new ATOM 1006 N CYS A 63 19.081 -4.242 10.051 1.00 63.83 N ATOM 1007 CA CYS A 63 19.148 -3.748 8.646 1.00 63.83 C ATOM 1008 C CYS A 63 19.269 -2.210 8.525 1.00 63.83 C ATOM 1009 O CYS A 63 19.723 -1.745 7.501 1.00 63.83 O ATOM 1010 CB CYS A 63 17.937 -4.293 7.881 1.00 63.83 C ATOM 1011 SG CYS A 63 16.417 -3.440 8.355 1.00 63.83 S ATOM 0 H CYS A 63 18.249 -3.960 10.570 1.00 63.83 H new ATOM 0 HA CYS A 63 20.070 -4.122 8.201 1.00 63.83 H new ATOM 0 HB2 CYS A 63 18.101 -4.179 6.809 1.00 63.83 H new ATOM 0 HB3 CYS A 63 17.832 -5.360 8.076 1.00 63.83 H new ATOM 1016 N GLY A 64 18.967 -1.403 9.522 1.00 23.81 N ATOM 1017 CA GLY A 64 19.215 0.078 9.326 1.00 23.81 C ATOM 1018 C GLY A 64 17.993 0.975 9.582 1.00 23.81 C ATOM 1019 O GLY A 64 18.117 2.183 9.601 1.00 23.81 O ATOM 0 H GLY A 64 18.578 -1.682 10.423 1.00 23.81 H new ATOM 0 HA2 GLY A 64 20.022 0.388 9.990 1.00 23.81 H new ATOM 0 HA3 GLY A 64 19.562 0.242 8.306 1.00 23.81 H new ATOM 1023 N LYS A 65 16.814 0.438 9.711 1.00120.74 N ATOM 1024 CA LYS A 65 15.617 1.323 9.893 1.00120.74 C ATOM 1025 C LYS A 65 15.379 1.680 11.383 1.00120.74 C ATOM 1026 O LYS A 65 15.944 1.082 12.278 1.00120.74 O ATOM 1027 CB LYS A 65 14.416 0.583 9.316 1.00120.74 C ATOM 1028 CG LYS A 65 13.522 1.548 8.541 1.00120.74 C ATOM 1029 CD LYS A 65 12.376 0.758 7.909 1.00120.74 C ATOM 1030 CE LYS A 65 11.917 1.454 6.630 1.00120.74 C ATOM 1031 NZ LYS A 65 13.055 1.531 5.670 1.00120.74 N ATOM 0 H LYS A 65 16.621 -0.564 9.699 1.00120.74 H new ATOM 0 HA LYS A 65 15.777 2.270 9.377 1.00120.74 H new ATOM 0 HB2 LYS A 65 14.755 -0.217 8.658 1.00120.74 H new ATOM 0 HB3 LYS A 65 13.847 0.116 10.120 1.00120.74 H new ATOM 0 HG2 LYS A 65 13.129 2.316 9.207 1.00120.74 H new ATOM 0 HG3 LYS A 65 14.098 2.060 7.770 1.00120.74 H new ATOM 0 HD2 LYS A 65 12.702 -0.258 7.685 1.00120.74 H new ATOM 0 HD3 LYS A 65 11.545 0.679 8.610 1.00120.74 H new ATOM 0 HE2 LYS A 65 11.087 0.907 6.183 1.00120.74 H new ATOM 0 HE3 LYS A 65 11.552 2.455 6.859 1.00120.74 H new ATOM 0 HZ1 LYS A 65 12.702 1.392 4.702 1.00120.74 H new ATOM 0 HZ2 LYS A 65 13.508 2.464 5.743 1.00120.74 H new ATOM 0 HZ3 LYS A 65 13.750 0.791 5.895 1.00120.74 H new ATOM 1045 N ALA A 66 14.540 2.669 11.643 1.00 39.51 N ATOM 1046 CA ALA A 66 14.255 3.097 13.060 1.00 39.51 C ATOM 1047 C ALA A 66 12.750 3.157 13.357 1.00 39.51 C ATOM 1048 O ALA A 66 11.928 3.335 12.478 1.00 39.51 O ATOM 1049 CB ALA A 66 14.848 4.484 13.301 1.00 39.51 C ATOM 0 H ALA A 66 14.039 3.199 10.930 1.00 39.51 H new ATOM 0 HA ALA A 66 14.706 2.355 13.719 1.00 39.51 H new ATOM 0 HB1 ALA A 66 14.642 4.795 14.325 1.00 39.51 H new ATOM 0 HB2 ALA A 66 15.926 4.452 13.141 1.00 39.51 H new ATOM 0 HB3 ALA A 66 14.400 5.197 12.609 1.00 39.51 H new ATOM 1055 N PHE A 67 12.396 2.949 14.609 1.00 62.57 N ATOM 1056 CA PHE A 67 10.957 2.927 15.007 1.00 62.57 C ATOM 1057 C PHE A 67 10.668 3.777 16.252 1.00 62.57 C ATOM 1058 O PHE A 67 11.451 3.850 17.189 1.00 62.57 O ATOM 1059 CB PHE A 67 10.610 1.481 15.311 1.00 62.57 C ATOM 1060 CG PHE A 67 10.889 0.689 14.068 1.00 62.57 C ATOM 1061 CD1 PHE A 67 9.922 0.619 13.065 1.00 62.57 C ATOM 1062 CD2 PHE A 67 12.128 0.060 13.900 1.00 62.57 C ATOM 1063 CE1 PHE A 67 10.190 -0.084 11.888 1.00 62.57 C ATOM 1064 CE2 PHE A 67 12.400 -0.638 12.719 1.00 62.57 C ATOM 1065 CZ PHE A 67 11.427 -0.710 11.714 1.00 62.57 C ATOM 0 H PHE A 67 13.053 2.793 15.374 1.00 62.57 H new ATOM 0 HA PHE A 67 10.361 3.345 14.196 1.00 62.57 H new ATOM 0 HB2 PHE A 67 11.205 1.110 16.146 1.00 62.57 H new ATOM 0 HB3 PHE A 67 9.563 1.389 15.599 1.00 62.57 H new ATOM 0 HD1 PHE A 67 8.968 1.107 13.198 1.00 62.57 H new ATOM 0 HD2 PHE A 67 12.872 0.114 14.681 1.00 62.57 H new ATOM 0 HE1 PHE A 67 9.441 -0.144 11.112 1.00 62.57 H new ATOM 0 HE2 PHE A 67 13.357 -1.120 12.582 1.00 62.57 H new ATOM 0 HZ PHE A 67 11.633 -1.251 10.802 1.00 62.57 H new ATOM 1075 N SER A 68 9.515 4.398 16.253 1.00 84.84 N ATOM 1076 CA SER A 68 9.081 5.232 17.405 1.00 84.84 C ATOM 1077 C SER A 68 8.577 4.303 18.506 1.00 84.84 C ATOM 1078 O SER A 68 8.813 4.525 19.677 1.00 84.84 O ATOM 1079 CB SER A 68 7.926 6.126 16.957 1.00 84.84 C ATOM 1080 OG SER A 68 7.401 6.835 18.073 1.00 84.84 O ATOM 0 H SER A 68 8.845 4.358 15.485 1.00 84.84 H new ATOM 0 HA SER A 68 9.909 5.841 17.766 1.00 84.84 H new ATOM 0 HB2 SER A 68 8.272 6.829 16.199 1.00 84.84 H new ATOM 0 HB3 SER A 68 7.144 5.521 16.498 1.00 84.84 H new ATOM 0 HG SER A 68 6.662 7.407 17.779 1.00 84.84 H new ATOM 1086 N GLN A 69 7.864 3.268 18.129 1.00 93.39 N ATOM 1087 CA GLN A 69 7.319 2.333 19.153 1.00 93.39 C ATOM 1088 C GLN A 69 8.097 1.014 19.152 1.00 93.39 C ATOM 1089 O GLN A 69 8.453 0.472 18.113 1.00 93.39 O ATOM 1090 CB GLN A 69 5.856 2.008 18.844 1.00 93.39 C ATOM 1091 CG GLN A 69 5.054 3.287 18.559 1.00 93.39 C ATOM 1092 CD GLN A 69 4.160 3.058 17.340 1.00 93.39 C ATOM 1093 OE1 GLN A 69 3.846 1.933 17.006 1.00 93.39 O ATOM 1094 NE2 GLN A 69 3.735 4.081 16.656 1.00 93.39 N ATOM 0 H GLN A 69 7.639 3.035 17.162 1.00 93.39 H new ATOM 0 HA GLN A 69 7.409 2.820 20.124 1.00 93.39 H new ATOM 0 HB2 GLN A 69 5.802 1.342 17.983 1.00 93.39 H new ATOM 0 HB3 GLN A 69 5.412 1.477 19.686 1.00 93.39 H new ATOM 0 HG2 GLN A 69 4.448 3.551 19.425 1.00 93.39 H new ATOM 0 HG3 GLN A 69 5.731 4.122 18.377 1.00 93.39 H new ATOM 0 HE21 GLN A 69 3.998 5.026 16.935 1.00 93.39 H new ATOM 0 HE22 GLN A 69 3.139 3.937 15.841 1.00 93.39 H new ATOM 1103 N SER A 70 8.333 0.481 20.311 1.00 67.34 N ATOM 1104 CA SER A 70 9.052 -0.815 20.385 1.00 67.34 C ATOM 1105 C SER A 70 8.205 -1.858 19.680 1.00 67.34 C ATOM 1106 O SER A 70 8.701 -2.698 18.990 1.00 67.34 O ATOM 1107 CB SER A 70 9.234 -1.239 21.837 1.00 67.34 C ATOM 1108 OG SER A 70 7.957 -1.338 22.455 1.00 67.34 O ATOM 0 H SER A 70 8.061 0.884 21.208 1.00 67.34 H new ATOM 0 HA SER A 70 10.033 -0.717 19.919 1.00 67.34 H new ATOM 0 HB2 SER A 70 9.752 -2.197 21.887 1.00 67.34 H new ATOM 0 HB3 SER A 70 9.853 -0.514 22.366 1.00 67.34 H new ATOM 0 HG SER A 70 8.066 -1.612 23.389 1.00 67.34 H new ATOM 1114 N SER A 71 6.924 -1.806 19.873 1.00 68.68 N ATOM 1115 CA SER A 71 6.013 -2.791 19.238 1.00 68.68 C ATOM 1116 C SER A 71 6.281 -2.861 17.738 1.00 68.68 C ATOM 1117 O SER A 71 6.185 -3.913 17.135 1.00 68.68 O ATOM 1118 CB SER A 71 4.575 -2.345 19.489 1.00 68.68 C ATOM 1119 OG SER A 71 4.053 -3.062 20.595 1.00 68.68 O ATOM 0 H SER A 71 6.459 -1.109 20.455 1.00 68.68 H new ATOM 0 HA SER A 71 6.179 -3.781 19.663 1.00 68.68 H new ATOM 0 HB2 SER A 71 4.543 -1.274 19.686 1.00 68.68 H new ATOM 0 HB3 SER A 71 3.966 -2.524 18.603 1.00 68.68 H new ATOM 0 HG SER A 71 3.974 -2.462 21.366 1.00 68.68 H new ATOM 1125 N ASN A 72 6.617 -1.768 17.125 1.00 33.83 N ATOM 1126 CA ASN A 72 6.889 -1.815 15.658 1.00 33.83 C ATOM 1127 C ASN A 72 8.305 -2.337 15.443 1.00 33.83 C ATOM 1128 O ASN A 72 8.573 -3.060 14.503 1.00 33.83 O ATOM 1129 CB ASN A 72 6.726 -0.426 15.037 1.00 33.83 C ATOM 1130 CG ASN A 72 5.232 -0.125 14.876 1.00 33.83 C ATOM 1131 OD1 ASN A 72 4.445 -0.440 15.747 1.00 33.83 O ATOM 1132 ND2 ASN A 72 4.799 0.468 13.794 1.00 33.83 N ATOM 0 H ASN A 72 6.716 -0.852 17.564 1.00 33.83 H new ATOM 0 HA ASN A 72 6.175 -2.480 15.172 1.00 33.83 H new ATOM 0 HB2 ASN A 72 7.196 0.327 15.670 1.00 33.83 H new ATOM 0 HB3 ASN A 72 7.225 -0.385 14.069 1.00 33.83 H new ATOM 0 HD21 ASN A 72 3.804 0.665 13.683 1.00 33.83 H new ATOM 0 HD22 ASN A 72 5.456 0.734 13.061 1.00 33.83 H new ATOM 1139 N LEU A 73 9.207 -2.040 16.340 1.00 75.65 N ATOM 1140 CA LEU A 73 10.574 -2.602 16.186 1.00 75.65 C ATOM 1141 C LEU A 73 10.489 -4.078 16.546 1.00 75.65 C ATOM 1142 O LEU A 73 11.136 -4.902 15.956 1.00 75.65 O ATOM 1143 CB LEU A 73 11.567 -1.876 17.090 1.00 75.65 C ATOM 1144 CG LEU A 73 12.927 -2.600 17.085 1.00 75.65 C ATOM 1145 CD1 LEU A 73 13.375 -2.909 15.650 1.00 75.65 C ATOM 1146 CD2 LEU A 73 13.981 -1.706 17.741 1.00 75.65 C ATOM 0 H LEU A 73 9.059 -1.445 17.155 1.00 75.65 H new ATOM 0 HA LEU A 73 10.931 -2.475 15.164 1.00 75.65 H new ATOM 0 HB2 LEU A 73 11.694 -0.848 16.750 1.00 75.65 H new ATOM 0 HB3 LEU A 73 11.176 -1.830 18.107 1.00 75.65 H new ATOM 0 HG LEU A 73 12.819 -3.534 17.636 1.00 75.65 H new ATOM 0 HD11 LEU A 73 14.337 -3.420 15.671 1.00 75.65 H new ATOM 0 HD12 LEU A 73 12.635 -3.548 15.168 1.00 75.65 H new ATOM 0 HD13 LEU A 73 13.471 -1.979 15.090 1.00 75.65 H new ATOM 0 HD21 LEU A 73 14.944 -2.217 17.738 1.00 75.65 H new ATOM 0 HD22 LEU A 73 14.064 -0.773 17.184 1.00 75.65 H new ATOM 0 HD23 LEU A 73 13.687 -1.491 18.768 1.00 75.65 H new ATOM 1158 N ILE A 74 9.670 -4.435 17.491 1.00 27.72 N ATOM 1159 CA ILE A 74 9.508 -5.862 17.850 1.00 27.72 C ATOM 1160 C ILE A 74 9.031 -6.606 16.600 1.00 27.72 C ATOM 1161 O ILE A 74 9.636 -7.561 16.183 1.00 27.72 O ATOM 1162 CB ILE A 74 8.469 -5.960 18.974 1.00 27.72 C ATOM 1163 CG1 ILE A 74 9.101 -5.441 20.272 1.00 27.72 C ATOM 1164 CG2 ILE A 74 8.030 -7.414 19.171 1.00 27.72 C ATOM 1165 CD1 ILE A 74 8.021 -5.232 21.335 1.00 27.72 C ATOM 0 H ILE A 74 9.100 -3.788 18.035 1.00 27.72 H new ATOM 0 HA ILE A 74 10.443 -6.302 