USER MOD reduce.3.24.130724 H: found=0, std=0, add=656, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 657 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 164:sc= 1.24 (180deg=1.22) USER MOD Single : A 83 LYS NZ :NH3+ -167:sc= 1.06 (180deg=0.737) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= 1.58 K(o=1.6,f=-9.2!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0.0726 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.267 USER MOD Single : A 97 LYS NZ :NH3+ 170:sc= 1.2 (180deg=1.06) USER MOD Single : A 100 ASN : amide:sc= 0.131 K(o=0.13,f=-1.2) USER MOD Single : A 101 HIS : no HE2:sc= 0.781 K(o=0.78,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.21) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -157:sc= 1.15 (180deg=0.515) USER MOD Single : A 108 LYS NZ :NH3+ -150:sc= 2.46 (180deg=0.0558) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 125 HIS : no HD1:sc= -0.0583 X(o=-0.058,f=0) USER MOD Single : B 1 DC O5' : rot 180:sc= 0 USER MOD Single : B 5 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 7 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : B 9 DT C7 :methyl 150:sc= -0.203 (180deg=-0.203) USER MOD Single : B 12 DG O3' : rot 180:sc= 0 USER MOD Single : C 13 DC O5' : rot 180:sc= 0 USER MOD Single : C 17 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 19 DT C7 :methyl 150:sc= -0.176 (180deg=-0.176) USER MOD Single : C 21 DT C7 :methyl -30:sc= -0.824 (180deg=-1.62!) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -1.090 5.426 9.273 1.00 1.00 N ATOM 2 CA ALA A 79 0.233 5.263 8.612 1.00 1.00 C ATOM 3 C ALA A 79 0.424 6.269 7.476 1.00 1.00 C ATOM 4 O ALA A 79 -0.533 6.860 6.995 1.00 1.00 O ATOM 5 CB ALA A 79 0.377 3.811 8.108 1.00 1.00 C ATOM 0 HA ALA A 79 1.017 5.465 9.342 1.00 1.00 H new ATOM 0 HB1 ALA A 79 1.346 3.689 7.623 1.00 1.00 H new ATOM 0 HB2 ALA A 79 0.304 3.124 8.951 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -0.417 3.594 7.393 1.00 1.00 H new ATOM 11 N ARG A 80 1.672 6.450 7.024 1.00 1.00 N ATOM 12 CA ARG A 80 2.109 7.215 5.823 1.00 1.00 C ATOM 13 C ARG A 80 1.507 6.669 4.502 1.00 1.00 C ATOM 14 O ARG A 80 2.214 6.152 3.642 1.00 1.00 O ATOM 15 CB ARG A 80 3.654 7.302 5.790 1.00 1.00 C ATOM 16 CG ARG A 80 4.205 8.162 6.942 1.00 1.00 C ATOM 17 CD ARG A 80 4.118 9.671 6.665 1.00 1.00 C ATOM 18 NE ARG A 80 4.303 10.467 7.896 1.00 1.00 N ATOM 19 CZ ARG A 80 3.381 10.829 8.771 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.169 10.351 8.789 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.647 11.719 9.667 1.00 1.00 N ATOM 0 H ARG A 80 2.468 6.041 7.515 1.00 1.00 H new ATOM 0 HA ARG A 80 1.713 8.227 5.906 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.076 6.299 5.852 1.00 1.00 H new ATOM 0 HB3 ARG A 80 3.974 7.724 4.837 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.653 7.934 7.854 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.245 7.892 7.123 1.00 1.00 H new ATOM 0 HD2 ARG A 80 4.877 9.951 5.934 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.149 9.904 6.224 1.00 1.00 H new ATOM 0 HE ARG A 80 5.255 10.774 8.094 1.00 1.00 H new ATOM 0 HH11 ARG A 80 1.885 9.655 8.100 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.504 10.673 9.492 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.572 12.147 9.702 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.932 11.995 10.340 1.00 1.00 H new ATOM 35 N LYS A 81 0.178 6.746 4.380 1.00 1.00 N ATOM 36 CA LYS A 81 -0.665 6.348 3.257 1.00 1.00 C ATOM 37 C LYS A 81 -0.184 6.944 1.943 1.00 1.00 C ATOM 38 O LYS A 81 0.136 8.126 1.825 1.00 1.00 O ATOM 39 CB LYS A 81 -2.098 6.841 3.530 1.00 1.00 C ATOM 40 CG LYS A 81 -2.880 6.018 4.574 1.00 1.00 C ATOM 41 CD LYS A 81 -3.692 6.819 5.604 1.00 1.00 C ATOM 42 CE LYS A 81 -4.391 8.052 5.024 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.309 8.688 6.013 1.00 1.00 N ATOM 0 H LYS A 81 -0.385 7.126 5.141 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.624 5.263 3.166 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.052 7.877 3.866 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.654 6.834 2.592 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.561 5.352 4.044 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -2.172 5.387 5.112 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -4.442 6.165 6.049 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -3.028 7.135 6.408 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -3.642 8.777 4.705 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -4.956 7.765 4.137 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -5.551 9.648 5.695 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -6.177 8.122 6.095 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -4.840 8.738 6.940 1.00 1.00 H new ATOM 57 N VAL A 82 -0.186 6.072 0.951 1.00 1.00 N ATOM 58 CA VAL A 82 0.016 6.400 -0.456 1.00 1.00 C ATOM 59 C VAL A 82 -1.239 7.041 -1.045 1.00 1.00 C ATOM 60 O VAL A 82 -2.354 6.550 -0.864 1.00 1.00 O ATOM 61 CB VAL A 82 0.320 5.119 -1.261 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.438 5.384 -2.771 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.593 4.443 -0.757 1.00 1.00 C ATOM 0 H VAL A 82 -0.334 5.075 1.106 1.00 1.00 H new ATOM 0 HA VAL A 82 0.852 7.096 -0.519 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.529 4.453 -1.106 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.652 4.449 -3.289 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.500 5.798 -3.142 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.245 6.093 -2.954 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.783 3.543 -1.342 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.434 5.128 -0.861 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.471 4.175 0.292 1.00 1.00 H new ATOM 73 N LYS A 83 -1.056 8.114 -1.810 1.00 1.00 N ATOM 74 CA LYS A 83 -2.072 8.703 -2.662 1.00 1.00 C ATOM 75 C LYS A 83 -1.637 8.445 -4.095 1.00 1.00 C ATOM 76 O LYS A 83 -0.511 8.754 -4.490 1.00 1.00 O ATOM 77 CB LYS A 83 -2.250 10.207 -2.424 1.00 1.00 C ATOM 78 CG LYS A 83 -3.416 10.482 -1.471 1.00 1.00 C ATOM 79 CD LYS A 83 -3.542 11.995 -1.245 1.00 1.00 C ATOM 80 CE LYS A 83 -4.918 12.397 -0.696 1.00 1.00 C ATOM 81 NZ LYS A 83 -5.128 11.980 0.721 1.00 1.00 N ATOM 0 H LYS A 83 -0.166 8.610 -1.852 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.039 8.253 -2.439 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.332 10.623 -2.009 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.427 10.710 -3.375 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.342 10.087 -1.888 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.252 9.973 -0.521 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.768 12.320 -0.550 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.364 12.515 -2.186 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.030 13.479 -0.770 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.695 11.952 -1.318 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -6.134 12.077 0.966 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.837 10.988 0.838 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.559 12.584 1.348 1.00 1.00 H new ATOM 95 N GLN A 84 -2.511 7.798 -4.855 1.00 1.00 N ATOM 96 CA GLN A 84 -2.357 7.697 -6.287 1.00 1.00 C ATOM 97 C GLN A 84 -2.945 9.001 -6.820 1.00 1.00 C ATOM 98 O GLN A 84 -3.948 9.501 -6.307 1.00 1.00 O ATOM 99 CB GLN A 84 -3.055 6.437 -6.838 1.00 1.00 C ATOM 100 CG GLN A 84 -3.779 6.612 -8.175 1.00 1.00 C ATOM 101 CD GLN A 84 -4.401 5.302 -8.661 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.604 5.099 -8.585 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.621 4.359 -9.146 1.00 1.00 N ATOM 0 H GLN A 84 -3.342 7.332 -4.490 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.320 7.579 -6.600 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.309 5.650 -6.950 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.776 6.090 -6.098 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.558 7.367 -8.070 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -3.077 6.980 -8.923 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.615 4.515 -9.215 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -4.022 3.473 -9.453 1.00 1.00 H new ATOM 112 N TYR A 85 -2.352 9.503 -7.885 1.00 1.00 N ATOM 113 CA TYR A 85 -2.858 10.650 -8.628 1.00 1.00 C ATOM 114 C TYR A 85 -2.945 10.247 -10.102 1.00 1.00 C ATOM 115 O TYR A 85 -2.043 9.578 -10.600 1.00 1.00 O ATOM 116 CB TYR A 85 -1.922 11.850 -8.414 1.00 1.00 C ATOM 117 CG TYR A 85 -1.703 12.274 -6.973 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.626 13.145 -6.363 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.570 11.839 -6.260 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.412 13.605 -5.050 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.346 12.292 -4.946 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.266 13.180 -4.341 1.00 1.00 C ATOM 123 OH TYR A 85 -1.078 13.627 -3.073 1.00 1.00 O ATOM 0 H TYR A 85 -1.488 9.121 -8.269 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.848 10.947 -8.282 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.953 11.613 -8.853 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.322 12.701 -8.965 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.504 13.462 -6.906 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.128 11.157 -6.722 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.119 14.278 -4.588 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.526 11.962 -4.401 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.248 13.250 -2.713 1.00 1.00 H new ATOM 133 N LYS A 86 -3.998 10.664 -10.805 1.00 1.00 N ATOM 134 CA LYS A 86 -4.203 10.392 -12.238 1.00 1.00 C ATOM 135 C LYS A 86 -4.576 11.683 -12.959 1.00 1.00 C ATOM 136 O LYS A 86 -5.457 12.402 -12.503 1.00 1.00 O ATOM 137 CB LYS A 86 -5.285 9.308 -12.397 1.00 1.00 C ATOM 138 CG LYS A 86 -5.692 9.084 -13.864 1.00 1.00 C ATOM 139 CD LYS A 86 -6.512 7.795 -14.003 1.00 1.00 C ATOM 140 CE LYS A 86 -6.817 7.519 -15.482 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.661 6.300 -15.656 1.00 1.00 N ATOM 0 H LYS A 86 -4.751 11.212 -10.390 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.283 10.020 -12.690 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.918 8.371 -11.979 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.165 9.592 -11.820 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.275 9.933 -14.219 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.801 9.025 -14.490 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.962 6.957 -13.575 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.443 7.885 -13.443 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.328 8.379 -15.914 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.882 7.395 -16.029 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.845 6.147 -16.668 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -7.163 5.474 -15.266 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.563 6.428 -15.155 1.00 1.00 H new ATOM 155 N ASN A 87 -3.913 11.975 -14.070 1.00 1.00 N ATOM 156 CA ASN A 87 -4.073 13.239 -14.784 1.00 1.00 C ATOM 157 C ASN A 87 -5.070 13.113 -15.955 1.00 1.00 C ATOM 158 O ASN A 87 -4.735 12.493 -16.967 1.00 1.00 O ATOM 159 CB ASN A 87 -2.683 13.696 -15.233 1.00 1.00 C ATOM 160 CG ASN A 87 -2.687 15.081 -15.844 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.651 15.538 -16.440 