18.197 1.00 27.72 H new ATOM 0 HB ILE A 74 7.595 -5.364 18.711 1.00 27.72 H new ATOM 0 HG12 ILE A 74 9.845 -6.151 20.633 1.00 27.72 H new ATOM 0 HG13 ILE A 74 9.622 -4.503 20.082 1.00 27.72 H new ATOM 0 HG21 ILE A 74 7.293 -7.466 19.972 1.00 27.72 H new ATOM 0 HG22 ILE A 74 7.589 -7.789 18.247 1.00 27.72 H new ATOM 0 HG23 ILE A 74 8.895 -8.023 19.434 1.00 27.72 H new ATOM 0 HD11 ILE A 74 8.480 -4.864 22.252 1.00 27.72 H new ATOM 0 HD12 ILE A 74 7.293 -4.505 20.976 1.00 27.72 H new ATOM 0 HD13 ILE A 74 7.519 -6.179 21.535 1.00 27.72 H new ATOM 1177 N THR A 75 7.963 -6.171 15.987 1.00 95.20 N ATOM 1178 CA THR A 75 7.504 -6.867 14.748 1.00 95.20 C ATOM 1179 C THR A 75 8.645 -6.826 13.737 1.00 95.20 C ATOM 1180 O THR A 75 9.186 -7.826 13.320 1.00 95.20 O ATOM 1181 CB THR A 75 6.315 -6.119 14.133 1.00 95.20 C ATOM 1182 OG1 THR A 75 5.205 -6.184 15.011 1.00 95.20 O ATOM 1183 CG2 THR A 75 5.940 -6.745 12.778 1.00 95.20 C ATOM 0 H THR A 75 7.396 -5.377 16.283 1.00 95.20 H new ATOM 0 HA THR A 75 7.212 -7.888 14.992 1.00 95.20 H new ATOM 0 HB THR A 75 6.594 -5.077 13.977 1.00 95.20 H new ATOM 0 HG1 THR A 75 5.314 -5.523 15.726 1.00 95.20 H new ATOM 0 HG21 THR A 75 5.095 -6.206 12.350 1.00 95.20 H new ATOM 0 HG22 THR A 75 6.791 -6.682 12.100 1.00 95.20 H new ATOM 0 HG23 THR A 75 5.668 -7.791 12.923 1.00 95.20 H new ATOM 1191 N HIS A 76 9.011 -5.636 13.367 1.00 66.30 N ATOM 1192 CA HIS A 76 10.118 -5.456 12.389 1.00 66.30 C ATOM 1193 C HIS A 76 11.280 -6.385 12.804 1.00 66.30 C ATOM 1194 O HIS A 76 11.889 -7.074 11.987 1.00 66.30 O ATOM 1195 CB HIS A 76 10.528 -3.976 12.381 1.00 66.30 C ATOM 1196 CG HIS A 76 11.756 -3.801 11.546 1.00 66.30 C ATOM 1197 ND1 HIS A 76 11.733 -3.175 10.291 1.00 66.30 N ATOM 1198 CD2 HIS A 76 13.042 -4.219 11.738 1.00 66.30 C ATOM 1199 CE1 HIS A 76 12.980 -3.247 9.783 1.00 66.30 C ATOM 1200 NE2 HIS A 76 13.782 -3.865 10.636 1.00 66.30 N ATOM 0 H HIS A 76 8.588 -4.771 13.702 1.00 66.30 H new ATOM 0 HA HIS A 76 9.815 -5.721 11.376 1.00 66.30 H new ATOM 0 HB2 HIS A 76 9.717 -3.365 11.985 1.00 66.30 H new ATOM 0 HB3 HIS A 76 10.716 -3.635 13.399 1.00 66.30 H new ATOM 0 HD1 HIS A 76 10.923 -2.745 9.845 1.00 66.30 H new ATOM 0 HD2 HIS A 76 13.414 -4.739 12.608 1.00 66.30 H new ATOM 0 HE1 HIS A 76 13.280 -2.858 8.821 1.00 66.30 H new ATOM 1208 N SER A 77 11.540 -6.472 14.074 1.00 87.23 N ATOM 1209 CA SER A 77 12.599 -7.394 14.538 1.00 87.23 C ATOM 1210 C SER A 77 12.086 -8.824 14.315 1.00 87.23 C ATOM 1211 O SER A 77 12.837 -9.725 14.028 1.00 87.23 O ATOM 1212 CB SER A 77 12.913 -7.131 16.016 1.00 87.23 C ATOM 1213 OG SER A 77 11.774 -7.414 16.810 1.00 87.23 O ATOM 0 H SER A 77 11.065 -5.945 14.807 1.00 87.23 H new ATOM 0 HA SER A 77 13.526 -7.245 13.985 1.00 87.23 H new ATOM 0 HB2 SER A 77 13.752 -7.750 16.334 1.00 87.23 H new ATOM 0 HB3 SER A 77 13.214 -6.092 16.153 1.00 87.23 H new ATOM 0 HG SER A 77 11.000 -7.566 16.229 1.00 87.23 H new ATOM 1219 N ARG A 78 10.794 -9.028 14.425 1.00 73.27 N ATOM 1220 CA ARG A 78 10.232 -10.394 14.185 1.00 73.27 C ATOM 1221 C ARG A 78 10.533 -10.807 12.748 1.00 73.27 C ATOM 1222 O ARG A 78 10.892 -11.936 12.483 1.00 73.27 O ATOM 1223 CB ARG A 78 8.717 -10.404 14.400 1.00 73.27 C ATOM 1224 CG ARG A 78 8.388 -10.509 15.892 1.00 73.27 C ATOM 1225 CD ARG A 78 6.884 -10.747 16.039 1.00 73.27 C ATOM 1226 NE ARG A 78 6.494 -11.917 15.199 1.00 73.27 N ATOM 1227 CZ ARG A 78 6.765 -13.130 15.600 1.00 73.27 C ATOM 1228 NH1 ARG A 78 7.397 -13.315 16.723 1.00 73.27 N ATOM 1229 NH2 ARG A 78 6.405 -14.157 14.875 1.00 73.27 N ATOM 0 H ARG A 78 10.109 -8.312 14.669 1.00 73.27 H new ATOM 0 HA ARG A 78 10.689 -11.090 14.888 1.00 73.27 H new ATOM 0 HB2 ARG A 78 8.279 -9.495 13.988 1.00 73.27 H new ATOM 0 HB3 ARG A 78 8.273 -11.243 13.864 1.00 73.27 H new ATOM 0 HG2 ARG A 78 8.948 -11.326 16.347 1.00 73.27 H new ATOM 0 HG3 ARG A 78 8.680 -9.595 16.410 1.00 73.27 H new ATOM 0 HD2 ARG A 78 6.632 -10.932 17.083 1.00 73.27 H new ATOM 0 HD3 ARG A 78 6.330 -9.860 15.730 1.00 73.27 H new ATOM 0 HE ARG A 78 6.015 -11.769 14.311 1.00 73.27 H new ATOM 0 HH11 ARG A 78 7.679 -12.514 17.287 1.00 73.27 H new ATOM 0 HH12 ARG A 78 7.610 -14.261 17.039 1.00 73.27 H new ATOM 0 HH21 ARG A 78 5.911 -14.012 13.994 1.00 73.27 H new ATOM 0 HH22 ARG A 78 6.618 -15.103 15.190 1.00 73.27 H new ATOM 1243 N LYS A 79 10.431 -9.903 11.809 1.00 80.85 N ATOM 1244 CA LYS A 79 10.758 -10.277 10.408 1.00 80.85 C ATOM 1245 C LYS A 79 12.193 -10.742 10.436 1.00 80.85 C ATOM 1246 O LYS A 79 12.511 -11.797 9.929 1.00 80.85 O ATOM 1247 CB LYS A 79 10.569 -9.071 9.469 1.00 80.85 C ATOM 1248 CG LYS A 79 9.113 -8.595 9.545 1.00 80.85 C ATOM 1249 CD LYS A 79 8.931 -7.305 8.744 1.00 80.85 C ATOM 1250 CE LYS A 79 7.466 -6.837 8.849 1.00 80.85 C ATOM 1251 NZ LYS A 79 7.405 -5.362 9.088 1.00 80.85 N ATOM 0 H LYS A 79 10.139 -8.936 11.951 1.00 80.85 H new ATOM 0 HA LYS A 79 10.102 -11.061 10.029 1.00 80.85 H new ATOM 0 HB2 LYS A 79 11.243 -8.264 9.755 1.00 80.85 H new ATOM 0 HB3 LYS A 79 10.820 -9.349 8.445 1.00 80.85 H new ATOM 0 HG2 LYS A 79 8.450 -9.368 9.157 1.00 80.85 H new ATOM 0 HG3 LYS A 79 8.832 -8.428 10.585 1.00 80.85 H new ATOM 0 HD2 LYS A 79 9.599 -6.532 9.123 1.00 80.85 H new ATOM 0 HD3 LYS A 79 9.197 -7.472 7.700 1.00 80.85 H new ATOM 0 HE2 LYS A 79 6.932 -7.085 7.932 1.00 80.85 H new ATOM 0 HE3 LYS A 79 6.967 -7.364 9.662 1.00 80.85 H new ATOM 0 HZ1 LYS A 79 6.417 -5.076 9.241 1.00 80.85 H new ATOM 0 HZ2 LYS A 79 7.969 -5.123 9.929 1.00 80.85 H new ATOM 0 HZ3 LYS A 79 7.787 -4.860 8.261 1.00 80.85 H new ATOM 1265 N HIS A 80 13.052 -10.024 11.087 1.00 46.01 N ATOM 1266 CA HIS A 80 14.438 -10.544 11.181 1.00 46.01 C ATOM 1267 C HIS A 80 14.422 -11.902 11.885 1.00 46.01 C ATOM 1268 O HIS A 80 15.104 -12.817 11.473 1.00 46.01 O ATOM 1269 CB HIS A 80 15.303 -9.598 11.982 1.00 46.01 C ATOM 1270 CG HIS A 80 15.525 -8.359 11.182 1.00 46.01 C ATOM 1271 ND1 HIS A 80 15.880 -8.389 9.826 1.00 46.01 N ATOM 1272 CD2 HIS A 80 15.428 -7.046 11.521 1.00 46.01 C ATOM 1273 CE1 HIS A 80 15.983 -7.110 9.409 1.00 46.01 C ATOM 1274 NE2 HIS A 80 15.723 -6.285 10.412 1.00 46.01 N ATOM 0 H HIS A 80 12.868 -9.131 11.544 1.00 46.01 H new ATOM 0 HA HIS A 80 14.843 -10.640 10.174 1.00 46.01 H new ATOM 0 HB2 HIS A 80 14.821 -9.355 12.929 1.00 46.01 H new ATOM 0 HB3 HIS A 80 16.256 -10.069 12.222 1.00 46.01 H new ATOM 0 HD1 HIS A 80 16.032 -9.223 9.259 1.00 46.01 H new ATOM 0 HD2 HIS A 80 15.164 -6.664 12.496 1.00 46.01 H new ATOM 0 HE1 HIS A 80 16.240 -6.804 8.406 1.00 46.01 H new ATOM 1282 N THR A 81 13.666 -12.062 12.957 1.00 89.50 N ATOM 1283 CA THR A 81 13.676 -13.395 13.645 1.00 89.50 C ATOM 1284 C THR A 81 12.557 -14.259 13.067 1.00 89.50 C ATOM 1285 O THR A 81 12.105 -15.209 13.679 1.00 89.50 O ATOM 1286 CB THR A 81 13.471 -13.228 15.154 1.00 89.50 C ATOM 1287 OG1 THR A 81 12.205 -12.634 15.384 1.00 89.50 O ATOM 1288 CG2 THR A 81 14.565 -12.334 15.740 1.00 89.50 C ATOM 0 H THR A 81 13.063 -11.351 13.371 1.00 89.50 H new ATOM 0 HA THR A 81 14.642 -13.873 13.481 1.00 89.50 H new ATOM 0 HB THR A 81 13.519 -14.205 15.634 1.00 89.50 H new ATOM 0 HG1 THR A 81 12.307 -11.873 15.993 1.00 89.50 H new ATOM 0 HG21 THR A 81 14.408 -12.223 16.813 1.00 89.50 H new ATOM 0 HG22 THR A 81 15.540 -12.787 15.561 1.00 89.50 H new ATOM 0 HG23 THR A 81 14.527 -11.354 15.265 1.00 89.50 H new ATOM 1296 N GLY A 82 12.126 -13.944 11.884 1.00 8.65 N ATOM 1297 CA GLY A 82 11.050 -14.734 11.231 1.00 8.65 C ATOM 1298 C GLY A 82 9.798 -14.730 12.107 1.00 8.65 C ATOM 0 H GLY A 82 12.478 -13.161 11.332 1.00 8.65 H new ATOM 0 HA2 GLY A 82 10.821 -14.313 10.252 1.00 8.65 H new ATOM 0 HA3 GLY A 82 11.387 -15.758 11.067 1.00 8.65 H new TER 1302 GLY A 82 ATOM 1303 O5' DC B 101 0.467 -12.932 4.088 1.00 0.00 O ATOM 1304 C5' DC B 101 1.293 -12.977 2.921 1.00 0.00 C ATOM 1305 C4' DC B 101 1.909 -11.613 2.618 1.00 0.00 C ATOM 1306 O4' DC B 101 0.869 -10.660 2.396 1.00 0.00 O ATOM 1307 C3' DC B 101 2.793 -11.054 3.743 1.00 0.00 C ATOM 1308 O3' DC B 101 4.150 -10.993 3.295 1.00 0.00 O ATOM 1309 C2' DC B 101 2.260 -9.638 3.989 1.00 0.00 C ATOM 1310 C1' DC B 101 1.365 -9.388 2.785 1.00 0.00 C ATOM 1311 N1 DC B 101 0.205 -8.515 3.064 1.00 0.00 N ATOM 1312 C2 DC B 101 0.104 -7.326 2.354 1.00 0.00 C ATOM 1313 O2 DC B 101 0.961 -7.029 1.526 1.00 0.00 O ATOM 1314 N3 DC B 101 -0.957 -6.512 2.604 1.00 0.00 N ATOM 1315 C4 DC B 101 -1.884 -6.848 3.510 1.00 0.00 C ATOM 1316 N4 DC B 101 -2.911 -6.028 3.729 1.00 0.00 N ATOM 1317 C5 DC B 101 -1.786 -8.072 4.244 1.00 0.00 C ATOM 1318 C6 DC B 101 -0.732 -8.872 3.991 1.00 0.00 C ATOM 0 H5' DC B 101 0.701 -13.308 2.068 1.00 0.00 H new ATOM 0 H5'' DC B 101 2.085 -13.712 3.063 1.00 0.00 H new ATOM 0 H4' DC B 101 2.538 -11.769 1.741 1.00 0.00 H new ATOM 0 H3' DC B 101 2.767 -11.667 4.644 1.00 0.00 H new ATOM 0 H2' DC B 101 1.704 -9.574 4.924 1.00 0.00 H new ATOM 0 H2'' DC B 101 3.068 -8.909 4.048 1.00 0.00 H new ATOM 0 HO5' DC B 101 0.067 -12.041 4.172 1.00 0.00 H new ATOM 0 H1' DC B 101 1.955 -8.880 2.022 1.00 0.00 H new ATOM 0 H41 