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.616 15.814 -15.685 1.00 1.00 N ATOM 0 H ASN A 87 -3.245 11.339 -14.505 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.506 13.994 -14.128 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.008 13.684 -14.377 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.289 12.985 -15.959 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.588 16.763 -16.058 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.809 15.437 -15.188 1.00 1.00 H new ATOM 169 N PRO A 88 -6.271 13.723 -15.878 1.00 1.00 N ATOM 170 CA PRO A 88 -7.285 13.655 -16.936 1.00 1.00 C ATOM 171 C PRO A 88 -6.872 14.337 -18.256 1.00 1.00 C ATOM 172 O PRO A 88 -7.490 14.076 -19.291 1.00 1.00 O ATOM 173 CB PRO A 88 -8.553 14.268 -16.326 1.00 1.00 C ATOM 174 CG PRO A 88 -8.034 15.183 -15.219 1.00 1.00 C ATOM 175 CD PRO A 88 -6.778 14.472 -14.739 1.00 1.00 C ATOM 0 HA PRO A 88 -7.440 12.620 -17.242 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -9.122 14.826 -17.069 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.215 13.499 -15.929 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -7.812 16.182 -15.594 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.763 15.298 -14.417 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.037 15.189 -14.384 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -7.003 13.807 -13.905 1.00 1.00 H new ATOM 183 N HIS A 89 -5.827 15.180 -18.256 1.00 1.00 N ATOM 184 CA HIS A 89 -5.302 15.867 -19.452 1.00 1.00 C ATOM 185 C HIS A 89 -4.228 15.077 -20.220 1.00 1.00 C ATOM 186 O HIS A 89 -3.980 15.386 -21.386 1.00 1.00 O ATOM 187 CB HIS A 89 -4.770 17.253 -19.052 1.00 1.00 C ATOM 188 CG HIS A 89 -5.788 18.093 -18.317 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.844 18.778 -18.891 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.844 18.292 -16.964 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.531 19.389 -17.904 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.937 19.111 -16.725 1.00 1.00 N ATOM 0 H HIS A 89 -5.311 15.409 -17.407 1.00 1.00 H new ATOM 0 HA HIS A 89 -6.138 15.961 -20.146 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.889 17.129 -18.423 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.449 17.784 -19.948 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.167 17.889 -16.225 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.412 20.000 -18.036 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.241 19.447 -15.811 1.00 1.00 H new ATOM 201 N THR A 90 -3.608 14.062 -19.604 1.00 1.00 N ATOM 202 CA THR A 90 -2.485 13.292 -20.197 1.00 1.00 C ATOM 203 C THR A 90 -2.662 11.770 -20.147 1.00 1.00 C ATOM 204 O THR A 90 -2.051 11.061 -20.951 1.00 1.00 O ATOM 205 CB THR A 90 -1.160 13.624 -19.497 1.00 1.00 C ATOM 206 OG1 THR A 90 -1.196 13.130 -18.178 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.885 15.118 -19.379 1.00 1.00 C ATOM 0 H THR A 90 -3.868 13.742 -18.671 1.00 1.00 H new ATOM 0 HA THR A 90 -2.475 13.596 -21.244 1.00 1.00 H new ATOM 0 HB THR A 90 -0.382 13.169 -20.110 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.351 13.338 -17.728 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.068 15.274 -18.874 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.845 15.560 -20.374 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.682 15.590 -18.804 1.00 1.00 H new ATOM 215 N GLY A 91 -3.487 11.252 -19.229 1.00 1.00 N ATOM 216 CA GLY A 91 -3.638 9.818 -18.968 1.00 1.00 C ATOM 217 C GLY A 91 -2.500 9.201 -18.136 1.00 1.00 C ATOM 218 O GLY A 91 -2.459 7.980 -17.978 1.00 1.00 O ATOM 0 H GLY A 91 -4.080 11.832 -18.635 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.582 9.653 -18.449 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.702 9.292 -19.921 1.00 1.00 H new ATOM 222 N GLU A 92 -1.570 10.005 -17.602 1.00 1.00 N ATOM 223 CA GLU A 92 -0.532 9.550 -16.692 1.00 1.00 C ATOM 224 C GLU A 92 -1.091 9.360 -15.284 1.00 1.00 C ATOM 225 O GLU A 92 -2.068 9.982 -14.862 1.00 1.00 O ATOM 226 CB GLU A 92 0.639 10.542 -16.631 1.00 1.00 C ATOM 227 CG GLU A 92 1.592 10.399 -17.816 1.00 1.00 C ATOM 228 CD GLU A 92 2.599 9.245 -17.618 1.00 1.00 C ATOM 229 OE1 GLU A 92 2.202 8.058 -17.702 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.802 9.520 -17.389 1.00 1.00 O ATOM 0 H GLU A 92 -1.525 11.005 -17.799 1.00 1.00 H new ATOM 0 HA GLU A 92 -0.169 8.597 -17.076 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.248 11.559 -16.605 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.192 10.389 -15.704 1.00 1.00 H new ATOM 0 HG2 GLU A 92 1.016 10.224 -18.725 1.00 1.00 H new ATOM 0 HG3 GLU A 92 2.136 11.333 -17.958 1.00 1.00 H new ATOM 237 N VAL A 93 -0.398 8.510 -14.547 1.00 1.00 N ATOM 238 CA VAL A 93 -0.669 8.133 -13.159 1.00 1.00 C ATOM 239 C VAL A 93 0.640 8.115 -12.366 1.00 1.00 C ATOM 240 O VAL A 93 1.726 7.882 -12.902 1.00 1.00 O ATOM 241 CB VAL A 93 -1.355 6.759 -13.108 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.863 6.364 -11.705 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.559 6.700 -14.065 1.00 1.00 C ATOM 0 H VAL A 93 0.422 8.031 -14.920 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.340 8.866 -12.710 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.576 6.057 -13.405 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.334 5.382 -11.752 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -1.024 6.331 -11.010 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.590 7.100 -11.361 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -3.023 5.715 -14.006 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.286 7.461 -13.782 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.222 6.881 -15.086 1.00 1.00 H new ATOM 253 N ILE A 94 0.507 8.332 -11.065 1.00 1.00 N ATOM 254 CA ILE A 94 1.558 8.320 -10.044 1.00 1.00 C ATOM 255 C ILE A 94 0.996 7.728 -8.751 1.00 1.00 C ATOM 256 O ILE A 94 -0.216 7.647 -8.562 1.00 1.00 O ATOM 257 CB ILE A 94 2.116 9.731 -9.710 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.532 10.899 -10.532 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.653 9.725 -9.778 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.926 12.259 -9.958 1.00 1.00 C ATOM 0 H ILE A 94 -0.406 8.537 -10.660 1.00 1.00 H new ATOM 0 HA ILE A 94 2.374 7.725 -10.453 1.00 1.00 H new ATOM 0 HB ILE A 94 1.780 9.930 -8.692 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.880 10.826 -11.562 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.445 10.817 -10.556 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.032 10.720 -9.542 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.046 9.007 -9.058 1.00 1.00 H new ATOM 0 HG23 ILE A 94 3.972 9.444 -10.782 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.493 13.051 -10.569 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.555 12.344 -8.937 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.012 12.353 -9.959 1.00 1.00 H new ATOM 272 N GLU A 95 1.903 7.425 -7.830 1.00 1.00 N ATOM 273 CA GLU A 95 1.670 6.979 -6.455 1.00 1.00 C ATOM 274 C GLU A 95 2.789 7.515 -5.552 1.00 1.00 C ATOM 275 O GLU A 95 3.967 7.236 -5.786 1.00 1.00 O ATOM 276 CB GLU A 95 1.695 5.448 -6.403 1.00 1.00 C ATOM 277 CG GLU A 95 0.357 4.831 -6.805 1.00 1.00 C ATOM 278 CD GLU A 95 0.446 3.296 -6.912 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.790 2.621 -5.910 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.170 2.750 -8.008 1.00 1.00 O ATOM 0 H GLU A 95 2.900 7.489 -8.038 1.00 1.00 H new ATOM 0 HA GLU A 95 0.702 7.349 -6.116 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.477 5.077 -7.066 1.00 1.00 H new ATOM 0 HB3 GLU A 95 1.953 5.125 -5.394 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.403 5.101 -6.072 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.038 5.245 -7.762 1.00 1.00 H new ATOM 287 N THR A 96 2.429 8.285 -4.525 1.00 1.00 N ATOM 288 CA THR A 96 3.389 8.891 -3.579 1.00 1.00 C ATOM 289 C THR A 96 2.762 8.975 -2.180 1.00 1.00 C ATOM 290 O THR A 96 1.540 9.063 -2.056 1.00 1.00 O ATOM 291 CB THR A 96 3.894 10.284 -4.048 1.00 1.00 C ATOM 292 OG1 THR A 96 3.320 11.334 -3.296 1.00 1.00 O ATOM 293 CG2 THR A 96 3.616 10.644 -5.517 1.00 1.00 C ATOM 0 H THR A 96 1.457 8.513 -4.318 1.00 1.00 H new ATOM 0 HA THR A 96 4.266 8.244 -3.542 1.00 1.00 H new ATOM 0 HB THR A 96 4.970 10.189 -3.905 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.663 12.193 -3.619 1.00 1.00 H new ATOM 0 HG21 THR A 96 4.013 11.637 -5.730 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.097 9.914 -6.168 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.541 10.637 -5.696 1.00 1.00 H new ATOM 301 N LYS A 97 3.563 8.942 -1.111 1.00 1.00 N ATOM 302 CA LYS A 97 3.079 9.132 0.275 1.00 1.00 C ATOM 303 C LYS A 97 3.153 10.608 0.719 1.00 1.00 C ATOM 304 O LYS A 97 2.966 10.913 1.901 1.00 1.00 O ATOM 305 CB LYS A 97 3.878 8.234 1.235 1.00 1.00 C ATOM 306 CG LYS A 97 3.953 6.749 0.826 1.00 1.00 C ATOM 307 CD LYS A 97 5.015 5.982 1.633 1.00 1.00 C ATOM 308 CE LYS A 97 5.405 4.641 0.994 1.00 1.00 C ATOM 309 NZ LYS A 97 6.206 4.825 -0.253 1.00 1.00 N ATOM 0 H LYS A 97 4.569 8.783 -1.174 1.00 1.00 H new ATOM 0 HA LYS A 97 2.028 8.845 0.304 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.892 8.625 1.315 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.431 8.300 2.227 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.979 6.283 0.973 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.183 6.677 -0.237 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.905 6.603 1.733 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.638 5.802 2.640 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.979 4.052 1.710 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.503 4.073 0.765 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.590 3.908 -0.557 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.598 5.212 -1.003 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.989 5.484 -0.069 1.00 1.00 H new ATOM 323 N GLY A 98 3.469 11.503 -0.219 1.00 1.00 N ATOM 324 CA GLY A 98 3.721 12.926 -0.017 1.00 1.00 C ATOM 325 C GLY A 98 5.018 13.414 -0.671 1.00 1.00 C ATOM 326 O GLY A 98 5.630 12.725 -1.491 1.00 1.00 O ATOM 0 H GLY A 98 3.561 11.234 -1.199 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.883 13.496 -0.419 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.763 13.132 1.053 1.00 1.00 H new ATOM 330 N GLY A 99 5.428 14.616 -0.270 1.00 1.00 N ATOM 331 CA GLY A 99 6.725 15.207 -0.579 1.00 1.00 C ATOM 332 C GLY A 99 6.932 15.739 -2.004 1.00 1.00 C ATOM 333 O GLY A 99 6.148 15.525 -2.932 1.00 1.00 O ATOM 0 H GLY A 99 4.843 15.226 0.300 1.00 1.00 H new ATOM 0 HA2 GLY A 99 6.896 16.029 0.116 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.493 14.458 -0.383 1.00 1.00 H new ATOM 337 N ASN A 100 8.054 16.442 -2.156 1.00 1.00 N ATOM 338 CA ASN A 100 8.658 16.899 -3.402 1.00 1.00 C ATOM 339 C ASN A 100 8.934 15.675 -4.307 1.00 1.00 C ATOM 340 O ASN A 100 9.890 14.926 -4.091 1.00 1.00 O ATOM 341 CB ASN A 100 9.913 17.705 -2.989 1.00 1.00 C ATOM 342 CG ASN A 100 11.003 17.901 -4.031 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.828 17.719 -5.231 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.170 18.298 -3.568 1.00 1.00 N ATOM 0 H ASN A 100 8.605 16.728 -1.347 1.00 1.00 H new ATOM 0 HA ASN A 100 8.018 17.549 -3.999 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.585 18.690 -2.658 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.359 17.211 -2.126 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.946 18.459 -4.211 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.298 18.445 -2.567 1.00 1.00 H new ATOM 351 N HIS A 101 8.051 15.442 -5.290 1.00 1.00 N ATOM 352 CA HIS A 101 8.142 14.358 -6.285 1.00 1.00 C ATOM 353 C HIS A 101 7.942 14.931 -7.698 1.00 1.00 C ATOM 354 O HIS A 101 6.942 15.607 -7.933 1.00 1.00 O ATOM 355 CB HIS A 101 7.127 13.264 -5.901 1.00 1.00 C ATOM 356 CG HIS A 101 7.327 11.970 -6.652 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.296 11.013 -6.394 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.587 11.533 -7.717 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.145 10.016 -7.287 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.117 10.312 -8.105 1.00 1.00 N ATOM 0 H HIS A 101 7.223 16.023 -5.420 1.00 1.00 H new ATOM 0 HA HIS A 101 9.129 13.896 -6.291 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.201 13.070 -4.831 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.119 13.632 -6.089 1.00 1.00 H new ATOM 0 HD1 HIS A 101 9.000 11.056 -5.657 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.749 12.043 -8.169 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.751 9.123 -7.339 1.00 1.00 H new ATOM 369 N LYS A 102 8.856 14.647 -8.640 1.00 1.00 N ATOM 370 CA LYS A 102 8.944 15.295 -9.972 1.00 1.00 C ATOM 371 C LYS A 102 7.607 15.472 -10.708 1.00 1.00 C ATOM 372 O LYS A 102 7.132 16.598 -10.807 1.00 1.00 O ATOM 373 CB LYS A 102 10.012 14.584 -10.825 1.00 1.00 C ATOM 374 CG LYS A 102 10.429 15.425 -12.047 1.00 1.00 C ATOM 375 CD LYS A 102 11.333 16.637 -11.746 1.00 1.00 C ATOM 376 CE LYS A 102 12.681 16.296 -11.086 1.00 1.00 C ATOM 377 NZ LYS A 102 13.576 15.507 -11.979 1.00 1.00 N ATOM 0 H LYS A 102 9.578 13.941 -8.498 1.00 1.00 H new ATOM 0 HA LYS A 102 9.255 16.325 -9.794 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.888 14.378 -10.211 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.626 13.622 -11.162 1.00 1.00 H new ATOM 0 HG2 LYS A 102 10.946 14.775 -12.753 1.00 1.00 H new ATOM 0 HG3 LYS A 102 9.527 15.782 -12.544 1.00 1.00 H new ATOM 0 HD2 LYS A 102 11.526 17.167 -12.678 1.00 1.00 H new ATOM 0 HD3 LYS A 102 10.790 17.323 -11.096 1.00 1.00 H new ATOM 0 HE2 LYS A 102 13.184 17.219 -10.799 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.500 15.733 -10.170 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.510 15.407 -11.533 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 13.165 14.565 -12.138 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 13.678 15.998 -12.890 1.00 1.00 H new ATOM 391 N THR A 103 6.961 14.392 -11.153 1.00 1.00 N ATOM 392 CA THR A 103 5.727 14.475 -11.969 1.00 1.00 C ATOM 393 C THR A 103 4.598 15.202 -11.236 1.00 1.00 C ATOM 394 O THR A 103 3.930 16.062 -11.807 1.00 1.00 O ATOM 395 CB THR A 103 5.253 13.082 -12.416 1.00 1.00 C ATOM 396 OG1 THR A 103 6.315 12.409 -13.059 1.00 1.00 O ATOM 397 CG2 THR A 103 4.084 13.202 -13.393 1.00 1.00 C ATOM 0 H THR A 103 7.268 13.438 -10.965 1.00 1.00 H new ATOM 0 HA THR A 103 5.983 15.058 -12.854 1.00 1.00 H new ATOM 0 HB THR A 103 4.930 12.526 -11.536 1.00 1.00 H new ATOM 0 HG1 THR A 103 6.015 11.520 -13.343 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.762 12.207 -13.699 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.256 13.719 -12.908 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.400 13.767 -14.270 1.00 1.00 H new ATOM 405 N LEU A 104 4.438 14.918 -9.939 1.00 1.00 N ATOM 406 CA LEU A 104 3.440 15.555 -9.074 1.00 1.00 C ATOM 407 C LEU A 104 3.636 17.080 -9.013 1.00 1.00 C ATOM 408 O LEU A 104 2.664 17.835 -9.076 1.00 1.00 O ATOM 409 CB LEU A 104 3.530 14.877 -7.687 1.00 1.00 C ATOM 410 CG LEU A 104 2.500 15.333 -6.636 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.064 15.121 -7.115 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.698 14.535 -5.347 1.00 1.00 C ATOM 0 H LEU A 104 5.009 14.227 -9.453 1.00 1.00 H new ATOM 0 HA LEU A 104 2.436 15.418 -9.476 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.425 13.801 -7.825 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.528 15.051 -7.285 1.00 1.00 H new ATOM 0 HG LEU A 104 2.657 16.398 -6.466 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.370 15.456 -6.344 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.896 15.694 -8.027 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.900 14.062 -7.316 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.969 14.858 -4.604 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.561 13.473 -5.552 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.705 14.704 -4.965 1.00 1.00 H new ATOM 424 N LYS A 105 4.890 17.548 -8.975 1.00 1.00 N ATOM 425 CA LYS A 105 5.226 18.982 -9.016 1.00 1.00 C ATOM 426 C LYS A 105 4.947 19.622 -10.378 1.00 1.00 C ATOM 427 O LYS A 105 4.529 20.776 -10.409 1.00 1.00 O ATOM 428 CB LYS A 105 6.693 19.204 -8.599 1.00 1.00 C ATOM 429 CG LYS A 105 6.958 19.038 -7.087 1.00 1.00 C ATOM 430 CD LYS A 105 6.213 20.026 -6.166 1.00 1.00 C ATOM 431 CE LYS A 105 6.379 21.496 -6.595 1.00 1.00 C ATOM 432 NZ LYS A 105 5.751 22.429 -5.616 1.00 1.00 N ATOM 0 H LYS A 105 5.707 16.941 -8.915 1.00 1.00 H new ATOM 0 HA LYS A 105 4.571 19.479 -8.301 1.00 1.00 H new ATOM 0 HB2 LYS A 105 7.323 18.502 -9.145 1.00 1.00 H new ATOM 0 HB3 LYS A 105 6.996 20.207 -8.901 1.00 1.00 H new ATOM 0 HG2 LYS A 105 6.684 18.023 -6.798 1.00 1.00 H new ATOM 0 HG3 LYS A 105 8.029 19.142 -6.911 1.00 1.00 H new ATOM 0 HD2 LYS A 105 5.152 19.774 -6.156 1.00 1.00 H new ATOM 0 HD3 LYS A 105 6.578 19.908 -5.146 1.00 1.00 H new ATOM 0 HE2 LYS A 105 7.439 21.730 -6.692 1.00 1.00 H new ATOM 0 HE3 LYS A 105 5.929 21.642 -7.577 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 5.530 23.329 -6.087 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 4.875 22.007 -5.247 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 6.409 22.602 -4.830 1.00 1.00 H new ATOM 446 N GLU A 106 5.087 18.895 -11.486 1.00 1.00 N ATOM 447 CA GLU A 106 4.760 19.442 -12.810 1.00 1.00 C ATOM 448 C GLU A 106 3.262 19.648 -12.957 1.00 1.00 C ATOM 449 O GLU A 106 2.811 20.676 -13.445 1.00 1.00 O ATOM 450 CB GLU A 106 5.201 18.534 -13.959 1.00 1.00 C ATOM 451 CG GLU A 106 6.623 18.033 -13.807 1.00 1.00 C ATOM 452 CD GLU A 106 7.152 17.439 -15.126 1.00 1.00 C ATOM 453 OE1 GLU A 106 6.956 16.226 -15.379 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.774 18.186 -15.922 1.00 1.00 O ATOM 0 H GLU A 106 5.422 17.932 -11.498 1.00 1.00 H new ATOM 0 HA GLU A 106 5.301 20.387 -12.870 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.526 17.681 -14.020 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.112 19.078 -14.899 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.268 18.853 -13.491 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.662 17.276 -13.023 1.00 1.00 H new ATOM 461 N TRP A 107 2.484 18.678 -12.489 1.00 1.00 N ATOM 462 CA TRP A 107 1.020 18.776 -12.532 1.00 1.00 C ATOM 463 C TRP A 107 0.481 19.964 -11.718 1.00 1.00 C ATOM 464 O TRP A 107 -0.440 20.656 -12.156 1.00 1.00 O ATOM 465 CB TRP A 107 0.384 17.467 -12.062 1.00 1.00 C ATOM 466 CG TRP A 107 0.624 16.229 -12.871 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.450 16.079 -13.935 1.00 1.00 C ATOM 468 CD2 TRP A 107 0.029 14.917 -12.647 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.399 14.774 -14.381 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.592 14.001 -13.582 1.00 1.00 C ATOM 471 CE3 TRP A 107 -0.926 14.406 -11.747 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.288 12.639 -13.576 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.296 13.048 -11.784 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.673 12.161 -12.677 1.00 1.00 C ATOM 0 H TRP A 107 2.837 17.815 -12.075 1.00 1.00 H new ATOM 0 HA TRP A 107 0.743 18.956 -13.571 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.733 17.274 -11.047 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.693 17.623 -12.005 1.00 1.00 H new ATOM 0 HD1 TRP A 107 2.056 16.861 -14.368 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.898 14.427 -15.200 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.380 15.063 -11.020 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.787 11.963 -14.255 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.066 12.685 -11.119 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -0.934 11.113 -12.670 1.00 1.00 H new ATOM 485 N LYS A 108 1.097 20.264 -10.566 1.00 1.00 N ATOM 486 CA LYS A 108 0.767 21.473 -9.785 1.00 1.00 C ATOM 487 C LYS A 108 1.140 22.762 -10.521 1.00 1.00 C ATOM 488 O LYS A 108 0.426 23.755 -10.403 1.00 1.00 O ATOM 489 CB LYS A 108 1.476 21.461 -8.427 1.00 1.00 C ATOM 490 CG LYS A 108 0.908 20.378 -7.507 1.00 1.00 C ATOM 491 CD LYS A 108 1.537 20.526 -6.125 1.00 1.00 C ATOM 492 CE LYS A 108 1.103 19.357 -5.240 1.00 1.00 C ATOM 493 NZ LYS A 108 1.590 19.538 -3.852 1.00 1.00 N ATOM 0 H LYS A 108 1.828 19.687 -10.151 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.313 21.455 -9.642 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.543 21.292 -8.574 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.370 22.436 -7.951 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.176 20.470 -7.440 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.119 19.389 -7.914 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.624 20.549 -6.209 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.232 21.470 -5.674 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.016 19.278 -5.241 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.491 18.423 -5.647 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.753 18.607 -3.417 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.480 20.075 -3.864 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.879 20.059 -3.300 1.00 1.00 H new ATOM 507 N ALA A 109 2.232 22.755 -11.294 1.00 1.00 N ATOM 508 CA ALA A 109 2.631 23.894 -12.108 1.00 1.00 C ATOM 509 C ALA A 109 1.644 24.125 -13.265 1.00 1.00 C ATOM 510 O ALA A 109 1.177 25.241 -13.509 1.00 1.00 O ATOM 511 CB ALA A 109 4.028 23.623 -12.681 1.00 1.00 C ATOM 0 H ALA A 109 2.861 21.955 -11.368 1.00 1.00 H new ATOM 0 HA ALA A 109 2.637 24.787 -11.483 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.340 24.469 -13.294 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.736 23.486 -11.864 1.00 1.00 H new ATOM 0 HB3 ALA A 109 4.002 22.722 -13.293 1.00 1.00 H new ATOM 517 N LYS A 110 1.339 23.031 -13.977 1.00 1.00 N ATOM 518 CA LYS A 110 0.609 23.007 -15.232 1.00 1.00 C ATOM 519 C LYS A 110 -0.900 23.250 -15.097 1.00 1.00 C ATOM 520 O LYS A 110 -1.487 23.884 -15.976 1.00 1.00 O ATOM 521 CB LYS A 110 0.888 21.676 -15.950 1.00 1.00 C ATOM 522 CG LYS A 110 2.288 21.650 -16.593 1.00 1.00 C ATOM 523 CD LYS A 110 2.619 20.298 -17.245 1.00 1.00 C ATOM 524 CE LYS A 110 1.843 20.054 -18.551 1.00 1.00 C ATOM 525 NZ LYS A 110 2.407 20.813 -19.705 1.00 1.00 N ATOM 0 H LYS A 110 1.613 22.098 -13.670 1.00 1.00 H new ATOM 0 HA LYS A 110 0.973 23.848 -15.823 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.800 20.855 -15.239 1.00 1.00 H new ATOM 0 HB3 LYS A 110 0.133 21.513 -16.719 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.352 22.436 -17.345 1.00 1.00 H new ATOM 0 HG3 LYS A 110 3.036 21.874 -15.833 1.00 1.00 H new ATOM 0 HD2 LYS A 110 3.688 20.252 -17.450 1.00 1.00 H new ATOM 0 HD3 LYS A 110 2.395 19.497 -16.541 1.00 1.00 H new ATOM 0 HE2 LYS A 110 1.854 18.989 -18.782 1.00 1.00 