DC B 101 -3.623 -6.274 4.417 1.00 0.00 H new ATOM 0 H42 DC B 101 -2.986 -5.154 3.209 1.00 0.00 H new ATOM 0 H5 DC B 101 -2.532 -8.345 4.976 1.00 0.00 H new ATOM 0 H6 DC B 101 -0.627 -9.804 4.526 1.00 0.00 H new ATOM 1331 P DA B 102 5.340 -10.661 4.330 1.00 0.00 P ATOM 1332 OP1 DA B 102 6.608 -11.157 3.751 1.00 0.00 O ATOM 1333 OP2 DA B 102 4.919 -11.109 5.676 1.00 0.00 O ATOM 1334 O5' DA B 102 5.379 -9.051 4.325 1.00 0.00 O ATOM 1335 C5' DA B 102 5.967 -8.344 3.230 1.00 0.00 C ATOM 1336 C4' DA B 102 5.836 -6.833 3.400 1.00 0.00 C ATOM 1337 O4' DA B 102 4.454 -6.468 3.391 1.00 0.00 O ATOM 1338 C3' DA B 102 6.438 -6.286 4.704 1.00 0.00 C ATOM 1339 O3' DA B 102 7.487 -5.365 4.390 1.00 0.00 O ATOM 1340 C2' DA B 102 5.279 -5.550 5.384 1.00 0.00 C ATOM 1341 C1' DA B 102 4.303 -5.338 4.240 1.00 0.00 C ATOM 1342 N9 DA B 102 2.888 -5.260 4.649 1.00 0.00 N ATOM 1343 C8 DA B 102 2.103 -6.215 5.231 1.00 0.00 C ATOM 1344 N7 DA B 102 0.879 -5.852 5.469 1.00 0.00 N ATOM 1345 C5 DA B 102 0.844 -4.539 5.003 1.00 0.00 C ATOM 1346 C6 DA B 102 -0.171 -3.576 4.957 1.00 0.00 C ATOM 1347 N6 DA B 102 -1.406 -3.797 5.408 1.00 0.00 N ATOM 1348 N1 DA B 102 0.135 -2.379 4.430 1.00 0.00 N ATOM 1349 C2 DA B 102 1.364 -2.140 3.973 1.00 0.00 C ATOM 1350 N3 DA B 102 2.396 -2.978 3.969 1.00 0.00 N ATOM 1351 C4 DA B 102 2.060 -4.170 4.503 1.00 0.00 C ATOM 0 H5' DA B 102 5.487 -8.649 2.300 1.00 0.00 H new ATOM 0 H5'' DA B 102 7.021 -8.611 3.148 1.00 0.00 H new ATOM 0 H4' DA B 102 6.393 -6.402 2.568 1.00 0.00 H new ATOM 0 H3' DA B 102 6.860 -7.066 5.338 1.00 0.00 H new ATOM 0 H2' DA B 102 4.839 -6.141 6.187 1.00 0.00 H new ATOM 0 H2'' DA B 102 5.601 -4.605 5.823 1.00 0.00 H new ATOM 0 H1' DA B 102 4.531 -4.381 3.770 1.00 0.00 H new ATOM 0 H8 DA B 102 2.473 -7.200 5.475 1.00 0.00 H new ATOM 0 H61 DA B 102 -2.109 -3.060 5.351 1.00 0.00 H new ATOM 0 H62 DA B 102 -1.648 -4.703 5.810 1.00 0.00 H new ATOM 0 H2 DA B 102 1.541 -1.158 3.561 1.00 0.00 H new ATOM 1363 P DT B 103 8.320 -4.632 5.557 1.00 0.00 P ATOM 1364 OP1 DT B 103 9.672 -4.326 5.041 1.00 0.00 O ATOM 1365 OP2 DT B 103 8.168 -5.419 6.797 1.00 0.00 O ATOM 1366 O5' DT B 103 7.524 -3.245 5.739 1.00 0.00 O ATOM 1367 C5' DT B 103 7.460 -2.315 4.657 1.00 0.00 C ATOM 1368 C4' DT B 103 6.637 -1.081 5.010 1.00 0.00 C ATOM 1369 O4' DT B 103 5.317 -1.462 5.390 1.00 0.00 O ATOM 1370 C3' DT B 103 7.192 -0.247 6.175 1.00 0.00 C ATOM 1371 O3' DT B 103 7.774 0.955 5.661 1.00 0.00 O ATOM 1372 C2' DT B 103 5.958 0.091 7.022 1.00 0.00 C ATOM 1373 C1' DT B 103 4.806 -0.377 6.147 1.00 0.00 C ATOM 1374 N1 DT B 103 3.622 -0.832 6.903 1.00 0.00 N ATOM 1375 C2 DT B 103 2.581 0.075 7.040 1.00 0.00 C ATOM 1376 O2 DT B 103 2.612 1.188 6.523 1.00 0.00 O ATOM 1377 N3 DT B 103 1.503 -0.346 7.793 1.00 0.00 N ATOM 1378 C4 DT B 103 1.380 -1.565 8.428 1.00 0.00 C ATOM 1379 O4 DT B 103 0.378 -1.831 9.085 1.00 0.00 O ATOM 1380 C5 DT B 103 2.503 -2.445 8.232 1.00 0.00 C ATOM 1381 C7 DT B 103 2.499 -3.825 8.890 1.00 0.00 C ATOM 1382 C6 DT B 103 3.563 -2.076 7.481 1.00 0.00 C ATOM 0 H5' DT B 103 7.025 -2.803 3.785 1.00 0.00 H new ATOM 0 H5'' DT B 103 8.470 -2.010 4.381 1.00 0.00 H new ATOM 0 H4' DT B 103 6.666 -0.473 4.106 1.00 0.00 H new ATOM 0 H3' DT B 103 7.959 -0.770 6.746 1.00 0.00 H new ATOM 0 H2' DT B 103 5.973 -0.426 7.981 1.00 0.00 H new ATOM 0 H2'' DT B 103 5.895 1.158 7.236 1.00 0.00 H new ATOM 0 H1' DT B 103 4.460 0.460 5.541 1.00 0.00 H new ATOM 0 H3 DT B 103 0.724 0.305 7.889 1.00 0.00 H new ATOM 0 H71 DT B 103 3.068 -4.523 8.276 1.00 0.00 H new ATOM 0 H72 DT B 103 2.953 -3.758 9.879 1.00 0.00 H new ATOM 0 H73 DT B 103 1.473 -4.180 8.985 1.00 0.00 H new ATOM 0 H6 DT B 103 4.377 -2.770 7.333 1.00 0.00 H new ATOM 1395 P DA B 104 8.649 1.917 6.612 1.00 0.00 P ATOM 1396 OP1 DA B 104 9.539 2.727 5.750 1.00 0.00 O ATOM 1397 OP2 DA B 104 9.223 1.097 7.702 1.00 0.00 O ATOM 1398 O5' DA B 104 7.541 2.897 7.247 1.00 0.00 O ATOM 1399 C5' DA B 104 7.103 4.053 6.529 1.00 0.00 C ATOM 1400 C4' DA B 104 6.029 4.819 7.298 1.00 0.00 C ATOM 1401 O4' DA B 104 4.907 3.956 7.530 1.00 0.00 O ATOM 1402 C3' DA B 104 6.485 5.350 8.667 1.00 0.00 C ATOM 1403 O3' DA B 104 6.121 6.732 8.783 1.00 0.00 O ATOM 1404 C2' DA B 104 5.698 4.511 9.666 1.00 0.00 C ATOM 1405 C1' DA B 104 4.464 4.153 8.866 1.00 0.00 C ATOM 1406 N9 DA B 104 3.798 2.922 9.317 1.00 0.00 N ATOM 1407 C8 DA B 104 4.343 1.706 9.612 1.00 0.00 C ATOM 1408 N7 DA B 104 3.496 0.813 10.031 1.00 0.00 N ATOM 1409 C5 DA B 104 2.281 1.499 10.009 1.00 0.00 C ATOM 1410 C6 DA B 104 0.976 1.125 10.342 1.00 0.00 C ATOM 1411 N6 DA B 104 0.663 -0.078 10.816 1.00 0.00 N ATOM 1412 N1 DA B 104 0.010 2.049 10.198 1.00 0.00 N ATOM 1413 C2 DA B 104 0.309 3.271 9.762 1.00 0.00 C ATOM 1414 N3 DA B 104 1.511 3.729 9.424 1.00 0.00 N ATOM 1415 C4 DA B 104 2.457 2.780 9.576 1.00 0.00 C ATOM 0 H5' DA B 104 6.711 3.752 5.558 1.00 0.00 H new ATOM 0 H5'' DA B 104 7.953 4.708 6.340 1.00 0.00 H new ATOM 0 H4' DA B 104 5.782 5.679 6.676 1.00 0.00 H new ATOM 0 H3' DA B 104 7.562 5.282 8.822 1.00 0.00 H new ATOM 0 H2' DA B 104 6.251 3.627 9.982 1.00 0.00 H new ATOM 0 H2'' DA B 104 5.452 5.072 10.567 1.00 0.00 H new ATOM 0 H1' DA B 104 3.734 4.954 8.980 1.00 0.00 H new ATOM 0 H8 DA B 104 5.398 1.501 9.505 1.00 0.00 H new ATOM 0 H61 DA B 104 -0.306 -0.300 11.044 1.00 0.00 H new ATOM 0 H62 DA B 104 1.392 -0.778 10.952 1.00 0.00 H new ATOM 0 H2 DA B 104 -0.513 3.965 9.673 1.00 0.00 H new ATOM 1427 P DA B 105 6.210 7.501 10.197 1.00 0.00 P ATOM 1428 OP1 DA B 105 6.423 8.941 9.928 1.00 0.00 O ATOM 1429 OP2 DA B 105 7.155 6.766 11.066 1.00 0.00 O ATOM 1430 O5' DA B 105 4.725 7.314 10.794 1.00 0.00 O ATOM 1431 C5' DA B 105 3.604 7.924 10.145 1.00 0.00 C ATOM 1432 C4' DA B 105 2.296 7.659 10.890 1.00 0.00 C ATOM 1433 O4' DA B 105 2.030 6.250 10.922 1.00 0.00 O ATOM 1434 C3' DA B 105 2.278 8.155 12.345 1.00 0.00 C ATOM 1435 O3' DA B 105 1.144 9.030 12.514 1.00 0.00 O ATOM 1436 C2' DA B 105 2.129 6.874 13.169 1.00 0.00 C ATOM 1437 C1' DA B 105 1.451 5.949 12.185 1.00 0.00 C ATOM 1438 N9 DA B 105 1.662 4.520 12.458 1.00 0.00 N ATOM 1439 C8 DA B 105 2.824 3.818 12.466 1.00 0.00 C ATOM 1440 N7 DA B 105 2.699 2.548 12.728 1.00 0.00 N ATOM 1441 C5 DA B 105 1.318 2.406 12.915 1.00 0.00 C ATOM 1442 C6 DA B 105 0.502 1.309 13.227 1.00 0.00 C ATOM 1443 N6 DA B 105 0.976 0.081 13.422 1.00 0.00 N ATOM 1444 N1 DA B 105 -0.824 1.532 13.342 1.00 0.00 N ATOM 1445 C2 DA B 105 -1.312 2.760 13.168 1.00 0.00 C ATOM 1446 N3 DA B 105 -0.628 3.855 12.862 1.00 0.00 N ATOM 1447 C4 DA B 105 0.689 3.603 12.753 1.00 0.00 C ATOM 0 H5' DA B 105 3.524 7.544 9.126 1.00 0.00 H new ATOM 0 H5'' DA B 105 3.768 8.999 10.072 1.00 0.00 H new ATOM 0 H4' DA B 105 1.540 8.217 10.338 1.00 0.00 H new ATOM 0 H3' DA B 105 3.164 8.717 12.641 1.00 0.00 H new ATOM 0 H2' DA B 105 3.093 6.485 13.498 1.00 0.00 H new ATOM 0 H2'' DA B 105 1.527 7.031 14.064 1.00 0.00 H new ATOM 0 H1' DA B 105 0.374 6.109 12.241 1.00 0.00 H new ATOM 0 H8 DA B 105 3.781 4.278 12.270 1.00 0.00 H new ATOM 0 H61 DA B 105 0.338 -0.682 13.647 1.00 0.00 H new ATOM 0 H62 DA B 105 1.978 -0.097 13.347 1.00 0.00 H new ATOM 0 H2 DA B 105 -2.379 2.876 13.289 1.00 0.00 H new ATOM 1459 P DA B 106 0.317 9.146 13.898 1.00 0.00 P ATOM 1460 OP1 DA B 106 -0.533 10.355 13.823 1.00 0.00 O ATOM 1461 OP2 DA B 106 1.252 8.980 15.031 1.00 0.00 O ATOM 1462 O5' DA B 106 -0.647 7.856 13.846 1.00 0.00 O ATOM 1463 C5' DA B 106 -1.801 7.841 12.999 1.00 0.00 C ATOM 1464 C4' DA B 106 -2.924 7.001 13.600 1.00 0.00 C ATOM 1465 O4' DA B 106 -2.478 5.645 13.749 1.00 0.00 O ATOM 1466 C3' DA B 106 -3.387 7.486 14.976 1.00 0.00 C ATOM 1467 O3' DA B 106 -4.815 7.442 15.047 1.00 0.00 O ATOM 1468 C2' DA B 106 -2.785 6.481 15.943 1.00 0.00 C ATOM 1469 C1' DA B 106 -2.686 5.224 15.099 1.00 0.00 C ATOM 1470 N9 DA B 106 -1.551 4.371 15.479 1.00 0.00 N ATOM 1471 C8 DA B 106 -0.223 4.674 15.441 1.00 0.00 C ATOM 1472 N7 DA B 106 0.557 3.755 15.931 1.00 0.00 N ATOM 1473 C5 DA B 106 -0.332 2.747 16.299 1.00 0.00 C ATOM 1474 C6 DA B 106 -0.148 1.484 16.865 1.00 0.00 C ATOM 1475 N6 DA B 106 1.048 0.997 17.195 1.00 0.00 N ATOM 1476 N1 DA B 106 -1.242 0.738 17.077 1.00 0.00 N ATOM 1477 C2 DA B 106 -2.450 1.201 16.756 1.00 0.00 C ATOM 1478 N3 DA B 106 -2.739 2.387 16.230 1.00 0.00 N ATOM 1479 C4 DA B 106 -1.618 3.113 16.023 1.00 0.00 C ATOM 0 H5' DA B 106 -1.531 7.443 12.021 1.00 0.00 H new ATOM 0 H5'' DA B 106 -2.152 8.861 12.842 1.00 0.00 H new ATOM 0 H4' DA B 106 -3.765 7.088 12.912 1.00 0.00 H new ATOM 0 H3' DA B 106 -3.083 8.510 15.192 1.00 0.00 H new ATOM 0 H2' DA B 106 -1.809 6.803 16.306 1.00 0.00 H new ATOM 0 H2'' DA B 106 -3.417 6.332 16.818 1.00 0.00 H new ATOM 0 H1' DA B 106 -3.598 4.643 15.238 1.00 0.00 H new ATOM 0 H8 DA B 106 0.152 5.603 15.037 1.00 0.00 H new ATOM 0 H61 DA B 106 1.124 0.067 17.606 1.00 0.00 H new ATOM 0 H62 DA B 106 1.887 1.555 17.036 1.00 0.00 H new ATOM 0 H2 DA B 106 -3.284 0.541 16.944 1.00 0.00 H new ATOM 1491 P DT B 107 -5.581 7.882 16.393 1.00 0.00 P ATOM 1492 OP1 DT B 107 -6.970 8.246 16.038 1.00 0.00 O ATOM 1493 OP2 DT B 107 -4.727 8.848 17.118 1.00 0.00 O ATOM 1494 O5' DT B 107 -5.621 6.512 17.239 1.00 0.00 O ATOM 1495 C5' DT B 107 -6.399 5.404 16.785 1.00 0.00 C ATOM 1496 C4' DT B 107 -6.415 4.268 17.803 1.00 0.00 C ATOM 1497 O4' DT B 107 -5.140 3.628 17.848 1.00 0.00 O ATOM 1498 C3' DT B 107 -6.730 4.709 19.239 1.00 0.00 C ATOM 1499 O3' DT B 107 -8.024 4.220 19.603 1.00 0.00 O ATOM 1500 C2' DT B 107 -5.644 4.037 20.095 1.00 0.00 C ATOM 1501 C1' DT B 107 -5.036 3.029 19.133 1.00 0.00 C ATOM 1502 N1 DT B 107 -3.610 2.711 19.382 1.00 0.00 N ATOM 1503 C2 DT B 107 -3.291 1.395 19.657 1.00 0.00 C ATOM 1504 O2 DT B 107 -4.149 0.517 19.719 1.00 0.00 O ATOM 1505 N3 DT B 107 -1.950 1.116 19.857 1.00 0.00 N ATOM 1506 C4 DT B 107 -0.918 2.040 19.833 1.00 0.00 C ATOM 1507 O4 DT B 107 0.241 1.691 20.045 1.00 0.00 O ATOM 1508 C5 DT B 107 -1.348 3.393 19.539 1.00 0.00 C ATOM 1509 C7 DT B 107 -0.312 4.511 19.465 1.00 0.00 C ATOM 1510 C6 DT B 107 -2.649 3.681 19.321 1.00 0.00 C ATOM 0 H5' DT B 107 -5.996 5.040 15.840 1.00 0.00 H new ATOM 0 H5'' DT B 107 -7.420 5.732 16.591 1.00 0.00 H new ATOM 0 H4' DT B 107 -7.209 3.604 17.462 1.00 0.00 H new ATOM 0 H3' DT B 107 -6.737 5.792 19.365 1.00 0.00 H new ATOM 0 H2' DT B 107 -4.905 4.756 20.449 1.00 0.00 H new ATOM 0 H2'' DT B 107 -6.065 3.553 20.976 1.00 0.00 H new ATOM 0 H1' DT B 107 -5.567 2.084 19.245 1.00 0.00 H new ATOM 0 H3 DT B 107 -1.699 0.144 20.038 1.00 0.00 H new ATOM 0 H71 DT B 107 0.519 4.282 20.132 1.00 0.00 H new ATOM 0 H72 DT B 107 0.057 4.598 18.443 1.00 0.00 H new ATOM 0 H73 DT B 107 -0.771 5.453 19.767 1.00 0.00 H new ATOM 0 H6 DT B 107 -2.936 4.697 19.094 1.00 0.00 H new ATOM 1523 P DC B 108 -8.605 4.440 21.088 1.00 0.00 P ATOM 1524 OP1 DC B 108 -10.083 4.434 21.014 1.00 0.00 O ATOM 1525 OP2 DC B 108 -7.899 5.589 21.697 1.00 0.00 O ATOM 1526 O5' DC B 108 -8.132 3.100 21.840 1.00 0.00 O ATOM 1527 C5' DC B 108 -8.439 1.818 21.289 1.00 0.00 C ATOM 1528 C4' DC B 108 -7.621 0.714 21.950 1.00 0.00 C ATOM 1529 O4' DC B 108 -6.234 0.887 21.648 1.00 0.00 O ATOM 1530 C3' DC B 108 -7.738 0.673 23.480 1.00 0.00 C ATOM 1531 O3' DC B 108 -8.406 -0.532 23.866 1.00 0.00 O ATOM 1532 C2' DC B 108 -6.284 0.665 23.975 1.00 0.00 C ATOM 1533 C1' DC B 108 -5.507 0.307 22.722 1.00 0.00 C ATOM 1534 N1 DC B 108 -4.126 0.836 22.696 1.00 0.00 N ATOM 1535 C2 DC B 108 -3.087 -0.080 22.608 1.00 0.00 C ATOM 1536 O2 DC B 108 -3.333 -1.282 22.533 1.00 0.00 O ATOM 1537 N3 DC B 108 -1.810 0.389 22.608 1.00 0.00 N ATOM 1538 C4 DC B 108 -1.561 1.702 22.692 1.00 0.00 C ATOM 1539 N4 DC B 108 -0.299 2.129 22.681 1.00 0.00 N ATOM 1540 C5 DC B 108 -2.627 2.650 22.783 1.00 0.00 C ATOM 1541 C6 DC B 108 -3.888 2.176 22.779 1.00 0.00 C ATOM 0 H5' DC B 108 -8.242 1.825 20.217 1.00 0.00 H new ATOM 0 H5'' DC B 108 -9.501 1.611 21.417 1.00 0.00 H new ATOM 0 H4' DC B 108 -8.027 -0.215 21.550 1.00 0.00 H new ATOM 0 H3' DC B 108 -8.304 1.508 23.892 1.00 0.00 H new ATOM 0 H2' DC B 108 -5.986 1.635 24.373 1.00 0.00 H new ATOM 0 H2'' DC B 108 -6.131 -0.066 24.769 1.00 0.00 H new ATOM 0 H1' DC B 108 -5.409 -0.777 22.665 1.00 0.00 H new ATOM 0 H41 DC B 108 -0.098 3.127 22.744 1.00 0.00 H new ATOM 0 H42 DC B 108 0.466 1.458 22.609 1.00 0.00 H new ATOM 0 H5 DC B 108 -2.428 3.709 22.853 1.00 0.00 H new ATOM 0 H6 DC B 108 -4.718 2.864 22.842 1.00 0.00 H new ATOM 1553 P DA B 109 -8.428 -1.010 25.401 1.00 0.00 P ATOM 1554 OP1 DA B 109 -9.625 -1.855 25.610 1.00 0.00 O ATOM 1555 OP2 DA B 109 -8.193 0.171 26.263 1.00 0.00 O ATOM 1556 O5' DA B 109 -7.128 -1.947 25.482 1.00 0.00 O ATOM 1557 C5' DA B 109 -6.985 -3.067 24.612 1.00 0.00 C ATOM 1558 C4' DA B 109 -6.012 -4.074 25.197 1.00 0.00 C ATOM 1559 O4' DA B 109 -4.695 -3.497 25.255 1.00 0.00 O ATOM 1560 C3' DA B 109 -6.358 -4.491 26.617 1.00 0.00 C ATOM 1561 O3' DA B 109 -5.860 -5.817 26.844 1.00 0.00 O ATOM 1562 C2' DA B 109 -5.594 -3.464 27.444 1.00 0.00 C ATOM 1563 C1' DA B 109 -4.328 -3.312 26.631 1.00 0.00 C ATOM 1564 N9 DA B 109 -3.611 -2.018 26.747 1.00 0.00 N ATOM 1565 C8 DA B 109 -4.084 -0.742 26.933 1.00 0.00 C ATOM 1566 N7 DA B 109 -3.154 0.173 27.012 1.00 0.00 N ATOM 1567 C5 DA B 109 -1.974 -0.558 26.846 1.00 0.00 C ATOM 1568 C6 DA B 109 -0.614 -0.197 26.810 1.00 0.00 C ATOM 1569 N6 DA B 109 -0.189 1.057 26.954 1.00 0.00 N ATOM 1570 N1 DA B 109 0.287 -1.187 26.615 1.00 0.00 N ATOM 1571 C2 DA B 109 -0.131 -2.445 26.465 1.00 0.00 C ATOM 1572 N3 DA B 109 -1.380 -2.877 26.491 1.00 0.00 N ATOM 1573 C4 DA B 109 -2.252 -1.879 26.683 1.00 0.00 C ATOM 0 H5' DA B 109 -6.630 -2.734 23.637 1.00 0.00 H new ATOM 0 H5'' DA B 109 -7.955 -3.539 24.455 1.00 0.00 H new ATOM 0 H4' DA B 109 -6.063 -4.947 24.546 1.00 0.00 H new ATOM 0 H3' DA B 109 -7.423 -4.515 26.848 1.00 0.00 H new ATOM 0 H2' DA B 109 -6.138 -2.524 27.537 1.00 0.00 H new ATOM 0 H2'' DA B 109 -5.393 -3.818 28.455 1.00 0.00 H new ATOM 0 H1' DA B 109 -3.628 -4.050 27.024 1.00 0.00 H new ATOM 0 H8 DA B 109 -5.137 -0.514 27.008 1.00 0.00 H new ATOM 0 H61 DA B 109 0.809 1.264 26.920 1.00 0.00 H new ATOM 0 H62 DA B 109 -0.862 1.810 27.099 1.00 0.00 H new ATOM 0 H2 DA B 109 0.634 -3.191 26.305 1.00 0.00 H new ATOM 1585 P DC B 110 -5.756 -6.451 28.322 1.00 0.00 P ATOM 1586 OP1 DC B 110 -6.068 -7.895 28.227 1.00 0.00 O ATOM 1587 OP2 DC B 110 -6.517 -5.595 29.258 1.00 0.00 O ATOM 1588 O5' DC B 110 -4.184 -6.300 28.646 1.00 0.00 O ATOM 1589 C5' DC B 110 -3.222 -6.997 27.846 1.00 0.00 C ATOM 1590 C4' DC B 110 -1.789 -6.736 28.308 1.00 0.00 C ATOM 1591 O4' DC B 110 -1.490 -5.338 28.193 1.00 0.00 O ATOM 1592 C3' DC B 110 -1.506 -7.139 29.764 1.00 0.00 C ATOM 1593 O3' DC B 110 -0.377 -8.019 29.803 1.00 0.00 O ATOM 1594 C2' DC B 110 -1.161 -5.822 30.453 1.00 0.00 C ATOM 1595 C1' DC B 110 -0.660 -4.987 29.293 1.00 0.00 C ATOM 1596 N1 DC B 110 -0.756 -3.526 29.500 1.00 0.00 N ATOM 1597 C2 DC B 110 0.418 -2.837 29.775 1.00 0.00 C ATOM 1598 O2 DC B 110 1.486 -3.442 29.841 1.00 0.00 O ATOM 1599 N3 DC B 110 0.347 -1.492 29.968 1.00 0.00 N ATOM 1600 C4 DC B 110 -0.824 -0.847 29.894 1.00 0.00 C ATOM 1601 N4 DC B 110 -0.859 0.473 30.085 1.00 0.00 N ATOM 1602 C5 DC B 110 -2.035 -1.551 29.609 1.00 0.00 C ATOM 1603 C6 DC B 110 -1.956 -2.883 29.420 1.00 0.00 C ATOM 0 H5' DC B 110 -3.328 -6.691 26.805 1.00 0.00 H new ATOM 0 H5'' DC B 110 -3.426 -8.067 27.886 1.00 0.00 H new ATOM 0 H4' DC B 110 -1.166 -7.355 27.663 1.00 0.00 H new ATOM 0 H3' DC B 110 -2.343 -7.654 30.236 1.00 0.00 H new ATOM 0 H2' DC B 110 -2.029 -5.373 30.935 1.00 0.00 H new ATOM 0 H2'' DC B 110 -0.400 -5.950 31.223 1.00 0.00 H new ATOM 0 H1' DC B 110 0.401 -5.193 29.150 1.00 0.00 H new ATOM 0 H41 DC B 110 -1.746 0.973 30.031 1.00 0.00 H new ATOM 0 H42 DC B 110 0.002 0.982 30.285 1.00 0.00 H new ATOM 0 H5 DC B 110 -2.981 -1.033 29.547 1.00 0.00 H new ATOM 0 H6 DC B 110 -2.851 -3.447 29.203 1.00 0.00 H new ATOM 1615 P DT B 111 0.128 -8.655 31.196 1.00 0.00 P ATOM 1616 OP1 DT B 111 0.901 -9.880 30.891 1.00 0.00 O ATOM 1617 OP2 DT B 111 -1.028 -8.723 32.117 1.00 0.00 O ATOM 1618 O5' DT B 111 1.149 -7.540 31.750 1.00 0.00 O ATOM 1619 C5' DT B 111 2.424 -7.345 31.129 1.00 0.00 C ATOM 1620 C4' DT B 111 3.239 -6.270 31.842 1.00 0.00 C ATOM 1621 O4' DT B 111 2.576 -5.010 31.728 1.00 0.00 O ATOM 1622 C3' DT B 111 3.448 -6.527 33.342 1.00 0.00 C ATOM 1623 O3' DT B 111 4.838 -6.748 33.598 1.00 0.00 O ATOM 1624 C2' DT B 111 2.991 -5.232 34.026 1.00 0.00 C ATOM 1625 C1' DT B 111 2.918 -4.244 32.874 1.00 0.00 C ATOM 1626 N1 DT B 111 1.896 -3.184 33.036 1.00 0.00 N ATOM 1627 C2 DT B 111 2.339 -1.887 33.236 1.00 0.00 C ATOM 1628 O2 DT B 111 3.535 -1.606 33.290 1.00 0.00 O ATOM 1629 N3 DT B 111 1.356 -0.924 33.369 1.00 0.00 N ATOM 1630 C4 DT B 111 -0.008 -1.138 33.323 1.00 0.00 C ATOM 1631 O4 DT B 111 -0.791 -0.199 33.450 1.00 0.00 O ATOM 1632 C5 DT B 111 -0.381 -2.517 33.111 1.00 0.00 C ATOM 1633 C7 DT B 111 -1.860 -2.885 33.013 1.00 0.00 C ATOM 1634 C6 DT B 111 0.558 -3.479 32.979 1.00 0.00 C ATOM 0 H5' DT B 111 2.282 -7.062 30.086 1.00 0.00 H new ATOM 0 H5'' DT B 111 2.978 -8.284 31.132 1.00 0.00 H new ATOM 0 H4' DT B 111 4.215 -6.282 31.356 1.00 0.00 H new ATOM 0 H3' DT B 111 2.901 -7.399 33.700 1.00 0.00 H new ATOM 0 H2' DT B 111 2.025 -5.353 34.515 1.00 0.00 H new ATOM 0 H2'' DT B 111 3.697 -4.909 34.791 1.00 0.00 H new ATOM 0 H1' DT B 111 3.877 -3.729 32.808 1.00 0.00 H new ATOM 0 H3 DT B 111 1.668 0.036 33.515 1.00 0.00 H new ATOM 0 H71 DT B 111 -2.448 -2.193 33.616 1.00 0.00 H new ATOM 0 H72 DT B 111 -2.182 -2.825 31.973 1.00 0.00 H new ATOM 0 H73 DT B 111 -2.007 -3.901 33.380 1.00 0.00 H new ATOM 0 H6 DT B 111 0.248 -4.502 32.825 1.00 0.00 H new ATOM 1647 P DG B 112 5.325 -7.348 35.011 1.00 0.00 P ATOM 1648 OP1 DG B 112 6.420 -8.309 34.752 1.00 0.00 O ATOM 1649 OP2 DG B 112 4.128 -7.780 35.767 1.00 0.00 O ATOM 1650 O5' DG B 112 5.950 -6.062 35.752 1.00 0.00 O ATOM 1651 C5' DG B 112 7.271 -5.611 35.436 1.00 0.00 C ATOM 1652 C4' DG B 112 7.720 -4.493 36.372 1.00 0.00 C ATOM 1653 O4' DG B 112 6.806 -3.392 36.264 1.00 0.00 O ATOM 1654 C3' DG B 112 7.770 -4.896 37.846 1.00 0.00 C ATOM 1655 O3' DG B 112 8.875 -4.253 38.489 1.00 0.00 O ATOM 1656 C2' DG B 112 6.463 -4.361 38.404 1.00 0.00 C ATOM 1657 C1' DG B 112 6.235 -3.122 37.549 1.00 0.00 C ATOM 1658 N9 DG B 112 4.814 -2.777 37.340 1.00 0.00 N ATOM 1659 C8 DG B 112 3.756 -3.599 37.070 1.00 0.00 C ATOM 1660 N7 DG B 112 2.614 -2.999 36.920 1.00 0.00 N ATOM 1661 C5 DG B 112 2.934 -1.655 37.104 1.00 0.00 C ATOM 1662 C6 DG B 112 2.097 -0.507 37.060 1.00 0.00 C ATOM 1663 O6 DG B 112 0.890 -0.450 36.844 1.00 0.00 O ATOM 1664 N1 DG B 112 2.816 0.654 37.299 1.00 0.00 N ATOM 1665 C2 DG B 112 4.171 0.711 37.552 1.00 0.00 C ATOM 1666 N2 DG B 112 4.681 1.925 37.757 1.00 0.00 N ATOM 1667 N3 DG B 112 4.961 -0.366 37.594 1.00 0.00 N ATOM 1668 C4 DG B 112 4.279 -1.510 37.363 1.00 0.00 C ATOM 0 H5' DG B 112 7.299 -5.257 34.405 1.00 0.00 H new ATOM 0 H5'' DG B 112 7.968 -6.446 35.505 1.00 0.00 H new ATOM 0 H4' DG B 112 8.733 -4.235 36.062 1.00 0.00 H new ATOM 0 H3' DG B 112 7.892 -5.969 37.994 1.00 0.00 H new ATOM 0 H2' DG B 112 5.651 -5.081 38.303 1.00 0.00 H new ATOM 0 H2'' DG B 112 6.542 -4.116 39.463 1.00 0.00 H new ATOM 0 H1' DG B 112 6.688 -2.280 38.072 1.00 0.00 H new ATOM 0 H8 DG B 112 3.862 -4.671 36.987 1.00 0.00 H new ATOM 0 H1 DG B 112 2.303 1.535 37.287 1.00 0.00 H new ATOM 0 H21 DG B 112 5.677 2.034 37.949 1.00 0.00 H new ATOM 0 H22 DG B 112 4.076 2.745 37.722 1.00 0.00 H new ATOM 1680 P DC B 113 9.215 -4.565 40.035 1.00 0.00 P ATOM 1681 OP1 DC B 113 10.670 -4.388 40.232 1.00 0.00 O ATOM 1682 OP2 DC B 113 8.572 -5.848 40.399 1.00 0.00 O ATOM 1683 O5' DC B 113 8.453 -3.380 40.818 1.00 0.00 O ATOM 1684 C5' DC B 113 9.129 -2.151 41.106 1.00 0.00 C ATOM 1685 C4' DC B 113 8.267 -1.215 41.951 1.00 0.00 C ATOM 1686 O4' DC B 113 7.066 -0.900 41.239 1.00 0.00 O ATOM 1687 C3' DC B 113 7.846 -1.791 43.312 1.00 0.00 C ATOM 1688 O3' DC B 113 8.313 -0.930 44.356 1.00 0.00 O ATOM 1689 C2' DC B 113 6.316 -1.785 43.277 1.00 0.00 C ATOM 1690 C1' DC B 113 6.018 -0.768 42.190 1.00 0.00 C ATOM 1691 N1 DC B 113 4.738 -0.984 41.480 1.00 0.00 N ATOM 1692 C2 DC B 113 3.813 0.052 41.489 1.00 0.00 C ATOM 1693 O2 DC B 113 4.060 1.095 42.089 1.00 0.00 O ATOM 1694 N3 DC B 113 2.640 -0.125 40.821 1.00 0.00 N ATOM 1695 C4 DC B 113 2.385 -1.267 40.170 1.00 0.00 C ATOM 1696 N4 DC B 113 1.235 -1.401 39.511 1.00 0.00 N ATOM 1697 C5 DC B 113 3.332 -2.337 40.162 1.00 0.00 C ATOM 1698 C6 DC B 113 4.488 -2.154 40.826 1.00 0.00 C ATOM 0 H5' DC B 113 9.396 -1.656 40.173 1.00 0.00 H new ATOM 0 H5'' DC B 113 10.060 -2.363 41.632 1.00 0.00 H new ATOM 0 H4' DC B 113 8.891 -0.342 42.139 1.00 0.00 H new ATOM 0 H3' DC B 113 8.252 -2.786 43.494 1.00 0.00 H new ATOM 0 H2' DC B 113 5.911 -2.768 43.035 1.00 0.00 H new ATOM 0 H2'' DC B 113 5.889 -1.491 44.236 1.00 0.00 H new ATOM 0 H1' DC B 113 5.944 0.214 42.658 1.00 0.00 H new ATOM 0 H41 DC B 113 1.031 -2.267 39.012 1.00 0.00 H new ATOM 0 H42 DC B 113 0.558 -0.638 39.506 1.00 0.00 H new ATOM 0 H5 DC B 113 3.127 -3.261 39.641 1.00 0.00 H new ATOM 0 H6 DC B 113 5.226 -2.942 40.841 1.00 0.00 H new ATOM 1710 P DC B 114 8.000 -1.260 45.901 1.00 0.00 P ATOM 1711 OP1 DC B 114 9.088 -0.690 46.726 1.00 0.00 O ATOM 1712 OP2 DC B 114 7.669 -2.699 46.008 1.00 0.00 O ATOM 1713 O5' DC B 114 6.658 -0.414 46.181 1.00 0.00 O ATOM 1714 C5' DC B 114 6.693 1.016 46.192 1.00 0.00 C ATOM 1715 C4' DC B 114 5.326 1.610 46.524 1.00 0.00 C ATOM 1716 O4' DC B 114 4.375 1.206 45.534 1.00 0.00 O ATOM 1717 C3' DC B 114 4.765 1.181 47.890 1.00 0.00 C ATOM 1718 O3' DC B 114 4.549 2.342 48.697 1.00 0.00 O ATOM 1719 C2' DC B 114 3.425 0.516 47.563 1.00 0.00 C ATOM 1720 C1' DC B 114 3.117 1.053 46.177 1.00 0.00 C ATOM 1721 N1 DC B 114 2.286 0.156 45.345 1.00 0.00 N ATOM 1722 C2 DC B 114 1.061 0.636 44.902 1.00 0.00 C ATOM 1723 O2 DC B 114 0.695 1.768 45.211 1.00 0.00 O ATOM 1724 N3 DC B 114 0.290 -0.176 44.130 1.00 0.00 N ATOM 1725 C4 DC B 114 0.701 -1.407 43.802 1.00 0.00 C ATOM 1726 N4 DC B 114 -0.080 -2.175 43.044 1.00 0.00 N ATOM 1727 C5 DC B 114 1.963 -1.907 44.255 1.00 0.00 C ATOM 1728 C6 DC B 114 2.720 -1.096 45.019 1.00 0.00 C ATOM 0 H5' DC B 114 7.022 1.380 45.218 1.00 0.00 H new ATOM 0 H5'' DC B 114 7.426 1.357 46.924 1.00 0.00 H new ATOM 0 H4' DC B 114 5.478 2.689 46.548 1.00 0.00 H new ATOM 0 H3' DC B 114 5.435 0.516 48.435 1.00 0.00 H new ATOM 0 H2' DC B 114 3.500 -0.571 47.569 1.00 0.00 H new ATOM 0 H2'' DC B 114 2.652 0.786 48.283 1.00 0.00 H new ATOM 0 H1' DC B 114 2.547 1.976 46.287 1.00 0.00 H new ATOM 0 H41 DC B 114 0.223 -3.115 42.788 1.00 0.00 H new ATOM 0 H42 DC B 114 -0.981 -1.823 42.720 1.00 0.00 H new ATOM 0 H5 DC B 114 2.297 -2.900 43.993 1.00 0.00 H new ATOM 0 H6 DC B 114 3.679 -1.440 45.377 1.00 0.00 H new ATOM 1740 P DT B 115 4.041 2.202 50.219 1.00 0.00 P ATOM 1741 OP1 DT B 115 4.527 3.375 50.979 1.00 0.00 O ATOM 1742 OP2 DT B 115 4.358 0.835 50.689 1.00 0.00 O ATOM 1743 O5' DT B 115 2.443 2.326 50.070 1.00 0.00 O ATOM 1744 C5' DT B 115 1.845 3.563 49.675 1.00 0.00 C ATOM 1745 C4' DT B 115 0.322 3.495 49.737 1.00 0.00 C ATOM 1746 O4' DT B 115 -0.146 2.483 48.841 1.00 0.00 O ATOM 1747 C3' DT B 115 -0.238 3.160 51.127 1.00 0.00 C ATOM 1748 O3' DT B 115 -1.057 4.240 51.586 1.00 0.00 O ATOM 1749 C2' DT B 115 -1.100 1.914 50.907 1.00 0.00 C ATOM 1750 C1' DT B 115 -1.321 1.919 49.405 1.00 0.00 C ATOM 1751 N1 DT B 115 -1.510 0.576 48.814 1.00 0.00 N ATOM 1752 C2 DT B 115 -2.734 0.297 48.231 1.00 0.00 C ATOM 1753 O2 DT B 115 -3.644 1.122 48.197 1.00 0.00 O ATOM 1754 N3 DT B 115 -2.874 -0.967 47.690 1.00 0.00 N ATOM 1755 C4 DT B 115 -1.911 -1.961 47.679 1.00 0.00 C ATOM 1756 O4 DT B 115 -2.145 -3.053 47.164 1.00 0.00 O ATOM 1757 C5 DT B 115 -0.667 -1.579 48.309 1.00 0.00 C ATOM 1758 C7 DT B 115 0.484 -2.581 48.369 1.00 0.00 C ATOM 1759 C6 DT B 115 -0.505 -0.352 48.846 1.00 0.00 C ATOM 0 H5' DT B 115 2.158 3.812 48.661 1.00 0.00 H new ATOM 0 H5'' DT B 115 2.201 4.363 50.324 1.00 0.00 H new ATOM 0 H4' DT B 115 -0.025 4.493 49.467 1.00 0.00 H new ATOM 0 H3' DT B 115 0.546 2.998 51.867 1.00 0.00 H new ATOM 0 H2' DT B 115 -0.593 1.008 51.238 1.00 0.00 H new ATOM 0 H2'' DT B 115 -2.041 1.971 51.454 1.00 0.00 H new ATOM 0 H1' DT B 115 -2.235 2.475 49.197 1.00 0.00 H new ATOM 0 H3 DT B 115 -3.771 -1.188 47.258 1.00 0.00 H new ATOM 0 H71 DT B 115 1.433 -2.046 48.358 1.00 0.00 H new ATOM 0 H72 DT B 115 0.408 -3.168 49.285 1.00 0.00 H new ATOM 0 H73 DT B 115 0.433 -3.246 47.507 1.00 0.00 H new ATOM 0 H6 DT B 115 0.436 -0.097 49.310 1.00 0.00 H new ATOM 1772 P DA B 116 -1.775 4.167 53.025 1.00 0.00 P ATOM 1773 OP1 DA B 116 -1.881 5.543 53.559 1.00 0.00 O ATOM 1774 OP2 DA B 116 -1.106 3.115 53.823 1.00 0.00 O ATOM 1775 O5' DA B 116 -3.258 3.653 52.659 1.00 0.00 O ATOM 1776 C5' DA B 116 -4.234 4.565 52.149 1.00 0.00 C ATOM 1777 C4' DA B 116 -5.630 3.947 52.129 1.00 0.00 C ATOM 1778 O4' DA B 116 -5.644 2.836 51.219 1.00 0.00 O ATOM 1779 C3' DA B 116 -6.107 3.428 53.493 1.00 0.00 C ATOM 1780 O3' DA B 116 -7.459 3.812 53.753 1.00 0.00 O ATOM 1781 C2' DA B 116 -5.974 1.918 53.358 1.00 0.00 C ATOM 1782 C1' DA B 116 -6.227 1.714 51.877 1.00 0.00 C ATOM 1783 N9 DA B 116 -5.615 0.495 51.316 1.00 0.00 N ATOM 1784 C8 DA B 116 -4.362 -0.008 51.513 1.00 0.00 C ATOM 1785 N7 DA B 116 -4.102 -1.106 50.867 1.00 0.00 N ATOM 1786 C5 DA B 116 -5.290 -1.355 50.180 1.00 0.00 C ATOM 1787 C6 DA B 116 -5.683 -2.375 49.307 1.00 0.00 C ATOM 1788 N6 DA B 116 -4.884 -3.383 48.956 1.00 0.00 N ATOM 1789 N1 DA B 116 -6.930 -2.316 48.809 1.00 0.00 N ATOM 1790 C2 DA B 116 -7.744 -1.316 49.148 1.00 0.00 C ATOM 1791 N3 DA B 116 -7.471 -0.303 49.965 1.00 0.00 N ATOM 1792 C4 DA B 116 -6.215 -0.388 50.449 1.00 0.00 C ATOM 0 H5' DA B 116 -3.956 4.868 51.140 1.00 0.00 H new ATOM 0 H5'' DA B 116 -4.244 5.467 52.761 1.00 0.00 H new ATOM 0 H4' DA B 116 -6.303 4.748 51.825 1.00 0.00 H new ATOM 0 H3' DA B 116 -5.533 3.832 54.327 1.00 0.00 H new ATOM 0 H2' DA B 116 -4.986 1.567 53.656 1.00 0.00 H new ATOM 0 H2'' DA B 116 -6.700 1.387 53.974 1.00 0.00 H new ATOM 0 HO3' DA B 116 -7.735 3.466 54.627 1.00 0.00 H new ATOM 0 H1' DA B 116 -7.302 1.611 51.731 1.00 0.00 H new ATOM 0 H8 DA B 116 -3.640 0.470 52.158 1.00 0.00 H new ATOM 0 H61 DA B 116 -5.221 -4.101 48.315 1.00 0.00 H new ATOM 0 H62 DA B 116 -3.936 -3.436 49.328 1.00 0.00 H new ATOM 0 H2 DA B 116 -8.732 -1.330 48.712 1.00 0.00 H new TER 1805 DA B 116 ATOM 1806 O5' DT C 201 -12.329 -8.275 44.426 1.00 0.00 O ATOM 1807 C5' DT C 201 -13.412 -7.648 45.117 1.00 0.00 C ATOM 1808 C4' DT C 201 -13.154 -6.160 45.333 1.00 0.00 C ATOM 1809 O4' DT C 201 -11.965 -5.994 46.115 1.00 0.00 O ATOM 1810 C3' DT C 201 -12.964 -5.357 44.037 1.00 0.00 C ATOM 1811 O3' DT C 201 -13.866 -4.247 44.033 1.00 0.00 O ATOM 1812 C2' DT C 201 -11.521 -4.859 44.107 1.00 0.00 C ATOM 1813 C1' DT C 201 -11.243 -4.881 45.599 1.00 0.00 C ATOM 1814 N1 DT C 201 -9.819 -5.064 45.958 1.00 0.00 N ATOM 1815 C2 DT C 201 -9.227 -4.094 46.748 1.00 0.00 C ATOM 1816 O2 DT C 201 -9.841 -3.101 47.134 1.00 0.00 O ATOM 1817 N3 DT C 201 -7.902 -4.305 47.079 1.00 0.00 