H new ATOM 0 HE3 LYS A 110 0.801 20.339 -18.408 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 1.848 20.613 -20.559 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.373 21.832 -19.500 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.394 20.524 -19.862 1.00 1.00 H new ATOM 539 N TRP A 111 -1.515 22.784 -14.000 1.00 1.00 N ATOM 540 CA TRP A 111 -2.973 22.878 -13.768 1.00 1.00 C ATOM 541 C TRP A 111 -3.347 23.392 -12.364 1.00 1.00 C ATOM 542 O TRP A 111 -4.154 24.319 -12.262 1.00 1.00 O ATOM 543 CB TRP A 111 -3.635 21.518 -14.051 1.00 1.00 C ATOM 544 CG TRP A 111 -3.448 20.996 -15.446 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.163 21.368 -16.534 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.456 20.048 -15.937 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.673 20.720 -17.657 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.606 19.904 -17.347 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.417 19.319 -15.328 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.775 19.068 -18.109 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.543 18.521 -16.091 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.736 18.369 -17.471 1.00 1.00 C ATOM 0 H TRP A 111 -1.014 22.326 -13.239 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.354 23.626 -14.463 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.237 20.785 -13.349 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.703 21.603 -13.852 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -4.989 22.064 -16.528 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.055 20.833 -18.596 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.288 19.373 -14.257 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -1.932 18.963 -19.172 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.284 18.021 -15.608 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.090 17.718 -18.041 1.00 1.00 H new ATOM 563 N GLY A 112 -2.748 22.848 -11.293 1.00 1.00 N ATOM 564 CA GLY A 112 -2.859 23.396 -9.927 1.00 1.00 C ATOM 565 C GLY A 112 -2.990 22.339 -8.822 1.00 1.00 C ATOM 566 O GLY A 112 -3.523 21.259 -9.068 1.00 1.00 O ATOM 0 H GLY A 112 -2.169 22.010 -11.348 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.981 24.008 -9.723 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.725 24.056 -9.884 1.00 1.00 H new ATOM 570 N PRO A 113 -2.575 22.632 -7.572 1.00 1.00 N ATOM 571 CA PRO A 113 -2.684 21.691 -6.451 1.00 1.00 C ATOM 572 C PRO A 113 -4.127 21.290 -6.117 1.00 1.00 C ATOM 573 O PRO A 113 -4.380 20.133 -5.798 1.00 1.00 O ATOM 574 CB PRO A 113 -1.980 22.352 -5.264 1.00 1.00 C ATOM 575 CG PRO A 113 -1.948 23.839 -5.620 1.00 1.00 C ATOM 576 CD PRO A 113 -1.913 23.860 -7.145 1.00 1.00 C ATOM 0 HA PRO A 113 -2.211 20.746 -6.718 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.521 22.178 -4.334 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.974 21.955 -5.127 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.825 24.359 -5.235 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.073 24.331 -5.195 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.427 24.738 -7.536 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.888 23.900 -7.513 1.00 1.00 H new ATOM 584 N GLU A 114 -5.093 22.203 -6.266 1.00 1.00 N ATOM 585 CA GLU A 114 -6.512 21.928 -6.010 1.00 1.00 C ATOM 586 C GLU A 114 -7.036 20.828 -6.935 1.00 1.00 C ATOM 587 O GLU A 114 -7.698 19.879 -6.511 1.00 1.00 O ATOM 588 CB GLU A 114 -7.350 23.184 -6.267 1.00 1.00 C ATOM 589 CG GLU A 114 -6.774 24.454 -5.638 1.00 1.00 C ATOM 590 CD GLU A 114 -7.773 25.625 -5.736 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.759 26.359 -6.755 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.576 25.827 -4.792 1.00 1.00 O ATOM 0 H GLU A 114 -4.912 23.160 -6.570 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.597 21.611 -4.970 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.442 23.333 -7.343 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.356 23.023 -5.880 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.530 24.267 -4.592 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.844 24.722 -6.139 1.00 1.00 H new ATOM 599 N ALA A 115 -6.672 20.965 -8.210 1.00 1.00 N ATOM 600 CA ALA A 115 -6.963 20.008 -9.263 1.00 1.00 C ATOM 601 C ALA A 115 -6.331 18.655 -8.921 1.00 1.00 C ATOM 602 O ALA A 115 -7.010 17.636 -8.803 1.00 1.00 O ATOM 603 CB ALA A 115 -6.407 20.554 -10.584 1.00 1.00 C ATOM 0 H ALA A 115 -6.149 21.775 -8.543 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.039 19.863 -9.359 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.617 19.847 -11.387 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.879 21.510 -10.810 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.330 20.693 -10.495 1.00 1.00 H new ATOM 609 N VAL A 116 -5.019 18.686 -8.698 1.00 1.00 N ATOM 610 CA VAL A 116 -4.174 17.525 -8.475 1.00 1.00 C ATOM 611 C VAL A 116 -4.642 16.693 -7.278 1.00 1.00 C ATOM 612 O VAL A 116 -4.795 15.479 -7.395 1.00 1.00 O ATOM 613 CB VAL A 116 -2.722 18.004 -8.340 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.742 16.974 -7.776 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.219 18.435 -9.722 1.00 1.00 C ATOM 0 H VAL A 116 -4.497 19.562 -8.667 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.244 16.849 -9.328 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.749 18.821 -7.619 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.745 17.412 -7.721 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.062 16.676 -6.778 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.719 16.100 -8.426 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.188 18.778 -9.643 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.268 17.589 -10.407 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.843 19.245 -10.100 1.00 1.00 H new ATOM 625 N GLU A 117 -4.943 17.335 -6.148 1.00 1.00 N ATOM 626 CA GLU A 117 -5.481 16.654 -4.964 1.00 1.00 C ATOM 627 C GLU A 117 -6.899 16.106 -5.207 1.00 1.00 C ATOM 628 O GLU A 117 -7.233 15.028 -4.714 1.00 1.00 O ATOM 629 CB GLU A 117 -5.519 17.619 -3.767 1.00 1.00 C ATOM 630 CG GLU A 117 -4.136 17.984 -3.223 1.00 1.00 C ATOM 631 CD GLU A 117 -4.284 18.930 -2.012 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.721 18.470 -0.927 1.00 1.00 O ATOM 633 OE2 GLU A 117 -3.994 20.147 -2.130 1.00 1.00 O ATOM 0 H GLU A 117 -4.822 18.340 -6.026 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.819 15.814 -4.751 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.034 18.532 -4.065 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.106 17.168 -2.967 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.601 17.081 -2.928 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -3.544 18.465 -4.002 1.00 1.00 H new ATOM 640 N SER A 118 -7.731 16.814 -5.981 1.00 1.00 N ATOM 641 CA SER A 118 -9.086 16.362 -6.328 1.00 1.00 C ATOM 642 C SER A 118 -9.071 15.099 -7.199 1.00 1.00 C ATOM 643 O SER A 118 -9.920 14.215 -7.042 1.00 1.00 O ATOM 644 CB SER A 118 -9.867 17.485 -7.020 1.00 1.00 C ATOM 645 OG SER A 118 -11.228 17.117 -7.194 1.00 1.00 O ATOM 0 H SER A 118 -7.484 17.717 -6.385 1.00 1.00 H new ATOM 0 HA SER A 118 -9.588 16.104 -5.396 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.805 18.397 -6.426 1.00 1.00 H new ATOM 0 HB3 SER A 118 -9.418 17.704 -7.989 1.00 1.00 H new ATOM 0 HG SER A 118 -11.710 17.847 -7.636 1.00 1.00 H new ATOM 651 N TRP A 119 -8.066 14.965 -8.074 1.00 1.00 N ATOM 652 CA TRP A 119 -7.846 13.770 -8.889 1.00 1.00 C ATOM 653 C TRP A 119 -7.359 12.544 -8.088 1.00 1.00 C ATOM 654 O TRP A 119 -7.290 11.444 -8.647 1.00 1.00 O ATOM 655 CB TRP A 119 -6.810 14.054 -9.987 1.00 1.00 C ATOM 656 CG TRP A 119 -6.974 15.251 -10.878 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.123 15.906 -11.165 1.00 1.00 C ATOM 658 CD2 TRP A 119 -5.929 15.939 -11.635 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.856 16.971 -12.004 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.518 17.040 -12.324 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.543 15.735 -11.823 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.771 17.908 -13.135 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.784 16.590 -12.648 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.393 17.681 -13.293 1.00 1.00 C ATOM 0 H TRP A 119 -7.374 15.697 -8.236 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.822 13.529 -9.309 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.838 14.141 -9.502 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.768 13.174 -10.629 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.101 15.637 -10.794 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.562 17.624 -12.344 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.056 14.909 -11.326 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.249 18.740 -13.631 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.729 16.406 -12.785 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.803 18.343 -13.909 1.00 1.00 H new ATOM 675 N ALA A 120 -6.957 12.703 -6.819 1.00 1.00 N ATOM 676 CA ALA A 120 -6.322 11.642 -6.057 1.00 1.00 C ATOM 677 C ALA A 120 -7.258 10.490 -5.653 1.00 1.00 C ATOM 678 O ALA A 120 -8.490 10.557 -5.679 1.00 1.00 O ATOM 679 CB ALA A 120 -5.605 12.204 -4.822 1.00 1.00 C ATOM 0 H ALA A 120 -7.067 13.574 -6.301 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.594 11.204 -6.740 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.138 11.388 -4.270 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.840 12.913 -5.137 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.327 12.710 -4.181 1.00 1.00 H new ATOM 685 N THR A 121 -6.575 9.455 -5.187 1.00 1.00 N ATOM 686 CA THR A 121 -7.059 8.136 -4.765 1.00 1.00 C ATOM 687 C THR A 121 -6.229 7.683 -3.574 1.00 1.00 C ATOM 688 O THR A 121 -5.011 7.803 -3.593 1.00 1.00 O ATOM 689 CB THR A 121 -6.858 7.139 -5.908 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.550 7.546 -7.072 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.389 5.764 -5.510 1.00 1.00 C ATOM 0 H THR A 121 -5.562 9.519 -5.082 1.00 1.00 H new ATOM 0 HA THR A 121 -8.115 8.189 -4.501 1.00 1.00 H new ATOM 0 HB THR A 121 -5.788 7.096 -6.112 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.402 6.891 -7.786 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.240 5.064 -6.332 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.854 5.408 -4.629 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.453 5.836 -5.284 1.00 1.00 H new ATOM 699 N LEU A 122 -6.865 7.128 -2.549 1.00 1.00 N ATOM 700 CA LEU A 122 -6.215 6.704 -1.308 1.00 1.00 C ATOM 701 C LEU A 122 -5.887 5.204 -1.369 1.00 1.00 C ATOM 702 O LEU A 122 -6.768 4.380 -1.612 1.00 1.00 O ATOM 703 CB LEU A 122 -7.161 7.054 -0.143 1.00 1.00 C ATOM 704 CG LEU A 122 -6.753 6.469 1.225 1.00 1.00 C ATOM 705 CD1 LEU A 122 -5.374 6.929 1.705 1.00 1.00 C ATOM 706 CD2 LEU A 122 -7.764 6.862 2.302 1.00 1.00 C ATOM 0 H LEU A 122 -7.870 6.955 -2.555 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.266 7.220 -1.160 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.219 8.139 -0.055 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -8.162 6.700 -0.389 1.00 1.00 H new ATOM 0 HG LEU A 122 -6.724 5.390 1.074 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -5.156 6.477 2.673 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -4.617 6.623 0.983 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -5.366 8.015 1.802 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -7.458 6.440 3.259 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -7.807 7.948 2.382 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -8.749 6.479 2.034 1.00 1.00 H new ATOM 718 N LEU A 123 -4.620 4.868 -1.119 1.00 1.00 N ATOM 719 CA LEU A 123 -4.063 3.519 -1.206 1.00 1.00 C ATOM 720 C LEU A 123 -3.366 3.130 0.108 1.00 1.00 C ATOM 721 O LEU A 123 -2.390 3.746 0.543 1.00 1.00 O ATOM 722 CB LEU A 123 -3.105 3.456 -2.409 1.00 1.00 C ATOM 723 CG LEU A 123 -3.780 3.748 -3.758 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.729 3.663 -4.857 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.887 2.749 -4.100 1.00 1.00 C ATOM 0 H LEU A 123 -3.925 5.560 -0.838 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.863 2.795 -1.359 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.297 4.172 -2.256 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.651 2.466 -2.448 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.227 4.739 -3.684 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -3.194 3.868 -5.821 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.945 4.397 -4.668 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.295 2.663 -4.869 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.326 3.008 -5.064 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.468 1.744 -4.150 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.658 2.782 -3.330 1.00 1.00 H new ATOM 737 N GLY A 124 -3.902 2.090 0.745 1.00 1.00 N ATOM 738 CA GLY A 124 -3.461 1.615 2.065 1.00 1.00 C ATOM 739 C GLY A 124 -2.232 0.689 2.048 1.00 1.00 C ATOM 740 O GLY A 124 -1.657 0.421 3.107 1.00 1.00 O ATOM 0 H GLY A 124 -4.668 1.541 0.355 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.236 2.480 2.689 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -4.288 1.087 2.539 1.00 1.00 H new ATOM 744 N HIS A 125 -1.825 0.206 0.869 1.00 1.00 N ATOM 745 CA HIS A 125 -0.641 -0.636 0.633 1.00 1.00 C ATOM 746 C HIS A 125 -0.068 -0.447 -0.788 1.00 1.00 C ATOM 747 O HIS A 125 1.128 -0.763 -0.988 1.00 1.00 O ATOM 748 CB HIS A 125 -0.989 -2.112 0.902 1.00 1.00 C ATOM 749 CG HIS A 125 -2.141 -2.655 0.090 1.00 1.00 C ATOM 750 ND1 HIS A 125 -3.427 -2.887 0.551 1.00 1.00 N ATOM 751 CD2 HIS A 125 -2.098 -3.037 -1.225 1.00 1.00 C ATOM 752 CE1 HIS A 125 -4.154 -3.396 -0.467 1.00 1.00 C ATOM 753 NE2 HIS A 125 -3.363 -3.493 -1.557 1.00 1.00 N ATOM 0 H HIS A 125 -2.337 0.400 0.008 1.00 1.00 H new ATOM 0 HA HIS A 125 0.140 -0.323 1.326 1.00 1.00 H new ATOM 0 HB2 HIS A 125 -0.106 -2.720 0.704 1.00 1.00 H new ATOM 0 HB3 HIS A 125 -1.224 -2.227 1.960 1.00 1.00 H new ATOM 0 HD2 HIS A 125 -1.240 -2.991 -1.879 1.00 1.00 H new ATOM 0 HE1 HIS A 125 -5.195 -3.679 -0.417 1.00 1.00 H new ATOM 0 HE2 HIS A 125 -3.649 -3.843 -2.471 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.932 27.599 6.587 1.00 1.00 O ATOM 764 C5' DC B 1 -4.173 28.714 7.452 1.00 1.00 C ATOM 765 C4' DC B 1 -3.380 28.671 8.772 1.00 1.00 C ATOM 766 O4' DC B 1 -3.849 27.624 9.615 1.00 1.00 O ATOM 767 C3' DC B 1 -1.876 28.492 8.538 1.00 1.00 C ATOM 768 O3' DC B 1 -1.141 29.453 9.299 1.00 1.00 O ATOM 769 C2' DC B 1 -1.638 27.045 8.953 1.00 1.00 C ATOM 770 C1' DC B 1 -2.772 26.761 9.942 1.00 1.00 C ATOM 771 N1 DC B 1 -3.251 25.358 9.916 1.00 1.00 N ATOM 772 C2 DC B 1 -3.421 24.638 11.103 1.00 1.00 C ATOM 773 O2 DC B 1 -3.119 25.109 12.202 1.00 1.00 O ATOM 774 N3 DC B 1 -3.939 23.383 11.084 1.00 1.00 N ATOM 775 C4 DC B 1 -4.234 22.850 9.913 1.00 1.00 C ATOM 776 N4 DC B 1 -4.753 21.655 9.953 1.00 1.00 N ATOM 777 C5 DC B 1 -4.074 23.532 8.674 1.00 1.00 C ATOM 778 C6 DC B 1 -3.583 24.789 8.724 1.00 1.00 C ATOM 0 H5' DC B 1 -5.238 28.758 7.682 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.923 29.632 6.921 1.00 1.00 H new ATOM 0 H4' DC B 1 -3.540 29.633 9.259 1.00 1.00 H new ATOM 0 H3' DC B 1 -1.543 28.663 7.514 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.675 26.371 8.097 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.660 26.917 9.417 1.00 1.00 H new ATOM 0 HO5' DC B 1 -4.469 27.694 5.773 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.388 26.932 10.947 1.00 1.00 H new ATOM 0 H41 DC B 1 -5.007 21.180 9.087 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.906 21.195 10.851 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.334 23.065 7.736 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.452 25.349 7.810 1.00 1.00 H new ATOM 791 P DG B 2 0.476 29.590 9.229 1.00 1.00 P ATOM 792 OP1 DG B 2 0.824 30.994 9.587 1.00 1.00 O ATOM 793 OP2 DG B 2 0.948 29.061 7.916 1.00 1.00 O ATOM 794 O5' DG B 2 1.021 28.602 10.404 1.00 1.00 O ATOM 795 C5' DG B 2 0.849 28.929 11.783 1.00 1.00 C ATOM 796 C4' DG B 2 1.446 27.896 12.761 1.00 1.00 C ATOM 797 O4' DG B 2 0.627 26.728 12.843 1.00 1.00 O ATOM 798 C3' DG B 2 2.878 27.464 12.389 1.00 1.00 C ATOM 799 O3' DG B 2 3.719 27.502 13.543 1.00 1.00 O ATOM 800 C2' DG B 2 2.628 26.063 11.830 1.00 1.00 C ATOM 801 C1' DG B 2 1.452 25.585 12.680 1.00 1.00 C ATOM 802 N9 DG B 2 0.686 24.495 12.045 1.00 1.00 N ATOM 803 C8 DG B 2 0.255 24.431 10.749 1.00 1.00 C ATOM 804 N7 DG B 2 -0.462 23.379 10.462 1.00 1.00 N ATOM 805 C5 DG B 2 -0.482 22.665 11.668 1.00 1.00 C ATOM 806 C6 DG B 2 -1.090 21.407 12.023 1.00 1.00 C ATOM 807 O6 DG B 2 -1.810 20.669 11.351 1.00 1.00 O ATOM 808 N1 DG B 2 -0.809 21.001 13.310 1.00 1.00 N ATOM 809 C2 DG B 2 -0.074 21.731 14.179 1.00 1.00 C ATOM 810 N2 DG B 2 0.102 21.212 15.365 1.00 1.00 N ATOM 811 N3 DG B 2 0.476 22.916 13.920 1.00 1.00 N ATOM 812 C4 DG B 2 0.244 23.330 12.636 1.00 1.00 C ATOM 0 H5' DG B 2 -0.216 29.033 11.989 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.307 29.899 11.974 1.00 1.00 H new ATOM 0 H4' DG B 2 1.483 28.401 13.726 1.00 1.00 H new ATOM 0 H3' DG B 2 3.403 28.099 11.676 1.00 1.00 H new ATOM 0 H2' DG B 2 2.381 26.086 10.769 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.500 25.418 11.941 1.00 1.00 H new ATOM 0 H1' DG B 2 1.810 25.174 13.624 1.00 1.00 H new ATOM 0 H8 DG B 2 0.490 25.192 10.019 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.175 20.102 13.623 1.00 1.00 H new ATOM 0 H21 DG B 2 0.647 21.714 16.066 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.306 20.305 15.590 1.00 1.00 H new ATOM 824 P DC B 3 5.302 27.123 13.506 1.00 1.00 P ATOM 825 OP1 DC B 3 6.002 27.982 14.503 1.00 1.00 O ATOM 826 OP2 DC B 3 5.784 27.145 12.097 1.00 1.00 O ATOM 827 O5' DC B 3 5.330 25.589 14.033 1.00 1.00 O ATOM 828 C5' DC B 3 4.999 25.285 15.389 1.00 1.00 C ATOM 829 C4' DC B 3 4.963 23.783 15.711 1.00 1.00 C ATOM 830 O4' DC B 3 3.887 23.173 15.014 1.00 1.00 O ATOM 831 C3' DC B 3 6.270 23.041 15.377 1.00 1.00 C ATOM 832 O3' DC B 3 6.890 22.560 16.572 1.00 1.00 O ATOM 833 C2' DC B 3 5.816 21.913 14.447 1.00 1.00 C ATOM 834 C1' DC B 3 4.290 21.901 14.549 1.00 1.00 C ATOM 835 N1 DC B 3 3.641 21.634 13.245 1.00 1.00 N ATOM 836 C2 DC B 3 2.872 20.478 13.073 1.00 1.00 C ATOM 837 O2 DC B 3 2.746 19.635 13.964 1.00 1.00 O ATOM 838 N3 DC B 3 2.227 20.239 11.909 1.00 1.00 N ATOM 839 C4 DC B 3 2.367 21.109 10.933 1.00 1.00 C ATOM 840 N4 DC B 3 1.700 20.832 9.849 1.00 1.00 N ATOM 841 C5 DC B 3 3.153 22.294 11.030 1.00 1.00 C ATOM 842 C6 DC B 3 3.781 22.522 12.213 1.00 1.00 C ATOM 0 H5' DC B 3 4.025 25.717 15.618 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.724 25.768 16.044 1.00 1.00 H new ATOM 0 H4' DC B 3 4.828 23.705 16.790 1.00 1.00 H new ATOM 0 H3' DC B 3 7.025 23.669 14.904 1.00 1.00 H new ATOM 0 H2' DC B 3 6.141 22.092 13.422 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.239 20.956 14.753 1.00 1.00 H new ATOM 0 H1' DC B 3 3.989 21.103 15.227 1.00 1.00 H new ATOM 0 H41 DC B 3 1.753 21.456 9.044 1.00 1.00 H new ATOM 0 H42 DC B 3 1.124 19.991 9.805 1.00 1.00 H new ATOM 0 H5 DC B 3 3.245 22.980 10.201 1.00 1.00 H new ATOM 0 H6 DC B 3 4.391 23.404 12.339 1.00 1.00 H new ATOM 854 P DA B 4 8.370 21.879 16.588 1.00 1.00 P ATOM 855 OP1 DA B 4 8.876 21.934 17.988 1.00 1.00 O ATOM 856 OP2 DA B 4 9.197 22.499 15.517 1.00 1.00 O ATOM 857 O5' DA B 4 8.112 20.326 16.197 1.00 1.00 O ATOM 858 C5' DA B 4 7.352 19.474 17.049 1.00 1.00 C ATOM 859 C4' DA B 4 7.042 18.095 16.436 1.00 1.00 C ATOM 860 O4' DA B 4 6.050 18.181 15.414 1.00 1.00 O ATOM 861 C3' DA B 4 8.277 17.376 15.859 1.00 1.00 C ATOM 862 O3' DA B 4 8.418 16.089 16.460 1.00 1.00 O ATOM 863 C2' DA B 4 7.944 17.346 14.367 1.00 1.00 C ATOM 864 C1' DA B 4 6.421 17.299 14.373 1.00 1.00 C ATOM 865 N9 DA B 4 5.856 17.775 13.103 1.00 1.00 N ATOM 866 C8 DA B 4 6.145 18.954 12.480 1.00 1.00 C ATOM 867 N7 DA B 4 5.463 19.178 11.386 1.00 1.00 N ATOM 868 C5 DA B 4 4.700 18.005 11.269 1.00 1.00 C ATOM 869 C6 DA B 4 3.773 17.510 10.319 1.00 1.00 C ATOM 870 N6 DA B 4 3.368 18.180 9.262 1.00 1.00 N ATOM 871 N1 DA B 4 3.243 16.289 10.427 1.00 1.00 N ATOM 872 C2 DA B 4 3.593 15.556 11.475 1.00 1.00 C ATOM 873 N3 DA B 4 4.430 15.883 12.453 1.00 1.00 N ATOM 874 C4 DA B 4 4.954 17.131 12.292 1.00 1.00 C ATOM 0 H5' DA B 4 6.414 19.969 17.298 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.896 19.332 17.983 1.00 1.00 H new ATOM 0 H4' DA B 4 6.671 17.504 17.273 1.00 1.00 H new ATOM 0 H3' DA B 4 9.239 17.852 16.048 1.00 1.00 H new ATOM 0 H2' DA B 4 8.321 18.228 13.849 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.375 16.476 13.872 1.00 1.00 H new ATOM 0 H1' DA B 4 6.054 16.282 14.510 1.00 1.00 H new ATOM 0 H8 DA B 4 6.880 19.648 12.860 1.00 1.00 H new ATOM 0 H61 DA B 4 2.697 17.760 8.619 1.00 1.00 H new ATOM 0 H62 DA B 4 3.725 19.119 9.086 1.00 1.00 H new ATOM 0 H2 DA B 4 3.144 14.576 11.541 1.00 1.00 H new ATOM 886 P DT B 5 9.678 15.111 16.153 1.00 1.00 P ATOM 887 OP1 DT B 5 9.872 14.228 17.341 1.00 1.00 O ATOM 888 OP2 DT B 5 10.834 15.924 15.682 1.00 1.00 O ATOM 889 O5' DT B 5 9.159 14.200 14.914 1.00 1.00 O ATOM 890 C5' DT B 5 8.094 13.269 15.089 1.00 1.00 C ATOM 891 C4' DT B 5 7.738 12.488 13.815 1.00 1.00 C ATOM 892 O4' DT B 5 7.064 13.328 12.878 1.00 1.00 O ATOM 893 C3' DT B 5 8.963 11.859 13.124 1.00 1.00 C ATOM 894 O3' DT B 5 8.728 10.470 12.905 1.00 1.00 O ATOM 895 C2' DT B 5 9.064 12.692 11.847 1.00 1.00 C ATOM 896 C1' DT B 5 7.608 13.092 11.594 1.00 1.00 C ATOM 897 N1 DT B 5 7.427 14.308 10.753 1.00 1.00 N ATOM 898 C2 DT B 5 6.509 14.244 9.697 1.00 1.00 C ATOM 899 O2 DT B 5 5.924 13.220 9.359 1.00 1.00 O ATOM 900 N3 DT B 5 6.268 15.402 8.999 1.00 1.00 N ATOM 901 C4 DT B 5 6.922 16.594 9.193 1.00 1.00 C ATOM 902 O4 DT B 5 6.600 17.556 8.502 1.00 1.00 O ATOM 903 C5 DT B 5 7.948 16.572 10.234 1.00 1.00 C ATOM 904 C7 DT B 5 8.822 17.790 10.478 1.00 1.00 C ATOM 905 C6 DT B 5 8.145 15.462 10.991 1.00 1.00 C ATOM 0 H5' DT B 5 7.210 13.804 15.435 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.367 12.562 15.873 1.00 1.00 H new ATOM 0 H4' DT B 5 7.085 11.678 14.139 1.00 1.00 H new ATOM 0 H3' DT B 5 9.895 11.881 13.688 1.00 1.00 H new ATOM 0 H2' DT B 5 9.706 13.562 11.980 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.476 12.116 11.019 1.00 1.00 H new ATOM 0 H1' DT B 5 7.118 12.296 11.033 1.00 1.00 H new ATOM 0 H3 DT B 5 5.546 15.375 8.279 1.00 1.00 H new ATOM 0 H71 DT B 5 9.113 17.824 11.528 1.00 1.00 H new ATOM 0 H72 DT B 5 9.715 17.728 9.855 1.00 1.00 H new ATOM 0 H73 DT B 5 8.266 18.693 10.226 1.00 1.00 H new ATOM 0 H6 DT B 5 8.872 15.483 11.789 1.00 1.00 H new ATOM 918 P DA B 6 9.812 9.485 12.203 1.00 1.00 P ATOM 919 OP1 DA B 6 9.730 8.157 12.875 1.00 1.00 O ATOM 920 OP2 DA B 6 11.139 