N ATOM 1818 C4 DT C 201 -7.127 -5.385 46.693 1.00 0.00 C ATOM 1819 O4 DT C 201 -5.952 -5.472 47.045 1.00 0.00 O ATOM 1820 C5 DT C 201 -7.828 -6.346 45.870 1.00 0.00 C ATOM 1821 C7 DT C 201 -7.093 -7.587 45.371 1.00 0.00 C ATOM 1822 C6 DT C 201 -9.121 -6.164 45.535 1.00 0.00 C ATOM 0 H5' DT C 201 -13.561 -8.136 46.080 1.00 0.00 H new ATOM 0 H5'' DT C 201 -14.332 -7.779 44.548 1.00 0.00 H new ATOM 0 H4' DT C 201 -14.045 -5.778 45.832 1.00 0.00 H new ATOM 0 H3' DT C 201 -13.156 -5.944 43.139 1.00 0.00 H new ATOM 0 H2' DT C 201 -10.840 -5.508 43.557 1.00 0.00 H new ATOM 0 H2'' DT C 201 -11.415 -3.858 43.688 1.00 0.00 H new ATOM 0 HO5' DT C 201 -12.526 -9.228 44.306 1.00 0.00 H new ATOM 0 H1' DT C 201 -11.538 -3.915 46.009 1.00 0.00 H new ATOM 0 H3 DT C 201 -7.453 -3.599 47.662 1.00 0.00 H new ATOM 0 H71 DT C 201 -7.801 -8.408 45.257 1.00 0.00 H new ATOM 0 H72 DT C 201 -6.628 -7.372 44.409 1.00 0.00 H new ATOM 0 H73 DT C 201 -6.324 -7.869 46.091 1.00 0.00 H new ATOM 0 H6 DT C 201 -9.617 -6.901 44.920 1.00 0.00 H new ATOM 1836 P DA C 202 -13.912 -3.229 42.786 1.00 0.00 P ATOM 1837 OP1 DA C 202 -15.274 -2.657 42.705 1.00 0.00 O ATOM 1838 OP2 DA C 202 -13.325 -3.911 41.611 1.00 0.00 O ATOM 1839 O5' DA C 202 -12.902 -2.061 43.247 1.00 0.00 O ATOM 1840 C5' DA C 202 -13.269 -1.155 44.291 1.00 0.00 C ATOM 1841 C4' DA C 202 -12.171 -0.128 44.551 1.00 0.00 C ATOM 1842 O4' DA C 202 -10.986 -0.799 44.986 1.00 0.00 O ATOM 1843 C3' DA C 202 -11.790 0.710 43.319 1.00 0.00 C ATOM 1844 O3' DA C 202 -12.010 2.096 43.597 1.00 0.00 O ATOM 1845 C2' DA C 202 -10.294 0.451 43.125 1.00 0.00 C ATOM 1846 C1' DA C 202 -9.870 -0.080 44.482 1.00 0.00 C ATOM 1847 N9 DA C 202 -8.715 -0.996 44.440 1.00 0.00 N ATOM 1848 C8 DA C 202 -8.483 -2.052 43.605 1.00 0.00 C ATOM 1849 N7 DA C 202 -7.353 -2.665 43.795 1.00 0.00 N ATOM 1850 C5 DA C 202 -6.783 -1.956 44.850 1.00 0.00 C ATOM 1851 C6 DA C 202 -5.574 -2.094 45.540 1.00 0.00 C ATOM 1852 N6 DA C 202 -4.675 -3.037 45.259 1.00 0.00 N ATOM 1853 N1 DA C 202 -5.327 -1.222 46.531 1.00 0.00 N ATOM 1854 C2 DA C 202 -6.212 -0.272 46.832 1.00 0.00 C ATOM 1855 N3 DA C 202 -7.382 -0.051 46.242 1.00 0.00 N ATOM 1856 C4 DA C 202 -7.605 -0.940 45.250 1.00 0.00 C ATOM 0 H5' DA C 202 -13.470 -1.714 45.205 1.00 0.00 H new ATOM 0 H5'' DA C 202 -14.192 -0.642 44.021 1.00 0.00 H new ATOM 0 H4' DA C 202 -12.575 0.548 45.305 1.00 0.00 H new ATOM 0 H3' DA C 202 -12.375 0.451 42.436 1.00 0.00 H new ATOM 0 H2' DA C 202 -10.108 -0.272 42.331 1.00 0.00 H new ATOM 0 H2'' DA C 202 -9.756 1.361 42.860 1.00 0.00 H new ATOM 0 H1' DA C 202 -9.564 0.765 45.099 1.00 0.00 H new ATOM 0 H8 DA C 202 -9.186 -2.355 42.844 1.00 0.00 H new ATOM 0 H61 DA C 202 -3.809 -3.092 45.795 1.00 0.00 H new ATOM 0 H62 DA C 202 -4.853 -3.704 44.508 1.00 0.00 H new ATOM 0 H2 DA C 202 -5.950 0.390 47.644 1.00 0.00 H new ATOM 1868 P DG C 203 -11.957 3.185 42.412 1.00 0.00 P ATOM 1869 OP1 DG C 203 -12.703 4.385 42.852 1.00 0.00 O ATOM 1870 OP2 DG C 203 -12.327 2.509 41.147 1.00 0.00 O ATOM 1871 O5' DG C 203 -10.393 3.562 42.342 1.00 0.00 O ATOM 1872 C5' DG C 203 -9.852 4.571 43.199 1.00 0.00 C ATOM 1873 C4' DG C 203 -8.389 4.857 42.876 1.00 0.00 C ATOM 1874 O4' DG C 203 -7.591 3.721 43.200 1.00 0.00 O ATOM 1875 C3' DG C 203 -8.117 5.176 41.401 1.00 0.00 C ATOM 1876 O3' DG C 203 -7.800 6.564 41.264 1.00 0.00 O ATOM 1877 C2' DG C 203 -6.892 4.322 41.037 1.00 0.00 C ATOM 1878 C1' DG C 203 -6.432 3.780 42.384 1.00 0.00 C ATOM 1879 N9 DG C 203 -5.846 2.425 42.328 1.00 0.00 N ATOM 1880 C8 DG C 203 -6.408 1.264 41.879 1.00 0.00 C ATOM 1881 N7 DG C 203 -5.645 0.215 41.959 1.00 0.00 N ATOM 1882 C5 DG C 203 -4.468 0.718 42.510 1.00 0.00 C ATOM 1883 C6 DG C 203 -3.256 0.049 42.836 1.00 0.00 C ATOM 1884 O6 DG C 203 -2.982 -1.141 42.702 1.00 0.00 O ATOM 1885 N1 DG C 203 -2.320 0.923 43.370 1.00 0.00 N ATOM 1886 C2 DG C 203 -2.518 2.273 43.566 1.00 0.00 C ATOM 1887 N2 DG C 203 -1.495 2.948 44.092 1.00 0.00 N ATOM 1888 N3 DG C 203 -3.654 2.907 43.261 1.00 0.00 N ATOM 1889 C4 DG C 203 -4.582 2.071 42.738 1.00 0.00 C ATOM 0 H5' DG C 203 -9.940 4.253 44.238 1.00 0.00 H new ATOM 0 H5'' DG C 203 -10.434 5.487 43.096 1.00 0.00 H new ATOM 0 H4' DG C 203 -8.137 5.737 43.468 1.00 0.00 H new ATOM 0 H3' DG C 203 -8.973 4.966 40.760 1.00 0.00 H new ATOM 0 H2' DG C 203 -7.152 3.519 40.347 1.00 0.00 H new ATOM 0 H2'' DG C 203 -6.115 4.917 40.556 1.00 0.00 H new ATOM 0 H1' DG C 203 -5.647 4.435 42.761 1.00 0.00 H new ATOM 0 H8 DG C 203 -7.413 1.221 41.486 1.00 0.00 H new ATOM 0 H1 DG C 203 -1.415 0.537 43.638 1.00 0.00 H new ATOM 0 H21 DG C 203 -1.579 3.950 44.262 1.00 0.00 H new ATOM 0 H22 DG C 203 -0.629 2.462 44.325 1.00 0.00 H new ATOM 1901 P DG C 204 -7.434 7.184 39.824 1.00 0.00 P ATOM 1902 OP1 DG C 204 -7.896 8.591 39.794 1.00 0.00 O ATOM 1903 OP2 DG C 204 -7.889 6.236 38.782 1.00 0.00 O ATOM 1904 O5' DG C 204 -5.825 7.182 39.840 1.00 0.00 O ATOM 1905 C5' DG C 204 -5.110 8.015 40.756 1.00 0.00 C ATOM 1906 C4' DG C 204 -3.604 7.792 40.663 1.00 0.00 C ATOM 1907 O4' DG C 204 -3.313 6.417 40.892 1.00 0.00 O ATOM 1908 C3' DG C 204 -2.992 8.148 39.303 1.00 0.00 C ATOM 1909 O3' DG C 204 -2.232 9.355 39.427 1.00 0.00 O ATOM 1910 C2' DG C 204 -2.058 6.974 38.975 1.00 0.00 C ATOM 1911 C1' DG C 204 -2.084 6.131 40.243 1.00 0.00 C ATOM 1912 N9 DG C 204 -2.033 4.677 40.001 1.00 0.00 N ATOM 1913 C8 DG C 204 -2.948 3.877 39.379 1.00 0.00 C ATOM 1914 N7 DG C 204 -2.632 2.619 39.319 1.00 0.00 N ATOM 1915 C5 DG C 204 -1.394 2.572 39.959 1.00 0.00 C ATOM 1916 C6 DG C 204 -0.541 1.464 40.208 1.00 0.00 C ATOM 1917 O6 DG C 204 -0.719 0.286 39.912 1.00 0.00 O ATOM 1918 N1 DG C 204 0.611 1.849 40.879 1.00 0.00 N ATOM 1919 C2 DG C 204 0.909 3.139 41.267 1.00 0.00 C ATOM 1920 N2 DG C 204 2.067 3.312 41.905 1.00 0.00 N ATOM 1921 N3 DG C 204 0.109 4.184 41.035 1.00 0.00 N ATOM 1922 C4 DG C 204 -1.021 3.828 40.380 1.00 0.00 C ATOM 0 H5' DG C 204 -5.446 7.811 41.773 1.00 0.00 H new ATOM 0 H5'' DG C 204 -5.337 9.061 40.550 1.00 0.00 H new ATOM 0 H4' DG C 204 -3.171 8.454 41.413 1.00 0.00 H new ATOM 0 H3' DG C 204 -3.744 8.304 38.530 1.00 0.00 H new ATOM 0 H2' DG C 204 -2.411 6.410 38.111 1.00 0.00 H new ATOM 0 H2'' DG C 204 -1.050 7.317 38.742 1.00 0.00 H new ATOM 0 H1' DG C 204 -1.200 6.382 40.829 1.00 0.00 H new ATOM 0 H8 DG C 204 -3.869 4.263 38.967 1.00 0.00 H new ATOM 0 H1 DG C 204 1.290 1.122 41.103 1.00 0.00 H new ATOM 0 H21 DG C 204 2.343 4.243 42.217 1.00 0.00 H new ATOM 0 H22 DG C 204 2.677 2.513 42.081 1.00 0.00 H new ATOM 1934 P DC C 205 -1.644 10.093 38.122 1.00 0.00 P ATOM 1935 OP1 DC C 205 -1.395 11.510 38.465 1.00 0.00 O ATOM 1936 OP2 DC C 205 -2.509 9.754 36.970 1.00 0.00 O ATOM 1937 O5' DC C 205 -0.222 9.368 37.915 1.00 0.00 O ATOM 1938 C5' DC C 205 0.850 9.595 38.834 1.00 0.00 C ATOM 1939 C4' DC C 205 2.076 8.756 38.482 1.00 0.00 C ATOM 1940 O4' DC C 205 1.720 7.370 38.509 1.00 0.00 O ATOM 1941 C3' DC C 205 2.664 9.051 37.095 1.00 0.00 C ATOM 1942 O3' DC C 205 4.047 9.396 37.228 1.00 0.00 O ATOM 1943 C2' DC C 205 2.527 7.737 36.329 1.00 0.00 C ATOM 1944 C1' DC C 205 2.393 6.712 37.442 1.00 0.00 C ATOM 1945 N1 DC C 205 1.593 5.523 37.075 1.00 0.00 N ATOM 1946 C2 DC C 205 2.222 4.286 37.100 1.00 0.00 C ATOM 1947 O2 DC C 205 3.405 4.204 37.417 1.00 0.00 O ATOM 1948 N3 DC C 205 1.495 3.187 36.766 1.00 0.00 N ATOM 1949 C4 DC C 205 0.205 3.292 36.420 1.00 0.00 C ATOM 1950 N4 DC C 205 -0.475 2.194 36.098 1.00 0.00 N ATOM 1951 C5 DC C 205 -0.448 4.566 36.394 1.00 0.00 C ATOM 1952 C6 DC C 205 0.279 5.648 36.728 1.00 0.00 C ATOM 0 H5' DC C 205 0.521 9.354 39.845 1.00 0.00 H new ATOM 0 H5'' DC C 205 1.117 10.652 38.829 1.00 0.00 H new ATOM 0 H4' DC C 205 2.833 9.013 39.223 1.00 0.00 H new ATOM 0 H3' DC C 205 2.162 9.877 36.591 1.00 0.00 H new ATOM 0 H2' DC C 205 1.656 7.739 35.674 1.00 0.00 H new ATOM 0 H2'' DC C 205 3.397 7.542 35.702 1.00 0.00 H new ATOM 0 H1' DC C 205 3.391 6.352 37.691 1.00 0.00 H new ATOM 0 H41 DC C 205 -1.458 2.262 35.833 1.00 0.00 H new ATOM 0 H42 DC C 205 -0.013 1.285 36.116 1.00 0.00 H new ATOM 0 H5 DC C 205 -1.488 4.655 36.116 1.00 0.00 H new ATOM 0 H6 DC C 205 -0.182 6.625 36.721 1.00 0.00 H new ATOM 1964 P DA C 206 4.899 9.873 35.946 1.00 0.00 P ATOM 1965 OP1 DA C 206 5.965 10.786 36.413 1.00 0.00 O ATOM 1966 OP2 DA C 206 3.952 10.318 34.900 1.00 0.00 O ATOM 1967 O5' DA C 206 5.590 8.504 35.450 1.00 0.00 O ATOM 1968 C5' DA C 206 6.673 7.931 36.186 1.00 0.00 C ATOM 1969 C4' DA C 206 7.171 6.641 35.541 1.00 0.00 C ATOM 1970 O4' DA C 206 6.085 5.711 35.445 1.00 0.00 O ATOM 1971 C3' DA C 206 7.744 6.823 34.129 1.00 0.00 C ATOM 1972 O3' DA C 206 8.983 6.113 34.024 1.00 0.00 O ATOM 1973 C2' DA C 206 6.697 6.188 33.220 1.00 0.00 C ATOM 1974 C1' DA C 206 6.068 5.153 34.132 1.00 0.00 C ATOM 1975 N9 DA C 206 4.668 4.826 33.804 1.00 0.00 N ATOM 1976 C8 DA C 206 3.620 5.669 33.566 1.00 0.00 C ATOM 1977 N7 DA C 206 2.487 5.081 33.321 1.00 0.00 N ATOM 1978 C5 DA C 206 2.810 3.729 33.403 1.00 0.00 C ATOM 1979 C6 DA C 206 2.054 2.561 33.244 1.00 0.00 C ATOM 1980 N6 