10.162 12.132 1.00 1.00 O ATOM 921 O5' DA B 6 9.225 9.345 10.700 1.00 1.00 O ATOM 922 C5' DA B 6 7.974 8.697 10.474 1.00 1.00 C ATOM 923 C4' DA B 6 7.557 8.619 8.997 1.00 1.00 C ATOM 924 O4' DA B 6 7.180 9.909 8.514 1.00 1.00 O ATOM 925 C3' DA B 6 8.644 8.037 8.077 1.00 1.00 C ATOM 926 O3' DA B 6 8.055 7.084 7.197 1.00 1.00 O ATOM 927 C2' DA B 6 9.187 9.301 7.422 1.00 1.00 C ATOM 928 C1' DA B 6 7.977 10.233 7.387 1.00 1.00 C ATOM 929 N9 DA B 6 8.360 11.657 7.449 1.00 1.00 N ATOM 930 C8 DA B 6 9.341 12.238 8.208 1.00 1.00 C ATOM 931 N7 DA B 6 9.491 13.527 8.024 1.00 1.00 N ATOM 932 C5 DA B 6 8.534 13.798 7.036 1.00 1.00 C ATOM 933 C6 DA B 6 8.140 14.955 6.323 1.00 1.00 C ATOM 934 N6 DA B 6 8.672 16.154 6.482 1.00 1.00 N ATOM 935 N1 DA B 6 7.186 14.908 5.400 1.00 1.00 N ATOM 936 C2 DA B 6 6.600 13.741 5.168 1.00 1.00 C ATOM 937 N3 DA B 6 6.842 12.578 5.762 1.00 1.00 N ATOM 938 C4 DA B 6 7.835 12.671 6.690 1.00 1.00 C ATOM 0 H5' DA B 6 7.199 9.225 11.030 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.024 7.686 10.879 1.00 1.00 H new ATOM 0 H4' DA B 6 6.709 7.935 8.967 1.00 1.00 H new ATOM 0 H3' DA B 6 9.447 7.471 8.549 1.00 1.00 H new ATOM 0 H2' DA B 6 10.008 9.730 7.997 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.569 9.102 6.421 1.00 1.00 H new ATOM 0 H1' DA B 6 7.442 10.095 6.447 1.00 1.00 H new ATOM 0 H8 DA B 6 9.945 11.677 8.905 1.00 1.00 H new ATOM 0 H61 DA B 6 8.332 16.940 5.928 1.00 1.00 H new ATOM 0 H62 DA B 6 9.423 16.293 7.158 1.00 1.00 H new ATOM 0 H2 DA B 6 5.835 13.736 4.405 1.00 1.00 H new ATOM 950 P DT B 7 8.882 6.317 6.026 1.00 1.00 P ATOM 951 OP1 DT B 7 8.203 5.018 5.757 1.00 1.00 O ATOM 952 OP2 DT B 7 10.335 6.303 6.363 1.00 1.00 O ATOM 953 O5' DT B 7 8.646 7.294 4.758 1.00 1.00 O ATOM 954 C5' DT B 7 7.323 7.548 4.296 1.00 1.00 C ATOM 955 C4' DT B 7 7.240 8.707 3.299 1.00 1.00 C ATOM 956 O4' DT B 7 7.664 9.915 3.913 1.00 1.00 O ATOM 957 C3' DT B 7 8.067 8.494 2.015 1.00 1.00 C ATOM 958 O3' DT B 7 7.238 8.686 0.872 1.00 1.00 O ATOM 959 C2' DT B 7 9.107 9.598 2.138 1.00 1.00 C ATOM 960 C1' DT B 7 8.320 10.653 2.907 1.00 1.00 C ATOM 961 N1 DT B 7 9.199 11.702 3.478 1.00 1.00 N ATOM 962 C2 DT B 7 9.036 13.022 3.041 1.00 1.00 C ATOM 963 O2 DT B 7 8.251 13.372 2.160 1.00 1.00 O ATOM 964 N3 DT B 7 9.833 13.968 3.636 1.00 1.00 N ATOM 965 C4 DT B 7 10.821 13.727 4.555 1.00 1.00 C ATOM 966 O4 DT B 7 11.464 14.689 4.977 1.00 1.00 O ATOM 967 C5 DT B 7 10.992 12.318 4.918 1.00 1.00 C ATOM 968 C7 DT B 7 12.080 11.912 5.896 1.00 1.00 C ATOM 969 C6 DT B 7 10.186 11.365 4.377 1.00 1.00 C ATOM 0 H5' DT B 7 6.683 7.767 5.151 1.00 1.00 H new ATOM 0 H5'' DT B 7 6.930 6.646 3.827 1.00 1.00 H new ATOM 0 H4' DT B 7 6.192 8.759 3.003 1.00 1.00 H new ATOM 0 H3' DT B 7 8.500 7.500 1.904 1.00 1.00 H new ATOM 0 H2' DT B 7 9.995 9.270 2.679 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.441 9.960 1.166 1.00 1.00 H new ATOM 0 H1' DT B 7 7.627 11.200 2.267 1.00 1.00 H new ATOM 0 H3 DT B 7 9.675 14.940 3.370 1.00 1.00 H new ATOM 0 H71 DT B 7 11.764 11.025 6.444 1.00 1.00 H new ATOM 0 H72 DT B 7 12.997 11.693 5.349 1.00 1.00 H new ATOM 0 H73 DT B 7 12.261 12.726 6.598 1.00 1.00 H new ATOM 0 H6 DT B 7 10.322 10.331 4.656 1.00 1.00 H new ATOM 982 P DA B 8 7.548 8.018 -0.565 1.00 1.00 P ATOM 983 OP1 DA B 8 6.268 7.995 -1.320 1.00 1.00 O ATOM 984 OP2 DA B 8 8.233 6.718 -0.337 1.00 1.00 O ATOM 985 O5' DA B 8 8.561 9.041 -1.285 1.00 1.00 O ATOM 986 C5' DA B 8 8.058 10.150 -2.016 1.00 1.00 C ATOM 987 C4' DA B 8 9.132 11.122 -2.528 1.00 1.00 C ATOM 988 O4' DA B 8 9.533 11.997 -1.483 1.00 1.00 O ATOM 989 C3' DA B 8 10.400 10.466 -3.117 1.00 1.00 C ATOM 990 O3' DA B 8 10.499 10.719 -4.518 1.00 1.00 O ATOM 991 C2' DA B 8 11.520 11.107 -2.293 1.00 1.00 C ATOM 992 C1' DA B 8 10.874 12.357 -1.714 1.00 1.00 C ATOM 993 N9 DA B 8 11.469 12.803 -0.436 1.00 1.00 N ATOM 994 C8 DA B 8 11.697 12.092 0.721 1.00 1.00 C ATOM 995 N7 DA B 8 12.205 12.802 1.700 1.00 1.00 N ATOM 996 C5 DA B 8 12.315 14.081 1.131 1.00 1.00 C ATOM 997 C6 DA B 8 12.753 15.357 1.578 1.00 1.00 C ATOM 998 N6 DA B 8 13.149 15.670 2.801 1.00 1.00 N ATOM 999 N1 DA B 8 12.725 16.415 0.772 1.00 1.00 N ATOM 1000 C2 DA B 8 12.270 16.247 -0.455 1.00 1.00 C ATOM 1001 N3 DA B 8 11.823 15.139 -1.019 1.00 1.00 N ATOM 1002 C4 DA B 8 11.873 14.081 -0.165 1.00 1.00 C ATOM 0 H5' DA B 8 7.362 10.700 -1.382 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.488 9.778 -2.868 1.00 1.00 H new ATOM 0 H4' DA B 8 8.649 11.650 -3.350 1.00 1.00 H new ATOM 0 H3' DA B 8 10.421 9.378 -3.051 1.00 1.00 H new ATOM 0 H2' DA B 8 11.872 10.438 -1.508 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.382 11.353 -2.913 1.00 1.00 H new ATOM 0 H1' DA B 8 11.009 13.187 -2.407 1.00 1.00 H new ATOM 0 H8 DA B 8 11.476 11.039 0.814 1.00 1.00 H new ATOM 0 H61 DA B 8 13.445 16.623 3.013 1.00 1.00 H new ATOM 0 H62 DA B 8 13.159 14.958 3.532 1.00 1.00 H new ATOM 0 H2 DA B 8 12.262 17.129 -1.079 1.00 1.00 H new ATOM 1014 P DT B 9 11.740 10.159 -5.422 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.172 9.663 -6.702 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.604 9.249 -4.623 1.00 1.00 O ATOM 1017 O5' DT B 9 12.547 11.526 -5.716 1.00 1.00 O ATOM 1018 C5' DT B 9 11.934 12.569 -6.467 1.00 1.00 C ATOM 1019 C4' DT B 9 12.799 13.828 -6.613 1.00 1.00 C ATOM 1020 O4' DT B 9 12.906 14.486 -5.358 1.00 1.00 O ATOM 1021 C3' DT B 9 14.202 13.533 -7.162 1.00 1.00 C ATOM 1022 O3' DT B 9 14.484 14.379 -8.273 1.00 1.00 O ATOM 1023 C2' DT B 9 15.076 13.767 -5.934 1.00 1.00 C ATOM 1024 C1' DT B 9 14.265 14.751 -5.088 1.00 1.00 C ATOM 1025 N1 DT B 9 14.522 14.621 -3.627 1.00 1.00 N ATOM 1026 C2 DT B 9 14.833 15.784 -2.904 1.00 1.00 C ATOM 1027 O2 DT B 9 14.808 16.922 -3.378 1.00 1.00 O ATOM 1028 N3 DT B 9 15.173 15.616 -1.581 1.00 1.00 N ATOM 1029 C4 DT B 9 15.211 14.416 -0.911 1.00 1.00 C ATOM 1030 O4 DT B 9 15.490 14.417 0.287 1.00 1.00 O ATOM 1031 C5 DT B 9 14.871 13.243 -1.715 1.00 1.00 C ATOM 1032 C7 DT B 9 14.914 11.860 -1.094 1.00 1.00 C ATOM 1033 C6 DT B 9 14.519 13.381 -3.019 1.00 1.00 C ATOM 0 H5' DT B 9 10.993 12.841 -5.989 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.690 12.192 -7.460 1.00 1.00 H new ATOM 0 H4' DT B 9 12.301 14.471 -7.339 1.00 1.00 H new ATOM 0 H3' DT B 9 14.354 12.533 -7.569 1.00 1.00 H new ATOM 0 H2' DT B 9 15.265 12.838 -5.395 1.00 1.00 H new ATOM 0 H2'' DT B 9 16.047 14.181 -6.207 1.00 1.00 H new ATOM 0 H1' DT B 9 14.554 15.769 -5.351 1.00 1.00 H new ATOM 0 H3 DT B 9 15.418 16.453 -1.052 1.00 1.00 H new ATOM 0 H71 DT B 9 14.179 11.219 -1.581 1.00 1.00 H new ATOM 0 H72 DT B 9 15.909 11.434 -1.223 1.00 1.00 H new ATOM 0 H73 DT B 9 14.685 11.931 -0.031 1.00 1.00 H new ATOM 0 H6 DT B 9 14.233 12.509 -3.589 1.00 1.00 H new ATOM 1046 P DG B 10 15.933 14.427 -9.002 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.714 14.773 -10.431 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.710 13.200 -8.680 1.00 1.00 O ATOM 1049 O5' DG B 10 16.623 15.697 -8.274 1.00 1.00 O ATOM 1050 C5' DG B 10 16.051 16.997 -8.392 1.00 1.00 C ATOM 1051 C4' DG B 10 16.876 18.111 -7.726 1.00 1.00 C ATOM 1052 O4' DG B 10 16.810 18.005 -6.304 1.00 1.00 O ATOM 1053 C3' DG B 10 18.356 18.093 -8.155 1.00 1.00 C ATOM 1054 O3' DG B 10 18.805 19.423 -8.410 1.00 1.00 O ATOM 1055 C2' DG B 10 18.994 17.420 -6.941 1.00 1.00 C ATOM 1056 C1' DG B 10 18.131 17.930 -5.791 1.00 1.00 C ATOM 1057 N9 DG B 10 18.178 17.038 -4.616 1.00 1.00 N ATOM 1058 C8 DG B 10 18.046 15.680 -4.603 1.00 1.00 C ATOM 1059 N7 DG B 10 18.093 15.136 -3.416 1.00 1.00 N ATOM 1060 C5 DG B 10 18.330 16.231 -2.575 1.00 1.00 C ATOM 1061 C6 DG B 10 18.532 16.311 -1.148 1.00 1.00 C ATOM 1062 O6 DG B 10 18.454 15.420 -0.300 1.00 1.00 O ATOM 1063 N1 DG B 10 18.858 17.572 -0.709 1.00 1.00 N ATOM 1064 C2 DG B 10 18.941 18.648 -1.522 1.00 1.00 C ATOM 1065 N2 DG B 10 19.292 19.772 -0.959 1.00 1.00 N ATOM 1066 N3 DG B 10 18.712 18.645 -2.835 1.00 1.00 N ATOM 1067 C4 DG B 10 18.420 17.396 -3.309 1.00 1.00 C ATOM 0 H5' DG B 10 15.054 16.985 -7.951 1.00 1.00 H new ATOM 0 H5'' DG B 10 15.928 17.233 -9.449 1.00 1.00 H new ATOM 0 H4' DG B 10 16.437 19.052 -8.057 1.00 1.00 H new ATOM 0 H3' DG B 10 18.592 17.571 -9.082 1.00 1.00 H new ATOM 0 H2' DG B 10 18.967 16.333 -7.018 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.039 17.705 -6.822 1.00 1.00 H new ATOM 0 H1' DG B 10 18.495 18.897 -5.443 1.00 1.00 H new ATOM 0 H8 DG B 10 17.913 15.100 -5.504 1.00 1.00 H new ATOM 0 H1 DG B 10 19.048 17.703 0.285 1.00 1.00 H new ATOM 0 H21 DG B 10 19.372 20.620 -1.520 1.00 1.00 H new ATOM 0 H22 DG B 10 19.486 19.802 0.042 1.00 1.00 H new ATOM 1079 P DC B 11 20.298 19.765 -8.955 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.173 20.852 -9.968 1.00 1.00 O ATOM 1081 OP2 DC B 11 20.988 18.506 -9.355 1.00 1.00 O ATOM 1082 O5' DC B 11 21.047 20.363 -7.644 1.00 1.00 O ATOM 1083 C5' DC B 11 20.618 21.591 -7.054 1.00 1.00 C ATOM 1084 C4' DC B 11 21.461 22.057 -5.853 1.00 1.00 C ATOM 1085 O4' DC B 11 21.257 21.193 -4.737 1.00 1.00 O ATOM 1086 C3' DC B 11 22.970 22.127 -6.161 1.00 1.00 C ATOM 1087 O3' DC B 11 23.530 23.334 -5.637 1.00 1.00 O ATOM 1088 C2' DC B 11 23.482 20.851 -5.491 1.00 1.00 C ATOM 1089 C1' DC B 11 22.504 20.654 -4.328 1.00 1.00 C ATOM 1090 N1 DC B 11 22.309 19.245 -3.900 1.00 1.00 N ATOM 1091 C2 DC B 11 22.375 18.910 -2.539 1.00 1.00 C ATOM 1092 O2 DC B 11 22.684 19.728 -1.671 1.00 1.00 O ATOM 1093 N3 DC B 11 22.102 17.650 -2.121 1.00 1.00 N ATOM 1094 C4 DC B 11 21.779 16.754 -3.028 1.00 1.00 C ATOM 1095 N4 DC B 11 21.462 15.578 -2.563 1.00 1.00 N ATOM 1096 C5 DC B 11 21.734 17.015 -4.425 1.00 1.00 C ATOM 1097 C6 DC B 11 22.006 18.285 -4.822 1.00 1.00 C ATOM 0 H5' DC B 11 19.582 21.482 -6.733 1.00 1.00 H new ATOM 0 H5'' DC B 11 20.635 22.370 -7.816 1.00 1.00 H new ATOM 0 H4' DC B 11 21.124 23.067 -5.622 1.00 1.00 H new ATOM 0 H3' DC B 11 23.236 22.165 -7.217 1.00 1.00 H new ATOM 0 H2' DC B 11 23.470 20.003 -6.176 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.508 20.963 -5.141 1.00 1.00 H new ATOM 0 H1' DC B 11 22.929 21.157 -3.460 1.00 1.00 H new ATOM 0 H41 DC B 11 21.200 14.830 -3.205 1.00 1.00 H new ATOM 0 H42 DC B 11 21.476 15.406 -1.558 1.00 1.00 H new ATOM 0 H5 DC B 11 21.495 16.239 -5.137 1.00 1.00 H new ATOM 0 H6 DC B 11 21.982 18.537 -5.872 1.00 1.00 H new ATOM 1109 P DG B 12 25.039 23.831 -5.991 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.121 25.286 -5.684 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.390 23.381 -7.367 1.00 1.00 O ATOM 1112 O5' DG B 12 25.979 23.030 -4.943 1.00 1.00 O ATOM 1113 C5' DG B 12 25.956 23.339 -3.550 1.00 1.00 C ATOM 1114 C4' DG B 12 26.587 22.245 -2.674 1.00 1.00 C ATOM 1115 O4' DG B 12 25.762 21.092 -2.626 1.00 1.00 O ATOM 1116 C3' DG B 12 27.980 21.763 -3.119 1.00 1.00 C ATOM 1117 O3' DG B 12 29.044 22.453 -2.463 1.00 1.00 O ATOM 1118 C2' DG B 12 27.983 20.286 -2.723 1.00 1.00 C ATOM 1119 C1' DG B 12 26.574 20.023 -2.182 1.00 1.00 C ATOM 1120 N9 DG B 12 26.022 18.737 -2.647 1.00 1.00 N ATOM 1121 C8 DG B 12 25.782 18.350 -3.937 1.00 1.00 C ATOM 1122 N7 DG B 12 25.323 17.132 -4.058 1.00 1.00 N ATOM 1123 C5 DG B 12 25.268 16.672 -2.733 1.00 1.00 C ATOM 1124 C6 DG B 12 24.865 15.406 -2.166 1.00 1.00 C ATOM 1125 O6 DG B 12 24.445 14.387 -2.718 1.00 1.00 O ATOM 1126 N1 DG B 12 24.986 15.357 -0.795 1.00 1.00 N ATOM 1127 C2 DG B 12 25.454 16.375 -0.037 1.00 1.00 C ATOM 1128 N2 DG B 12 25.562 16.157 1.245 1.00 1.00 N ATOM 1129 N3 DG B 12 25.833 17.559 -0.505 1.00 1.00 N ATOM 1130 C4 DG B 12 25.708 17.651 -1.864 1.00 1.00 C ATOM 0 H5' DG B 12 24.924 23.495 -3.237 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.485 24.278 -3.384 1.00 1.00 H new ATOM 0 H4' DG B 12 26.690 22.732 -1.704 1.00 1.00 H new ATOM 0 H3' DG B 12 28.146 21.942 -4.181 1.00 1.00 H new ATOM 0 H2' DG B 12 28.204 19.648 -3.578 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.742 20.080 -1.968 1.00 1.00 H new ATOM 0 HO3' DG B 12 29.904 22.107 -2.781 1.00 1.00 H new ATOM 0 H1' DG B 12 26.606 19.961 -1.094 1.00 1.00 H new ATOM 0 H8 DG B 12 25.957 18.996 -4.784 1.00 1.00 H new ATOM 0 H1 DG B 12 24.705 14.499 -0.321 1.00 1.00 H new ATOM 0 H21 DG B 12 25.910 16.893 1.860 1.00 1.00 H new ATOM 0 H22 DG B 12 25.298 15.251 1.632 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 23.396 7.959 5.082 1.00 1.00 O ATOM 1145 C5' DC C 13 24.683 8.407 5.511 1.00 1.00 C ATOM 1146 C4' DC C 13 24.884 9.926 5.400 1.00 1.00 C ATOM 1147 O4' DC C 13 24.804 10.360 4.044 1.00 1.00 O ATOM 1148 C3' DC C 13 23.849 10.713 6.218 1.00 1.00 C ATOM 1149 O3' DC C 13 24.506 11.611 7.112 1.00 1.00 O ATOM 1150 C2' DC C 13 23.045 11.431 5.131 1.00 1.00 C ATOM 1151 C1' DC C 13 24.098 11.588 4.034 1.00 1.00 C ATOM 1152 N1 DC C 13 23.610 11.898 2.663 1.00 1.00 N ATOM 1153 C2 DC C 13 24.260 12.876 1.901 1.00 1.00 C ATOM 1154 O2 DC C 13 25.146 13.597 2.364 1.00 1.00 O ATOM 1155 N3 DC C 13 23.942 13.066 0.596 1.00 1.00 N ATOM 1156 C4 DC C 13 22.965 12.350 0.079 1.00 1.00 C ATOM 1157 N4 DC C 13 22.738 12.539 -1.191 1.00 1.00 N ATOM 1158 C5 DC C 13 22.239 11.372 0.813 1.00 1.00 C ATOM 1159 C6 DC C 13 22.597 11.173 2.105 1.00 1.00 C ATOM 0 H5' DC C 13 25.448 7.905 4.918 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.835 8.105 6.547 1.00 1.00 H new ATOM 0 H4' DC C 13 25.878 10.125 5.800 1.00 1.00 H new ATOM 0 H3' DC C 13 23.214 10.102 6.860 1.00 1.00 H new ATOM 0 H2' DC C 13 22.189 10.844 4.798 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.660 12.392 5.472 1.00 1.00 H new ATOM 0 HO5' DC C 13 23.340 6.985 5.179 1.00 1.00 H new ATOM 0 H1' DC C 13 24.698 12.469 4.262 1.00 1.00 H new ATOM 0 H41 DC C 13 21.996 12.019 -1.659 1.00 1.00 H new ATOM 0 H42 DC C 13 23.302 13.207 -1.716 1.00 1.00 H new ATOM 0 H5 DC C 13 21.435 10.811 0.360 1.00 1.00 H new ATOM 0 H6 DC C 13 22.077 10.435 2.698 1.00 1.00 H new ATOM 1172 P DG C 14 23.713 12.449 8.258 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.501 12.339 9.518 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.286 12.025 8.281 1.00 1.00 O ATOM 1175 O5' DG C 14 23.769 13.989 7.735 1.00 1.00 O ATOM 1176 C5' DG C 14 24.969 14.759 7.812 1.00 1.00 C ATOM 1177 C4' DG C 14 24.806 16.254 7.468 1.00 1.00 C ATOM 1178 O4' DG C 14 24.692 16.449 6.059 1.00 1.00 O ATOM 1179 C3' DG C 14 23.590 16.910 8.148 1.00 1.00 C ATOM 1180 O3' DG C 14 23.935 18.223 8.597 1.00 1.00 O ATOM 1181 C2' DG C 14 22.569 16.872 7.010 1.00 1.00 C ATOM 1182 C1' DG C 14 23.430 17.032 5.761 1.00 1.00 C ATOM 1183 N9 DG C 14 22.859 16.364 4.574 1.00 1.00 N ATOM 1184 C8 DG C 14 22.291 15.123 4.515 1.00 1.00 C ATOM 1185 N7 DG C 14 21.913 14.752 3.321 1.00 1.00 N ATOM 1186 C5 DG C 14 22.230 15.865 2.527 1.00 1.00 C ATOM 1187 C6 DG C 14 22.042 16.122 1.120 1.00 1.00 C ATOM 1188 O6 DG C 14 21.586 15.386 0.247 1.00 1.00 O ATOM 1189 N1 DG C 14 22.429 17.383 0.733 1.00 1.00 N ATOM 1190 C2 DG C 14 22.979 18.290 1.570 1.00 1.00 C ATOM 1191 N2 DG C 14 23.308 19.442 1.049 1.00 1.00 N ATOM 1192 N3 DG C 14 23.208 18.096 2.866 1.00 1.00 N ATOM 1193 C4 DG C 14 22.798 16.862 3.294 1.00 1.00 C ATOM 0 H5' DG C 14 25.706 14.324 7.137 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.373 14.675 8.821 1.00 1.00 H new ATOM 0 H4' DG C 14 25.708 16.734 7.849 1.00 1.00 H new ATOM 0 H3' DG C 14 23.214 16.426 9.050 1.00 1.00 H new ATOM 0 H2' DG C 14 22.014 15.934 6.999 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.837 17.674 7.099 1.00 1.00 H new ATOM 0 H1' DG C 14 23.499 18.092 5.515 1.00 1.00 H new ATOM 0 H8 DG C 14 22.164 14.498 5.387 1.00 1.00 H new ATOM 0 H1 DG C 14 22.293 17.649 -0.242 1.00 1.00 H new ATOM 0 H21 DG C 14 23.727 20.165 1.634 1.00 1.00 H new ATOM 0 H22 DG C 14 23.146 19.618 0.058 1.00 1.00 H new ATOM 1205 P DC C 15 22.895 19.191 9.390 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.695 20.212 10.128 1.00 1.00 O ATOM 1207 OP2 DC C 15 21.940 18.350 10.166 1.00 1.00 O ATOM 1208 O5' DC C 15 22.074 19.935 8.208 1.00 1.00 O ATOM 1209 C5' DC C 15 22.735 20.827 7.311 1.00 1.00 C ATOM 1210 C4' DC C 15 21.937 21.126 6.031 1.00 1.00 C ATOM 1211 O4' DC C 15 21.764 19.958 5.245 1.00 1.00 O ATOM 1212 C3' DC C 15 20.543 21.734 6.265 1.00 1.00 C ATOM 1213 O3' DC C 15 20.617 23.159 6.159 1.00 1.00 O ATOM 1214 C2' DC C 15 19.692 21.065 5.178 1.00 1.00 C ATOM 1215 C1' DC C 15 20.669 20.199 4.387 1.00 1.00 C ATOM 1216 N1 DC C 15 20.054 18.926 3.948 1.00 1.00 N ATOM 1217 C2 DC C 15 19.747 18.727 2.596 1.00 1.00 C ATOM 1218 O2 DC C 15 19.919 19.602 1.745 1.00 1.00 O ATOM 1219 N3 DC C 15 19.250 17.544 2.167 1.00 1.00 N ATOM 1220 C4 DC C 15 19.041 16.598 3.058 1.00 1.00 C ATOM 1221 N4 DC C 15 18.586 15.476 2.577 1.00 1.00 N ATOM 1222 C5 DC C 15 19.287 16.753 4.454 1.00 1.00 C ATOM 1223 C6 DC C 15 19.793 17.946 4.862 1.00 1.00 C ATOM 0 H5' DC C 15 23.700 20.401 7.035 1.00 1.00 H new ATOM 0 H5'' DC C 15 22.937 21.764 7.829 1.00 1.00 H new ATOM 0 H4' DC C 15 22.545 21.870 5.517 1.00 1.00 H new ATOM 0 H3' DC C 15 20.117 21.560 7.253 1.00 1.00 H new ATOM 0 H2' DC C 15 18.896 20.463 5.615 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.215 21.807 4.538 1.00 1.00 H new ATOM 0 H1' DC C 15 20.977 20.709 3.474 1.00 1.00 H new ATOM 0 H41 DC C 15 18.398 14.692 3.202 1.00 1.00 H new ATOM 0 H42 DC C 15 18.418 15.381 1.575 1.00 1.00 H new ATOM 0 H5 DC C 15 19.080 15.958 5.155 1.00 1.00 H new ATOM 0 H6 DC C 15 19.989 18.119 5.910 1.00 1.00 H new ATOM 1235 P DA C 16 19.327 24.137 6.325 1.00 1.00 P ATOM 1236 OP1 DA C 16 19.834 25.512 6.595 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.382 23.531 7.306 1.00 1.00 O ATOM 1238 O5' DA C 16 18.621 24.132 4.862 1.00 1.00 O ATOM 1239 C5' DA C 16 19.343 24.532 3.698 1.00 1.00 C ATOM 1240 C4' DA C 16 18.549 24.389 2.383 1.00 1.00 C ATOM 1241 O4' DA C 16 18.419 23.025 1.978 1.00 1.00 O ATOM 1242 C3' DA C 16 17.141 25.011 2.466 1.00 1.00 C ATOM 1243 O3' DA C 16 16.902 25.851 1.336 1.00 1.00 O ATOM 1244 C2' DA C 16 16.278 23.752 2.526 1.00 1.00 C ATOM 1245 C1' DA C 16 17.060 22.780 1.650 1.00 1.00 C ATOM 1246 N9 DA C 16 16.729 21.380 1.960 1.00 1.00 N ATOM 1247 C8 DA C 16 16.771 20.800 3.194 1.00 1.00 C ATOM 1248 N7 DA C 16 16.571 19.509 3.199 1.00 1.00 N ATOM 1249 C5 DA C 16 16.306 19.244 1.844 1.00 1.00 C ATOM 1250 C6 DA C 16 15.968 18.084 1.104 1.00 1.00 C ATOM 1251 N6 DA C 16 15.899 16.874 1.618 1.00 1.00 N ATOM 1252 N1 DA C 16 15.661 18.144 -0.194 1.00 1.00 N ATOM 1253 C2 DA C 16 15.706 19.332 -0.780 1.00 1.00 C ATOM 1254 N3 DA C 16 16.059 20.497 -0.241 1.00 1.00 N ATOM 1255 C4 DA C 16 16.350 20.386 1.089 1.00 1.00 C ATOM 0 H5' DA C 16 20.254 23.937 3.626 1.00 1.00 H new ATOM 0 H5'' DA C 16 19.650 25.572 3.813 1.00 1.00 H new ATOM 0 H4' DA C 16 19.132 24.935 1.641 1.00 1.00 H new ATOM 0 H3' DA C 16 16.952 25.678 3.307 1.00 1.00 H new ATOM 0 H2' DA C 16 16.168 23.382 3.546 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.274 23.929 2.141 1.00 1.00 H new ATOM 0 H1' DA C 16 16.832 22.927 0.594 1.00 1.00 H new ATOM 0 H8 DA C 16 16.955 21.364 4.096 1.00 1.00 H new ATOM 0 H61 DA C 16 15.649 16.082 1.026 1.00 1.00 H new ATOM 0 H62 DA C 16 16.095 16.729 2.608 1.00 1.00 H new ATOM 0 H2 DA C 16 15.422 19.358 -1.822 1.00 1.00 H new ATOM 1267 P DT C 17 15.563 26.759 1.186 1.00 1.00 P ATOM 1268 OP1 DT C 17 15.883 27.889 0.265 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.033 27.083 2.542 1.00 1.00 O ATOM 1270 O5' DT C 17 14.506 25.774 0.447 1.00 1.00 O ATOM 1271 C5' DT C 17 14.719 25.359 -0.901 1.00 1.00 C ATOM 1272 C4' DT C 17 13.707 24.315 -1.392 1.00 1.00 C ATOM 1273 O4' DT C 17 13.920 23.061 -0.749 1.00 1.00 O ATOM 1274 C3' DT C 17 12.236 24.727 -1.192 1.00 1.00 C ATOM 1275 O3' DT C 17 11.561 24.716 -2.449 1.00 1.00 O ATOM 1276 C2' DT C 17 11.743 23.675 -0.192 1.00 1.00 C ATOM 1277 C1' DT C 17 12.654 22.485 -0.500 1.00 1.00 C ATOM 1278 N1 DT C 17 12.757 21.477 0.591 1.00 1.00 N ATOM 1279 C2 DT C 17 12.636 20.121 0.253 1.00 1.00 C ATOM 1280 O2 DT C 17 12.406 19.691 -0.881 1.00 1.00 O ATOM 1281 N3 DT C 17 12.802 19.222 1.278 1.00 1.00 N ATOM 1282 C4 DT C 17 13.067 19.517 2.588 1.00 1.00 C ATOM 1283 O4 DT C 17 13.225 18.582 3.372 1.00 1.00 O ATOM 1284 C5 DT C 17 13.144 20.946 2.885 1.00 1.00 C ATOM 1285 C7 DT C 17 13.384 21.424 4.302 1.00 1.00 C ATOM 1286 C6 DT C 17 13.005 21.865 1.895 1.00 1.00 C ATOM 0 H5' DT C 17 15.724 24.948 -0.991 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.672 26.232 -1.552 1.00 1.00 H new ATOM 0 H4' DT C 17 13.881 24.234 -2.465 1.00 1.00 H new ATOM 0 H3' DT C 17 12.068 25.736 -0.816 1.00 1.00 H new ATOM 0 H2' DT C 17 11.848 24.012 0.839 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.691 23.432 -0.342 1.00 1.00 H new ATOM 0 H1' DT C 17 12.245 21.922 -1.339 1.00 1.00 H new ATOM 0 H3 DT C 17 12.719 18.234 1.039 1.00 1.00 H new ATOM 0 H71 DT C 17 13.920 22.373 4.280 1.00 1.00 H new ATOM 0 H72 DT C 17 12.428 21.559 4.807 1.00 1.00 H new ATOM 0 H73 DT C 17 13.977 20.684 4.840 1.00 1.00 H new ATOM 0 H6 DT C 17 13.089 22.916 2.130 1.00 1.00 H new ATOM 1299 P DA C 18 10.031 25.227 -2.621 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.813 25.534 -4.065 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.754 26.297 -1.621 1.00 1.00 O ATOM 1302 O5' DA C 18 9.161 23.918 -2.235 1.00 1.00 O ATOM 1303 C5' DA C 18 9.261 22.729 -3.008 1.00 1.00 C ATOM 1304 C4' DA C 18 8.401 21.571 -2.483 1.00 1.00 C ATOM 1305 O4' DA C 18 9.058 20.857 -1.448 1.00 1.00 O ATOM 1306 C3' DA C 18 7.007 21.962 -1.974 1.00 1.00 C ATOM 1307 O3' DA C 18 6.089 21.344 -2.870 1.00 1.00 O ATOM 1308 C2' DA C 18 7.022 21.448 -0.531 1.00 1.00 C ATOM 1309 C1' DA C 18 8.071 20.346 -0.571 1.00 1.00 C ATOM 1310 N9 DA C 18 8.730 20.004 0.710 1.00 1.00 N ATOM 1311 C8 DA C 18 9.092 20.830 1.740 1.00 1.00 C ATOM 1312 N7 DA C 18 9.643 20.216 2.761 1.00 1.00 N ATOM 1313 C5 DA C 18 9.628 18.870 2.362 1.00 1.00 C ATOM 1314 C6 DA C 18 9.994 17.630 2.952 1.00 1.00 C ATOM 1315 N6 DA C 18 10.471 17.450 4.170 1.00 1.00 N ATOM 1316 N1 DA C 18 9.877 16.488 2.284 1.00 1.00 N ATOM 1317 C2 DA C 18 9.423 16.536 1.046 1.00 1.00 C ATOM 1318 N3 DA C 18 9.003 17.597 0.372 1.00 1.00 N ATOM 1319 C4 DA C 18 9.119 18.745 1.097 1.00 1.00 C ATOM 0 H5' DA C 18 10.303 22.411 -3.035 1.00 1.00 H new ATOM 0 H5'' DA C 18 8.969 22.949 -4.035 1.00 1.00 H new ATOM 0 H4' DA C 18 8.260 20.949 -3.367 1.00 1.00 H new ATOM 0 H3' DA C 18 6.726 23.015 -1.955 1.00 1.00 H new ATOM 0 H2' DA C 18 7.289 22.234 0.175 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.047 21.066 -0.228 1.00 1.00 H new ATOM 0 H1' DA C 18 7.579 19.419 -0.866 1.00 1.00 H new ATOM 0 H8 DA C 18 8.937 21.899 1.715 1.00 1.00 H new ATOM 0 H61 DA C 18 10.702 16.511 4.494 1.00 1.00 H new ATOM 0 H62 DA C 18 10.608 18.250 4.787 1.00 1.00 H new ATOM 0 H2 DA C 18 9.390 15.595 0.517 1.00 1.00 H new ATOM 1331 P DT C 19 4.505 21.419 -2.721 1.00 1.00 P ATOM 1332 OP1 DT C 19 3.931 21.095 -4.044 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.094 22.657 -2.025 1.00 1.00 O ATOM 1334 O5' DT C 19 4.261 20.163 -1.822 1.00 