DA C 206 0.750 2.564 32.965 1.00 0.00 N ATOM 1981 N1 DA C 206 2.693 1.389 33.393 1.00 0.00 N ATOM 1982 C2 DA C 206 3.994 1.360 33.677 1.00 0.00 C ATOM 1983 N3 DA C 206 4.800 2.402 33.848 1.00 0.00 N ATOM 1984 C4 DA C 206 4.135 3.566 33.694 1.00 0.00 C ATOM 0 H5' DA C 206 6.352 7.727 37.207 1.00 0.00 H new ATOM 0 H5'' DA C 206 7.492 8.648 36.246 1.00 0.00 H new ATOM 0 H4' DA C 206 7.977 6.284 36.181 1.00 0.00 H new ATOM 0 H3' DA C 206 7.941 7.865 33.876 1.00 0.00 H new ATOM 0 H2' DA C 206 5.968 6.917 32.867 1.00 0.00 H new ATOM 0 H2'' DA C 206 7.146 5.734 32.337 1.00 0.00 H new ATOM 0 H1' DA C 206 6.635 4.228 34.027 1.00 0.00 H new ATOM 0 H8 DA C 206 3.725 6.744 33.580 1.00 0.00 H new ATOM 0 H61 DA C 206 0.249 1.682 32.860 1.00 0.00 H new ATOM 0 H62 DA C 206 0.254 3.449 32.857 1.00 0.00 H new ATOM 0 H2 DA C 206 4.442 0.383 33.779 1.00 0.00 H new ATOM 1996 P DG C 207 9.772 6.032 32.623 1.00 0.00 P ATOM 1997 OP1 DG C 207 11.224 6.073 32.905 1.00 0.00 O ATOM 1998 OP2 DG C 207 9.172 7.018 31.696 1.00 0.00 O ATOM 1999 O5' DG C 207 9.402 4.555 32.096 1.00 0.00 O ATOM 2000 C5' DG C 207 10.003 3.403 32.694 1.00 0.00 C ATOM 2001 C4' DG C 207 9.535 2.112 32.025 1.00 0.00 C ATOM 2002 O4' DG C 207 8.119 1.976 32.188 1.00 0.00 O ATOM 2003 C3' DG C 207 9.830 2.040 30.519 1.00 0.00 C ATOM 2004 O3' DG C 207 10.546 0.834 30.233 1.00 0.00 O ATOM 2005 C2' DG C 207 8.450 1.995 29.866 1.00 0.00 C ATOM 2006 C1' DG C 207 7.581 1.449 30.982 1.00 0.00 C ATOM 2007 N9 DG C 207 6.169 1.856 30.898 1.00 0.00 N ATOM 2008 C8 DG C 207 5.641 3.113 30.891 1.00 0.00 C ATOM 2009 N7 DG C 207 4.347 3.169 30.798 1.00 0.00 N ATOM 2010 C5 DG C 207 3.975 1.825 30.736 1.00 0.00 C ATOM 2011 C6 DG C 207 2.685 1.241 30.624 1.00 0.00 C ATOM 2012 O6 DG C 207 1.595 1.804 30.559 1.00 0.00 O ATOM 2013 N1 DG C 207 2.756 -0.147 30.592 1.00 0.00 N ATOM 2014 C2 DG C 207 3.920 -0.883 30.660 1.00 0.00 C ATOM 2015 N2 DG C 207 3.786 -2.209 30.616 1.00 0.00 N ATOM 2016 N3 DG C 207 5.135 -0.337 30.765 1.00 0.00 N ATOM 2017 C4 DG C 207 5.087 1.015 30.796 1.00 0.00 C ATOM 0 H5' DG C 207 9.757 3.373 33.755 1.00 0.00 H new ATOM 0 H5'' DG C 207 11.088 3.479 32.621 1.00 0.00 H new ATOM 0 H4' DG C 207 10.093 1.312 32.512 1.00 0.00 H new ATOM 0 H3' DG C 207 10.433 2.875 30.162 1.00 0.00 H new ATOM 0 H2' DG C 207 8.122 2.982 29.541 1.00 0.00 H new ATOM 0 H2'' DG C 207 8.437 1.350 28.988 1.00 0.00 H new ATOM 0 H1' DG C 207 7.589 0.361 30.923 1.00 0.00 H new ATOM 0 H8 DG C 207 6.255 3.999 30.958 1.00 0.00 H new ATOM 0 H1 DG C 207 1.879 -0.661 30.512 1.00 0.00 H new ATOM 0 H21 DG C 207 4.611 -2.807 30.662 1.00 0.00 H new ATOM 0 H22 DG C 207 2.858 -2.625 30.536 1.00 0.00 H new ATOM 2029 P DT C 208 10.933 0.441 28.720 1.00 0.00 P ATOM 2030 OP1 DT C 208 12.147 -0.404 28.757 1.00 0.00 O ATOM 2031 OP2 DT C 208 10.917 1.674 27.903 1.00 0.00 O ATOM 2032 O5' DT C 208 9.693 -0.480 28.266 1.00 0.00 O ATOM 2033 C5' DT C 208 9.438 -1.727 28.920 1.00 0.00 C ATOM 2034 C4' DT C 208 8.297 -2.489 28.254 1.00 0.00 C ATOM 2035 O4' DT C 208 7.093 -1.729 28.342 1.00 0.00 O ATOM 2036 C3' DT C 208 8.518 -2.789 26.766 1.00 0.00 C ATOM 2037 O3' DT C 208 8.735 -4.193 26.596 1.00 0.00 O ATOM 2038 C2' DT C 208 7.206 -2.373 26.086 1.00 0.00 C ATOM 2039 C1' DT C 208 6.267 -2.132 27.259 1.00 0.00 C ATOM 2040 N1 DT C 208 5.262 -1.070 27.035 1.00 0.00 N ATOM 2041 C2 DT C 208 4.006 -1.459 26.617 1.00 0.00 C ATOM 2042 O2 DT C 208 3.716 -2.638 26.434 1.00 0.00 O ATOM 2043 N3 DT C 208 3.086 -0.446 26.428 1.00 0.00 N ATOM 2044 C4 DT C 208 3.322 0.909 26.589 1.00 0.00 C ATOM 2045 O4 DT C 208 2.432 1.730 26.377 1.00 0.00 O ATOM 2046 C5 DT C 208 4.667 1.223 27.027 1.00 0.00 C ATOM 2047 C7 DT C 208 5.067 2.681 27.244 1.00 0.00 C ATOM 2048 C6 DT C 208 5.577 0.247 27.233 1.00 0.00 C ATOM 0 H5' DT C 208 9.193 -1.546 29.967 1.00 0.00 H new ATOM 0 H5'' DT C 208 10.341 -2.337 28.905 1.00 0.00 H new ATOM 0 H4' DT C 208 8.242 -3.437 28.789 1.00 0.00 H new ATOM 0 H3' DT C 208 9.379 -2.266 26.351 1.00 0.00 H new ATOM 0 H2' DT C 208 7.333 -1.475 25.481 1.00 0.00 H new ATOM 0 H2'' DT C 208 6.831 -3.153 25.424 1.00 0.00 H new ATOM 0 H1' DT C 208 5.703 -3.048 27.433 1.00 0.00 H new ATOM 0 H3 DT C 208 2.146 -0.722 26.144 1.00 0.00 H new ATOM 0 H71 DT C 208 5.827 2.738 28.023 1.00 0.00 H new ATOM 0 H72 DT C 208 5.467 3.091 26.316 1.00 0.00 H new ATOM 0 H73 DT C 208 4.193 3.257 27.548 1.00 0.00 H new ATOM 0 H6 DT C 208 6.572 0.511 27.560 1.00 0.00 H new ATOM 2061 P DG C 209 9.086 -4.802 25.146 1.00 0.00 P ATOM 2062 OP1 DG C 209 9.902 -6.022 25.341 1.00 0.00 O ATOM 2063 OP2 DG C 209 9.592 -3.704 24.292 1.00 0.00 O ATOM 2064 O5' DG C 209 7.642 -5.246 24.593 1.00 0.00 O ATOM 2065 C5' DG C 209 6.888 -6.254 25.273 1.00 0.00 C ATOM 2066 C4' DG C 209 5.477 -6.375 24.708 1.00 0.00 C ATOM 2067 O4' DG C 209 4.850 -5.093 24.726 1.00 0.00 O ATOM 2068 C3' DG C 209 5.416 -6.883 23.260 1.00 0.00 C ATOM 2069 O3' DG C 209 4.751 -8.149 23.234 1.00 0.00 O ATOM 2070 C2' DG C 209 4.581 -5.837 22.512 1.00 0.00 C ATOM 2071 C1' DG C 209 3.943 -5.038 23.636 1.00 0.00 C ATOM 2072 N9 DG C 209 3.711 -3.618 23.314 1.00 0.00 N ATOM 2073 C8 DG C 209 4.622 -2.617 23.110 1.00 0.00 C ATOM 2074 N7 DG C 209 4.106 -1.454 22.841 1.00 0.00 N ATOM 2075 C5 DG C 209 2.735 -1.695 22.884 1.00 0.00 C ATOM 2076 C6 DG C 209 1.647 -0.804 22.683 1.00 0.00 C ATOM 2077 O6 DG C 209 1.684 0.396 22.419 1.00 0.00 O ATOM 2078 N1 DG C 209 0.427 -1.450 22.826 1.00 0.00 N ATOM 2079 C2 DG C 209 0.268 -2.789 23.114 1.00 0.00 C ATOM 2080 N2 DG C 209 -0.986 -3.224 23.221 1.00 0.00 N ATOM 2081 N3 DG C 209 1.287 -3.630 23.300 1.00 0.00 N ATOM 2082 C4 DG C 209 2.486 -3.017 23.170 1.00 0.00 C ATOM 0 H5' DG C 209 6.836 -6.016 26.335 1.00 0.00 H new ATOM 0 H5'' DG C 209 7.399 -7.213 25.186 1.00 0.00 H new ATOM 0 H4' DG C 209 4.973 -7.106 25.340 1.00 0.00 H new ATOM 0 H3' DG C 209 6.403 -7.013 22.816 1.00 0.00 H new ATOM 0 H2' DG C 209 5.201 -5.209 21.872 1.00 0.00 H new ATOM 0 H2'' DG C 209 3.831 -6.302 21.872 1.00 0.00 H new ATOM 0 H1' DG C 209 2.964 -5.471 23.842 1.00 0.00 H new ATOM 0 H8 DG C 209 5.688 -2.781 23.168 1.00 0.00 H new ATOM 0 H1 DG C 209 -0.418 -0.891 22.709 1.00 0.00 H new ATOM 0 H21 DG C 209 -1.169 -4.205 23.433 1.00 0.00 H new ATOM 0 H22 DG C 209 -1.763 -2.576 23.091 1.00 0.00 H new ATOM 2094 P DA C 210 4.487 -8.910 21.840 1.00 0.00 P ATOM 2095 OP1 DA C 210 4.560 -10.367 22.086 1.00 0.00 O ATOM 2096 OP2 DA C 210 5.346 -8.293 20.804 1.00 0.00 O ATOM 2097 O5' DA C 210 2.957 -8.530 21.518 1.00 0.00 O ATOM 2098 C5' DA C 210 1.898 -9.036 22.334 1.00 0.00 C ATOM 2099 C4' DA C 210 0.536 -8.567 21.835 1.00 0.00 C ATOM 2100 O4' DA C 210 0.487 -7.133 21.871 1.00 0.00 O ATOM 2101 C3' DA C 210 0.214 -9.002 20.399 1.00 0.00 C ATOM 2102 O3' DA C 210 -1.102 -9.562 20.354 1.00 0.00 O ATOM 2103 C2' DA C 210 0.262 -7.705 19.598 1.00 0.00 C ATOM 2104 C1' DA C 210 -0.072 -6.662 20.648 1.00 0.00 C ATOM 2105 N9 DA C 210 0.498 -5.330 20.371 1.00 0.00 N ATOM 2106 C8 DA C 210 1.770 -5.002 20.001 1.00 0.00 C ATOM 2107 N7 DA C 210 1.977 -3.736 19.806 1.00 0.00 N ATOM 2108 C5 DA C 210 0.735 -3.167 20.072 1.00 0.00 C ATOM 2109 C6 DA C 210 0.275 -1.847 20.049 1.00 0.00 C ATOM 2110 N6 DA C 210 1.053 -0.812 19.732 1.00 0.00 N ATOM 2111 N1 DA C 210 -1.014 -1.634 20.366 1.00 0.00 N ATOM 2112 C2 DA C 210 -1.804 -2.660 20.689 1.00 0.00 C ATOM 2113 N3 DA C 210 -1.469 -3.947 20.743 1.00 0.00 N ATOM 2114 C4 DA C 210 -0.172 -4.129 20.419 1.00 0.00 C ATOM 0 H5' DA C 210 2.042 -8.708 23.364 1.00 0.00 H new ATOM 0 H5'' DA C 210 1.930 -10.126 22.339 1.00 0.00 H new ATOM 0 H4' DA C 210 -0.199 -9.029 22.495 1.00 0.00 H new ATOM 0 H3' DA C 210 0.902 -9.755 20.015 1.00 0.00 H new ATOM 0 H2' DA C 210 1.244 -7.537 19.156 1.00 0.00 H new ATOM 0 H2'' DA C 210 -0.460 -7.705 18.781 1.00 0.00 H new ATOM 0 H1' DA C 210 -1.155 -6.537 20.671 1.00 0.00 H new ATOM 0 H8 DA C 210 2.547 -5.742 19.879 1.00 0.00 H new ATOM 0 H61 DA C 210 0.669 0.133 19.730 1.00 0.00 H new ATOM 0 H62 DA C 210 2.032 -0.965 19.492 1.00 0.00 H new ATOM 0 H2 DA C 210 -2.828 -2.419 20.934 1.00 0.00 H new ATOM 2126 P DT C 211 -1.758 -10.014 18.954 1.00 0.00 P ATOM 2127 OP1 DT C 211 -2.752 -11.076 19.228 1.00 0.00 O ATOM 2128 OP2 DT C 211 -0.664 -10.257 17.987 1.00 0.00 O ATOM 2129 O5' DT C 211 -2.547 -8.688 18.500 1.00 0.00 O ATOM 2130 C5' DT C 211 -3.590 -8.159 19.320 1.00 0.00 C ATOM 2131 C4' DT C 211 -4.085 -6.810 18.810 1.00 0.00 C ATOM 2132 O4' DT C 211 -3.038 -5.847 18.872 1.00 0.00 O ATOM 2133 C3' DT C 211 -4.567 -6.817 17.356 1.00 0.00 C ATOM 2134 O3' DT C 211 -5.996 -6.807 17.332 1.00 0.00 O ATOM 2135 C2' DT C 211 -4.019 -5.510 16.766 1.00 0.00 C ATOM 2136 C1' DT C 211 -3.399 -4.812 17.970 1.00 0.00 C ATOM 2137 N1 DT C 211 -2.187 -4.015 17.664 1.00 0.00 N ATOM 2138 C2 DT C 211 -2.271 -2.644 17.830 1.00 0.00 C ATOM 2139 O2 DT C 211 -3.304 -2.092 18.199 1.00 0.00 O ATOM 2140 N3 DT C 211 -1.124 -1.925 17.554 1.00 0.00 N ATOM 2141 C4 DT C 211 0.084 -2.448 17.133 1.00 0.00 C ATOM 2142 O4 DT C 211 1.045 -1.711 16.916 1.00 0.00 O ATOM 2143 C5 DT C 211 0.081 -3.886 16.986 1.00 0.00 C ATOM 2144 C7 DT C 211 1.352 -4.597 16.531 1.00 0.00 C ATOM 2145 C6 DT C 211 -1.026 -4.613 17.247 1.00 0.00 C ATOM 0 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0.00 C ATOM 2164 O4' DT C 212 -5.908 -2.801 15.323 1.00 0.00 O ATOM 2165 C3' DT C 212 -7.864 -3.062 13.989 1.00 0.00 C ATOM 2166 O3' DT C 212 -8.944 -2.124 13.943 1.00 0.00 O ATOM 2167 C2' DT C 212 -6.696 -2.556 13.135 1.00 0.00 C ATOM 2168 C1' DT C 212 -5.751 -1.983 14.175 1.00 0.00 C ATOM 2169 N1 DT C 212 -4.325 -1.995 13.780 1.00 0.00 N ATOM 2170 C2 DT C 212 -3.797 -0.810 13.314 1.00 0.00 C ATOM 2171 O2 DT C 212 -4.467 0.215 13.240 1.00 0.00 O ATOM 2172 N3 DT C 212 -2.471 -0.831 12.938 1.00 0.00 N ATOM 2173 C4 DT C 212 -1.642 -1.940 12.953 1.00 0.00 C ATOM 2174 O4 DT C 212 -0.486 -1.867 12.547 1.00 0.00 O ATOM 2175 C5 DT C 212 -2.278 -3.142 13.460 1.00 0.00 C ATOM 2176 C7 DT C 212 -1.477 -4.439 13.531 1.00 0.00 C ATOM 2177 C6 DT C 212 -3.570 -3.133 13.870 1.00 0.00 C ATOM 0 H5' DT C 212 -7.035 -4.427 17.103 1.00 0.00 H new ATOM 0 H5'' DT C 212 -8.530 -4.685 16.226 1.00 0.00 H new ATOM 0 H4' DT C 212 -7.855 -2.413 16.032 1.00 0.00 H new ATOM 0 H3' DT C 212 -8.245 -4.023 13.644 1.00 0.00 H new ATOM 0 H2' DT C 212 -6.232 -3.361 12.565 1.00 0.00 H new ATOM 0 H2'' DT C 212 -7.016 -1.800 12.417 1.00 0.00 H new ATOM 0 H1' DT C 212 -6.002 -0.934 14.331 1.00 0.00 H new ATOM 0 H3 DT C 212 -2.064 0.049 12.620 1.00 0.00 H new ATOM 0 H71 DT C 212 -1.844 -5.048 14.357 1.00 0.00 H new ATOM 0 H72 DT C 212 -1.591 -4.988 12.596 1.00 0.00 H new ATOM 0 H73 DT C 212 -0.424 -4.208 13.690 1.00 0.00 H new ATOM 0 H6 DT C 212 -4.009 -4.034 14.272 1.00 0.00 H new ATOM 2190 P DT C 213 -9.715 -1.825 12.561 1.00 0.00 P ATOM 2191 OP1 DT C 213 -11.114 -1.463 12.881 1.00 0.00 O ATOM 2192 OP2 DT C 213 -9.437 -2.938 11.626 1.00 0.00 O ATOM 2193 O5' DT C 213 -8.965 -0.509 12.015 1.00 0.00 O ATOM 2194 C5' DT C 213 -9.120 0.744 12.688 1.00 0.00 C ATOM 2195 C4' DT C 213 -8.263 1.834 12.052 1.00 0.00 C ATOM 2196 O4' DT C 213 -6.885 1.437 12.088 1.00 0.00 O ATOM 2197 C3' DT C 213 -8.604 2.134 10.580 1.00 0.00 C ATOM 2198 O3' DT C 213 -8.877 3.532 10.427 1.00 0.00 O ATOM 2199 C2' DT C 213 -7.329 1.774 9.821 1.00 0.00 C ATOM 2200 C1' DT C 213 -6.276 1.919 10.900 1.00 0.00 C ATOM 2201 N1 DT C 213 -5.037 1.149 10.654 1.00 0.00 N ATOM 2202 C2 DT C 213 -3.856 1.864 10.563 1.00 0.00 C ATOM 2203 O2 DT C 213 -3.813 3.080 10.718 1.00 0.00 O ATOM 2204 N3 DT C 213 -2.718 1.133 10.294 1.00 0.00 N ATOM 2205 C4 DT C 213 -2.655 -0.235 10.112 1.00 0.00 C ATOM 2206 O4 DT C 213 -1.591 -0.788 9.866 1.00 0.00 O ATOM 2207 C5 DT C 213 -3.929 -0.901 10.227 1.00 0.00 C ATOM 2208 C7 DT C 213 -4.001 -2.415 10.046 1.00 0.00 C ATOM 2209 C6 DT C 213 -5.059 -0.213 10.491 1.00 0.00 C ATOM 0 H5' DT C 213 -8.846 0.630 13.737 1.00 0.00 H new ATOM 0 H5'' DT C 213 -10.168 1.044 12.663 1.00 0.00 H new ATOM 0 H4' DT C 213 -8.464 2.734 12.633 1.00 0.00 H new ATOM 0 H3' DT C 213 -9.476 1.585 10.226 1.00 0.00 H new ATOM 0 H2' DT C 213 -7.365 0.762 9.418 1.00 0.00 H new ATOM 0 H2'' DT C 213 -7.149 2.445 8.981 1.00 0.00 H new ATOM 0 H1' DT C 213 -5.963 2.962 10.945 1.00 0.00 H new ATOM 0 H3 DT C 213 -1.842 1.650 10.223 1.00 0.00 H new ATOM 0 H71 DT C 213 -4.818 -2.815 10.647 1.00 0.00 H new ATOM 0 H72 DT C 213 -4.176 -2.648 8.996 1.00 0.00 H new ATOM 0 H73 DT C 213 -3.061 -2.865 10.366 1.00 0.00 H new ATOM 0 H6 DT C 213 -5.996 -0.743 10.575 1.00 0.00 H new ATOM 2222 P DA C 214 -9.466 4.110 9.040 1.00 0.00 P ATOM 2223 OP1 DA C 214 -10.093 5.422 9.317 1.00 0.00 O ATOM 2224 OP2 DA C 214 -10.255 3.039 8.392 1.00 0.00 O ATOM 2225 O5' DA C 214 -8.140 4.363 8.158 1.00 0.00 O ATOM 2226 C5' DA C 214 -7.403 5.584 8.282 1.00 0.00 C ATOM 2227 C4' DA C 214 -6.202 5.618 7.336 1.00 0.00 C ATOM 2228 O4' DA C 214 -5.302 4.552 7.669 1.00 0.00 O ATOM 2229 C3' DA C 214 -6.560 5.463 5.849 1.00 0.00 C ATOM 2230 O3' DA C 214 -5.919 6.496 5.094 1.00 0.00 O ATOM 2231 C2' DA C 214 -5.980 4.105 5.467 1.00 0.00 C ATOM 2232 C1' DA C 214 -4.844 3.958 6.459 1.00 0.00 C ATOM 2233 N9 DA C 214 -4.470 2.564 6.750 1.00 0.00 N ATOM 2234 C8 DA C 214 -5.278 1.499 7.028 1.00 0.00 C ATOM 2235 N7 DA C 214 -4.657 0.382 7.254 1.00 0.00 N ATOM 2236 C5 DA C 214 -3.316 0.732 7.114 1.00 0.00 C ATOM 2237 C6 DA C 214 -2.131 0.002 7.227 1.00 0.00 C ATOM 2238 N6 DA C 214 -2.101 -1.300 7.512 1.00 0.00 N ATOM 2239 N1 DA C 214 -0.980 0.659 7.027 1.00 0.00 N ATOM 2240 C2 DA C 214 -0.983 1.956 6.728 1.00 0.00 C ATOM 2241 N3 DA C 214 -2.046 2.746 6.598 1.00 0.00 N ATOM 2242 C4 DA C 214 -3.191 2.059 6.806 1.00 0.00 C ATOM 0 H5' DA C 214 -7.060 5.699 9.310 1.00 0.00 H new ATOM 0 H5'' DA C 214 -8.059 6.428 8.068 1.00 0.00 H new ATOM 0 H4' DA C 214 -5.757 6.604 7.469 1.00 0.00 H new ATOM 0 H3' DA C 214 -7.631 5.531 5.658 1.00 0.00 H new ATOM 0 H2' DA C 214 -6.714 3.305 5.566 1.00 0.00 H new ATOM 0 H2'' DA C 214 -5.626 4.088 4.436 1.00 0.00 H new ATOM 0 H1' DA C 214 -3.957 4.427 6.033 1.00 0.00 H new ATOM 0 H8 DA C 214 -6.355 1.580 7.058 1.00 0.00 H new ATOM 0 H61 DA C 214 -1.207 -1.786 7.583 1.00 0.00 H new ATOM 0 H62 DA C 214 -2.972 -1.810 7.659 1.00 0.00 H new ATOM 0 H2 DA C 214 -0.019 2.417 6.574 1.00 0.00 H new ATOM 2254 P DT C 215 -6.085 6.571 3.492 1.00 0.00 P ATOM 2255 OP1 DT C 215 -5.868 7.973 3.069 1.00 0.00 O ATOM 2256 OP2 DT C 215 -7.339 5.876 3.125 1.00 0.00 O ATOM 2257 O5' DT C 215 -4.846 5.688 2.961 1.00 0.00 O ATOM 2258 C5' DT C 215 -3.511 6.196 3.027 1.00 0.00 C ATOM 2259 C4' DT C 215 -2.496 5.189 2.488 1.00 0.00 C ATOM 2260 O4' DT C 215 -2.519 4.007 3.288 1.00 0.00 O ATOM 2261 C3' DT C 215 -2.750 4.742 1.041 1.00 0.00 C ATOM 2262 O3' DT C 215 -1.723 5.265 0.192 1.00 0.00 O ATOM 2263 C2' DT C 215 -2.656 3.211 1.085 1.00 0.00 C ATOM 2264 C1' DT C 215 -2.071 2.943 2.464 1.00 0.00 C ATOM 2265 N1 DT C 215 -2.512 1.669 3.075 1.00 0.00 N ATOM 2266 C2 DT C 215 -1.534 0.756 3.429 1.00 0.00 C ATOM 2267 O2 DT C 215 -0.338 0.981 3.257 1.00 0.00 O ATOM 2268 N3 DT C 215 -1.980 -0.428 3.986 1.00 0.00 N ATOM 2269 C4 DT C 215 -3.300 -0.771 4.220 1.00 0.00 C ATOM 2270 O4 DT C 215 -3.584 -1.856 4.723 1.00 0.00 O ATOM 2271 C5 DT C 215 -4.251 0.242 3.820 1.00 0.00 C ATOM 2272 C7 DT C 215 -5.744 -0.010 4.011 1.00 0.00 C ATOM 2273 C6 DT C 215 -3.841 1.405 3.275 1.00 0.00 C ATOM 0 H5' DT C 215 -3.266 6.442 4.060 1.00 0.00 H new ATOM 0 H5'' DT C 215 -3.445 7.121 2.455 1.00 0.00 H new ATOM 0 H4' DT C 215 -1.539 5.710 2.521 1.00 0.00 H new ATOM 0 H3' DT C 215 -3.709 5.089 0.657 1.00 0.00 H new ATOM 0 H2' DT C 215 -3.633 2.743 0.963 1.00 0.00 H new ATOM 0 H2'' DT C 215 -2.016 2.823 0.293 1.00 0.00 H new ATOM 0 H1' DT C 215 -0.987 2.872 2.369 1.00 0.00 H new ATOM 0 H3 DT C 215 -1.270 -1.112 4.249 1.00 0.00 H new ATOM 0 H71 DT C 215 -6.254 0.938 4.179 1.00 0.00 H new ATOM 0 H72 DT C 215 -6.150 -0.487 3.119 1.00 0.00 H new ATOM 0 H73 DT C 215 -5.896 -0.662 4.872 1.00 0.00 H new ATOM 0 H6 DT C 215 -4.576 2.144 2.990 1.00 0.00 H new ATOM 2286 P DG C 216 -1.852 5.155 -1.410 1.00 0.00 P ATOM 2287 OP1 DG C 216 -0.958 6.166 -2.016 1.00 0.00 O ATOM 2288 OP2 DG C 216 -3.290 5.140 -1.758 1.00 0.00 O ATOM 2289 O5' DG C 216 -1.245 3.696 -1.721 1.00 0.00 O ATOM 2290 C5' DG C 216 0.168 3.512 -1.848 1.00 0.00 C ATOM 2291 C4' DG C 216 0.514 2.093 -2.296 1.00 0.00 C ATOM 2292 O4' DG C 216 0.182 1.165 -1.251 1.00 0.00 O ATOM 2293 C3' DG C 216 -0.222 1.633 -3.566 1.00 0.00 C ATOM 2294 O3' DG C 216 0.684 1.073 -4.519 1.00 0.00 O ATOM 2295 C2' DG C 216 -1.198 0.584 -3.045 1.00 0.00 C ATOM 2296 C1' DG C 216 -0.451 0.039 -1.846 1.00 0.00 C ATOM 2297 N9 DG C 216 -1.303 -0.603 -0.828 1.00 0.00 N ATOM 2298 C8 DG C 216 -2.463 -0.152 -0.265 1.00 0.00 C ATOM 2299 N7 DG C 216 -2.995 -0.946 0.617 1.00 0.00 N ATOM 2300 C5 DG C 216 -2.113 -2.025 0.647 1.00 0.00 C ATOM 2301 C6 DG C 216 -2.157 -3.216 1.421 1.00 0.00 C ATOM 2302 O6 DG C 216 -2.999 -3.559 2.247 1.00 0.00 O ATOM 2303 N1 DG C 216 -1.075 -4.042 1.148 1.00 0.00 N ATOM 2304 C2 DG C 216 -0.073 -3.762 0.243 1.00 0.00 C ATOM 2305 N2 DG C 216 0.884 -4.682 0.119 1.00 0.00 N ATOM 2306 N3 DG C 216 -0.026 -2.643 -0.487 1.00 0.00 N ATOM 2307 C4 DG C 216 -1.074 -1.823 -0.235 1.00 0.00 C ATOM 0 H5' DG C 216 0.650 3.720 -0.892 1.00 0.00 H new ATOM 0 H5'' DG C 216 0.565 4.228 -2.567 1.00 0.00 H new ATOM 0 H4' DG C 216 1.581 2.112 -2.518 1.00 0.00 H new ATOM 0 H3' DG C 216 -0.717 2.451 -4.090 1.00 0.00 H new ATOM 0 H2' DG C 216 -2.157 1.020 -2.766 1.00 0.00 H new ATOM 0 H2'' DG C 216 -1.402 -0.189 -3.786 1.00 0.00 H new ATOM 0 HO3' DG C 216 0.187 0.788 -5.314 1.00 0.00 H new ATOM 0 H1' DG C 216 0.230 -0.740 -2.190 1.00 0.00 H new ATOM 0 H8 DG C 216 -2.906 0.796 -0.533 1.00 0.00 H new ATOM 0 H1 DG C 216 -1.017 -4.924 1.656 1.00 0.00 H new ATOM 0 H21 DG C 216 1.653 -4.533 -0.534 1.00 0.00 H new ATOM 0 H22 DG C 216 0.847 -5.535 0.678 1.00 0.00 H new TER 2320 DG C 216 HETATM 2321 ZN ZN A 83 -16.304 -1.206 27.800 1.00 0.00 ZN HETATM 2322 ZN ZN A 84 0.499 15.742 16.229 1.00 0.00 ZN HETATM 2323 ZN ZN A 85 15.695 -4.288 10.373 1.00 0.00 ZN