1.00 O ATOM 1335 C5' DT C 19 4.538 18.855 -2.294 1.00 1.00 C ATOM 1336 C4' DT C 19 4.015 17.845 -1.276 1.00 1.00 C ATOM 1337 O4' DT C 19 5.015 17.713 -0.281 1.00 1.00 O ATOM 1338 C3' DT C 19 2.726 18.320 -0.570 1.00 1.00 C ATOM 1339 O3' DT C 19 1.788 17.290 -0.391 1.00 1.00 O ATOM 1340 C2' DT C 19 3.232 18.750 0.789 1.00 1.00 C ATOM 1341 C1' DT C 19 4.363 17.734 0.961 1.00 1.00 C ATOM 1342 N1 DT C 19 5.341 18.017 2.036 1.00 1.00 N ATOM 1343 C2 DT C 19 5.808 16.933 2.785 1.00 1.00 C ATOM 1344 O2 DT C 19 5.530 15.759 2.541 1.00 1.00 O ATOM 1345 N3 DT C 19 6.595 17.232 3.866 1.00 1.00 N ATOM 1346 C4 DT C 19 6.887 18.488 4.333 1.00 1.00 C ATOM 1347 O4 DT C 19 7.551 18.580 5.363 1.00 1.00 O ATOM 1348 C5 DT C 19 6.359 19.582 3.514 1.00 1.00 C ATOM 1349 C7 DT C 19 6.576 21.032 3.914 1.00 1.00 C ATOM 1350 C6 DT C 19 5.653 19.311 2.383 1.00 1.00 C ATOM 0 H5' DT C 19 5.611 18.725 -2.438 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.064 18.695 -3.263 1.00 1.00 H new ATOM 0 H4' DT C 19 3.788 16.916 -1.798 1.00 1.00 H new ATOM 0 H3' DT C 19 2.216 19.090 -1.149 1.00 1.00 H new ATOM 0 H2' DT C 19 3.588 19.780 0.798 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.472 18.668 1.566 1.00 1.00 H new ATOM 0 H1' DT C 19 3.926 16.784 1.268 1.00 1.00 H new ATOM 0 H3 DT C 19 7.003 16.445 4.372 1.00 1.00 H new ATOM 0 H71 DT C 19 6.615 21.654 3.020 1.00 1.00 H new ATOM 0 H72 DT C 19 5.754 21.361 4.549 1.00 1.00 H new ATOM 0 H73 DT C 19 7.515 21.122 4.460 1.00 1.00 H new ATOM 0 H6 DT C 19 5.333 20.124 1.748 1.00 1.00 H new ATOM 1363 P DA C 20 0.729 16.937 -1.549 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.453 16.944 -2.848 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.452 17.829 -1.393 1.00 1.00 O ATOM 1366 O5' DA C 20 0.384 15.435 -1.084 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.313 15.227 0.137 1.00 1.00 C ATOM 1368 C4' DA C 20 0.066 13.903 0.803 1.00 1.00 C ATOM 1369 O4' DA C 20 1.357 14.054 1.398 1.00 1.00 O ATOM 1370 C3' DA C 20 -0.945 13.633 1.921 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.281 12.255 2.016 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.197 14.199 3.118 1.00 1.00 C ATOM 1373 C1' DA C 20 1.269 13.946 2.804 1.00 1.00 C ATOM 1374 N9 DA C 20 2.093 14.973 3.478 1.00 1.00 N ATOM 1375 C8 DA C 20 2.178 16.302 3.152 1.00 1.00 C ATOM 1376 N7 DA C 20 2.859 17.035 3.990 1.00 1.00 N ATOM 1377 C5 DA C 20 3.258 16.098 4.950 1.00 1.00 C ATOM 1378 C6 DA C 20 4.025 16.168 6.136 1.00 1.00 C ATOM 1379 N6 DA C 20 4.583 17.281 6.575 1.00 1.00 N ATOM 1380 N1 DA C 20 4.225 15.099 6.908 1.00 1.00 N ATOM 1381 C2 DA C 20 3.694 13.950 6.502 1.00 1.00 C ATOM 1382 N3 DA C 20 2.971 13.720 5.410 1.00 1.00 N ATOM 1383 C4 DA C 20 2.791 14.843 4.660 1.00 1.00 C ATOM 0 H5' DA C 20 -1.386 15.242 -0.053 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.099 16.049 0.820 1.00 1.00 H new ATOM 0 H4' DA C 20 0.071 13.091 0.076 1.00 1.00 H new ATOM 0 H3' DA C 20 -1.928 14.085 1.788 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.398 15.263 3.245 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.496 13.705 4.043 1.00 1.00 H new ATOM 0 H1' DA C 20 1.626 12.976 3.149 1.00 1.00 H new ATOM 0 H8 DA C 20 1.715 16.712 2.267 1.00 1.00 H new ATOM 0 H61 DA C 20 5.126 17.273 7.438 1.00 1.00 H new ATOM 0 H62 DA C 20 4.471 18.149 6.051 1.00 1.00 H new ATOM 0 H2 DA C 20 3.872 13.096 7.139 1.00 1.00 H new ATOM 1395 P DT C 21 -2.536 11.755 2.894 1.00 1.00 P ATOM 1396 OP1 DT C 21 -2.940 10.406 2.429 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.570 12.818 2.866 1.00 1.00 O ATOM 1398 O5' DT C 21 -1.945 11.639 4.376 1.00 1.00 O ATOM 1399 C5' DT C 21 -0.868 10.755 4.648 1.00 1.00 C ATOM 1400 C4' DT C 21 -0.596 10.578 6.143 1.00 1.00 C ATOM 1401 O4' DT C 21 0.245 11.624 6.602 1.00 1.00 O ATOM 1402 C3' DT C 21 -1.849 10.567 7.019 1.00 1.00 C ATOM 1403 O3' DT C 21 -1.678 9.569 8.013 1.00 1.00 O ATOM 1404 C2' DT C 21 -1.881 11.986 7.572 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.392 12.313 7.660 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.027 13.754 7.585 1.00 1.00 N ATOM 1407 C2 DT C 21 0.953 14.215 8.478 1.00 1.00 C ATOM 1408 O2 DT C 21 1.460 13.530 9.368 1.00 1.00 O ATOM 1409 N3 DT C 21 1.360 15.518 8.341 1.00 1.00 N ATOM 1410 C4 DT C 21 0.874 16.412 7.419 1.00 1.00 C ATOM 1411 O4 DT C 21 1.363 17.539 7.382 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.181 15.894 6.548 1.00 1.00 C ATOM 1413 C7 DT C 21 -0.830 16.814 5.533 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.584 14.601 6.643 1.00 1.00 C ATOM 0 H5' DT C 21 0.033 11.131 4.163 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.085 9.782 4.207 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.128 9.598 6.236 1.00 1.00 H new ATOM 0 H3' DT C 21 -2.787 10.327 6.518 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.413 12.671 6.912 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.370 12.036 8.545 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.068 12.003 8.654 1.00 1.00 H new ATOM 0 H3 DT C 21 2.084 15.851 8.977 1.00 1.00 H new ATOM 0 H71 DT C 21 -0.817 17.837 5.909 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.279 16.766 4.594 1.00 1.00 H new ATOM 0 H73 DT C 21 -1.861 16.502 5.366 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.348 14.229 5.976 1.00 1.00 H new ATOM 1427 P DG C 22 -2.862 9.122 9.000 1.00 1.00 P ATOM 1428 OP1 DG C 22 -2.630 7.706 9.369 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.164 9.506 8.396 1.00 1.00 O ATOM 1430 O5' DG C 22 -2.559 10.036 10.279 1.00 1.00 O ATOM 1431 C5' DG C 22 -1.468 9.717 11.133 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.202 10.777 12.204 1.00 1.00 C ATOM 1433 O4' DG C 22 -0.659 11.952 11.610 1.00 1.00 O ATOM 1434 C3' DG C 22 -2.458 11.165 13.007 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.184 11.010 14.400 1.00 1.00 O ATOM 1436 C2' DG C 22 -2.674 12.607 12.556 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.245 13.047 12.286 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.161 14.285 11.495 1.00 1.00 N ATOM 1439 C8 DG C 22 -1.832 14.595 10.346 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.560 15.779 9.864 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.652 16.307 10.797 1.00 1.00 C ATOM 1442 C6 DG C 22 0.034 17.577 10.862 1.00 1.00 C ATOM 1443 O6 DG C 22 0.044 18.498 10.047 1.00 1.00 O ATOM 1444 N1 DG C 22 0.775 17.744 12.010 1.00 1.00 N ATOM 1445 C2 DG C 22 0.890 16.799 12.969 1.00 1.00 C ATOM 1446 N2 DG C 22 1.612 17.104 14.011 1.00 1.00 N ATOM 1447 N3 DG C 22 0.335 15.590 12.933 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.435 15.406 11.818 1.00 1.00 C ATOM 0 H5' DG C 22 -0.570 9.588 10.529 1.00 1.00 H new ATOM 0 H5'' DG C 22 -1.665 8.762 11.619 1.00 1.00 H new ATOM 0 H4' DG C 22 -0.492 10.329 12.899 1.00 1.00 H new ATOM 0 H3' DG C 22 -3.351 10.562 12.843 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.300 12.671 11.666 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.153 13.212 13.326 1.00 1.00 H new ATOM 0 H1' DG C 22 -0.726 13.293 13.213 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.529 13.918 9.875 1.00 1.00 H new ATOM 0 H1 DG C 22 1.264 18.629 12.144 1.00 1.00 H new ATOM 0 H21 DG C 22 1.732 16.427 14.764 1.00 1.00 H new ATOM 0 H22 DG C 22 2.057 18.020 14.073 1.00 1.00 H new ATOM 1460 P DC C 23 -3.285 11.263 15.567 1.00 1.00 P ATOM 1461 OP1 DC C 23 -3.175 10.153 16.556 1.00 1.00 O ATOM 1462 OP2 DC C 23 -4.620 11.540 14.960 1.00 1.00 O ATOM 1463 O5' DC C 23 -2.749 12.630 16.257 1.00 1.00 O ATOM 1464 C5' DC C 23 -1.487 12.664 16.920 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.159 14.008 17.599 1.00 1.00 C ATOM 1466 O4' DC C 23 -0.859 15.007 16.624 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.298 14.508 18.505 1.00 1.00 C ATOM 1468 O3' DC C 23 -1.785 14.941 19.765 1.00 1.00 O ATOM 1469 C2' DC C 23 -2.909 15.617 17.647 1.00 1.00 C ATOM 1470 C1' DC C 23 -1.732 16.110 16.801 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.127 16.652 15.479 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.689 17.921 15.069 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.003 18.650 15.791 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.016 18.406 13.847 1.00 1.00 N ATOM 1475 C4 DC C 23 -2.768 17.656 13.066 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.017 18.154 11.889 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.247 16.363 13.421 1.00 1.00 C ATOM 1478 C6 DC C 23 -2.899 15.896 14.647 1.00 1.00 C ATOM 0 H5' DC C 23 -0.704 12.436 16.196 1.00 1.00 H new ATOM 0 H5'' DC C 23 -1.465 11.876 17.673 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.286 13.829 18.227 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.040 13.762 18.788 1.00 1.00 H new ATOM 0 H2' DC C 23 -3.720 15.240 17.024 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.323 16.416 18.261 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.258 16.940 17.325 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.592 17.634 11.226 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.637 19.064 11.630 1.00 1.00 H new ATOM 0 H5 DC C 23 -3.858 15.781 12.747 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.235 14.920 14.965 1.00 1.00 H new ATOM 1490 P DG C 24 -2.751 15.250 21.035 1.00 1.00 P ATOM 1491 OP1 DG C 24 -1.912 15.226 22.266 1.00 1.00 O ATOM 1492 OP2 DG C 24 -3.937 14.350 20.975 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.259 16.767 20.784 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.368 17.870 20.935 1.00 1.00 C ATOM 1495 C4' DG C 24 -2.874 19.160 20.272 1.00 1.00 C ATOM 1496 O4' DG C 24 -2.826 19.080 18.856 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.313 19.569 20.625 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.381 20.414 21.774 1.00 1.00 O ATOM 1499 C2' DG C 24 -4.782 20.309 19.370 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.632 20.134 18.371 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.110 19.862 17.004 1.00 1.00 N ATOM 1502 C8 DG C 24 -4.867 18.807 16.577 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.224 18.873 15.319 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.666 20.089 14.886 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.710 20.778 13.618 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.256 20.457 12.561 1.00 1.00 O ATOM 1507 N1 DG C 24 -4.044 21.987 13.628 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.410 22.494 14.710 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.839 23.661 14.580 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.339 21.903 15.896 1.00 1.00 N ATOM 1511 C4 DG C 24 -3.986 20.698 15.921 1.00 1.00 C ATOM 0 H5' DG C 24 -1.400 17.607 20.508 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.208 18.055 21.997 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.192 19.910 20.673 1.00 1.00 H new ATOM 0 H3' DG C 24 -4.931 18.710 20.885 1.00 1.00 H new ATOM 0 H2' DG C 24 -5.711 19.888 18.984 1.00 1.00 H new ATOM 0 H2'' DG C 24 -4.971 21.362 19.577 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.316 20.646 21.954 1.00 1.00 H new ATOM 0 H1' DG C 24 -3.061 21.059 18.295 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.147 17.988 17.223 1.00 1.00 H new ATOM 0 H1 DG C 24 -4.029 22.532 12.766 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.350 24.080 15.371 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.882 24.153 13.688 1.00 1.00 H new TER 1524 DG C 24