USER MOD reduce.3.24.130724 H: found=0, std=0, add=656, rem=0, adj=19 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=-1.5) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 168:sc= 1.2 (180deg=0.886) USER MOD Single : A 83 LYS NZ :NH3+ -164:sc= 1.11 (180deg=0.582) 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= 1.72 K(o=1.7,f=-8.7!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -170:sc= 0.0246 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.211 USER MOD Single : A 97 LYS NZ :NH3+ 177:sc= 1.24 (180deg=1.16) USER MOD Single : A 100 ASN : amide:sc= 0.109 K(o=0.11,f=-1.3) USER MOD Single : A 101 HIS : no HE2:sc= 0.769 K(o=0.77,f=-2.4!) USER MOD Single : A 102 LYS NZ :NH3+ 154:sc= 1.21 (180deg=1.13) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -158:sc= 1.13 (180deg=0.551) USER MOD Single : A 108 LYS NZ :NH3+ -151:sc= 2.43 (180deg=0.478) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 94:sc= 1.23 USER MOD Single : A 125 HIS : no HE2:sc= 0.825 K(o=0.82,f=-2.8!) 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= -0.262 (180deg=-0.262) 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= -0.185 (180deg=-0.185) USER MOD Single : C 21 DT C7 :methyl -30:sc= -1.3 (180deg=-1.43!) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -1.060 6.321 9.631 1.00 1.00 N ATOM 2 CA ALA A 79 0.133 5.785 8.915 1.00 1.00 C ATOM 3 C ALA A 79 0.431 6.591 7.650 1.00 1.00 C ATOM 4 O ALA A 79 -0.458 7.226 7.099 1.00 1.00 O ATOM 5 CB ALA A 79 -0.096 4.299 8.575 1.00 1.00 C ATOM 0 HA ALA A 79 1.001 5.874 9.568 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.776 3.907 8.052 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.251 3.735 9.495 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -0.975 4.203 7.938 1.00 1.00 H new ATOM 11 N ARG A 80 1.680 6.557 7.167 1.00 1.00 N ATOM 12 CA ARG A 80 2.152 7.182 5.902 1.00 1.00 C ATOM 13 C ARG A 80 1.515 6.543 4.650 1.00 1.00 C ATOM 14 O ARG A 80 2.187 5.839 3.895 1.00 1.00 O ATOM 15 CB ARG A 80 3.700 7.176 5.875 1.00 1.00 C ATOM 16 CG ARG A 80 4.283 8.076 6.979 1.00 1.00 C ATOM 17 CD ARG A 80 4.310 9.564 6.615 1.00 1.00 C ATOM 18 NE ARG A 80 4.451 10.407 7.821 1.00 1.00 N ATOM 19 CZ ARG A 80 3.479 10.975 8.512 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.225 10.856 8.208 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.720 11.748 9.520 1.00 1.00 N ATOM 0 H ARG A 80 2.430 6.074 7.661 1.00 1.00 H new ATOM 0 HA ARG A 80 1.818 8.219 5.875 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.064 6.157 6.004 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.050 7.519 4.901 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.697 7.945 7.889 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.298 7.748 7.204 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.137 9.759 5.933 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.393 9.829 6.088 1.00 1.00 H new ATOM 0 HE ARG A 80 5.401 10.567 8.156 1.00 1.00 H new ATOM 0 HH11 ARG A 80 1.947 10.301 7.399 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.516 11.317 8.778 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.683 11.934 9.801 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.948 12.172 10.034 1.00 1.00 H new ATOM 35 N LYS A 81 0.203 6.720 4.485 1.00 1.00 N ATOM 36 CA LYS A 81 -0.656 6.265 3.391 1.00 1.00 C ATOM 37 C LYS A 81 -0.232 6.908 2.073 1.00 1.00 C ATOM 38 O LYS A 81 0.061 8.098 1.981 1.00 1.00 O ATOM 39 CB LYS A 81 -2.110 6.655 3.714 1.00 1.00 C ATOM 40 CG LYS A 81 -2.737 5.828 4.852 1.00 1.00 C ATOM 41 CD LYS A 81 -3.751 6.651 5.662 1.00 1.00 C ATOM 42 CE LYS A 81 -4.556 5.736 6.595 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.327 6.522 7.600 1.00 1.00 N ATOM 0 H LYS A 81 -0.336 7.235 5.181 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.569 5.183 3.288 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.142 7.710 3.984 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.716 6.538 2.816 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.231 4.951 4.434 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -1.951 5.466 5.514 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.230 7.410 6.246 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.426 7.177 4.986 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.241 5.126 6.006 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.880 5.052 7.108 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -6.010 5.900 8.078 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.674 6.923 8.303 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.836 7.292 7.122 1.00 1.00 H new ATOM 57 N VAL A 82 -0.224 6.071 1.053 1.00 1.00 N ATOM 58 CA VAL A 82 -0.011 6.435 -0.352 1.00 1.00 C ATOM 59 C VAL A 82 -1.260 7.076 -0.955 1.00 1.00 C ATOM 60 O VAL A 82 -2.374 6.572 -0.802 1.00 1.00 O ATOM 61 CB VAL A 82 0.321 5.175 -1.183 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.443 5.450 -2.691 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.607 4.520 -0.686 1.00 1.00 C ATOM 0 H VAL A 82 -0.372 5.070 1.178 1.00 1.00 H new ATOM 0 HA VAL A 82 0.815 7.146 -0.380 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.523 4.500 -1.043 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.677 4.522 -3.212 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.500 5.849 -3.066 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.238 6.175 -2.866 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.820 3.635 -1.286 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.433 5.226 -0.774 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.488 4.230 0.358 1.00 1.00 H new ATOM 73 N LYS A 83 -1.069 8.157 -1.706 1.00 1.00 N ATOM 74 CA LYS A 83 -2.074 8.751 -2.573 1.00 1.00 C ATOM 75 C LYS A 83 -1.621 8.474 -3.999 1.00 1.00 C ATOM 76 O LYS A 83 -0.490 8.789 -4.379 1.00 1.00 O ATOM 77 CB LYS A 83 -2.263 10.262 -2.358 1.00 1.00 C ATOM 78 CG LYS A 83 -3.449 10.558 -1.428 1.00 1.00 C ATOM 79 CD LYS A 83 -3.605 12.076 -1.249 1.00 1.00 C ATOM 80 CE LYS A 83 -4.993 12.477 -0.728 1.00 1.00 C ATOM 81 NZ LYS A 83 -5.224 12.058 0.683 1.00 1.00 N ATOM 0 H LYS A 83 -0.180 8.658 -1.726 1.00 1.00 H new ATOM 0 HA LYS A 83 -3.045 8.311 -2.347 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.353 10.686 -1.934 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.424 10.749 -3.320 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.364 10.136 -1.845 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.291 10.083 -0.460 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.845 12.435 -0.555 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.424 12.570 -2.204 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.106 13.558 -0.804 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.758 12.031 -1.364 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -6.241 12.103 0.897 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.885 11.084 0.816 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.707 12.694 1.323 1.00 1.00 H new ATOM 95 N GLN A 84 -2.475 7.811 -4.771 1.00 1.00 N ATOM 96 CA GLN A 84 -2.280 7.702 -6.199 1.00 1.00 C ATOM 97 C GLN A 84 -2.881 8.988 -6.760 1.00 1.00 C ATOM 98 O GLN A 84 -3.907 9.469 -6.277 1.00 1.00 O ATOM 99 CB GLN A 84 -2.934 6.429 -6.772 1.00 1.00 C ATOM 100 CG GLN A 84 -3.640 6.592 -8.124 1.00 1.00 C ATOM 101 CD GLN A 84 -4.227 5.268 -8.613 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.423 5.029 -8.535 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.416 4.356 -9.111 1.00 1.00 N ATOM 0 H GLN A 84 -3.311 7.341 -4.423 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.230 7.600 -6.473 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.165 5.663 -6.875 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.659 6.058 -6.047 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.435 7.332 -8.034 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -2.933 6.972 -8.861 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.416 4.546 -9.180 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -3.788 3.460 -9.427 1.00 1.00 H new ATOM 112 N TYR A 85 -2.275 9.496 -7.817 1.00 1.00 N ATOM 113 CA TYR A 85 -2.787 10.623 -8.583 1.00 1.00 C ATOM 114 C TYR A 85 -2.838 10.211 -10.054 1.00 1.00 C ATOM 115 O TYR A 85 -1.932 9.530 -10.527 1.00 1.00 O ATOM 116 CB TYR A 85 -1.883 11.845 -8.364 1.00 1.00 C ATOM 117 CG TYR A 85 -1.687 12.283 -6.925 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.622 13.153 -6.336 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.554 11.868 -6.194 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.424 13.635 -5.030 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.350 12.341 -4.883 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.281 13.232 -4.302 1.00 1.00 C ATOM 123 OH TYR A 85 -1.105 13.703 -3.040 1.00 1.00 O ATOM 0 H TYR A 85 -1.393 9.130 -8.177 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.791 10.897 -8.258 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.904 11.629 -8.793 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.298 12.683 -8.924 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.499 13.453 -6.891 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.157 11.188 -6.639 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.141 14.309 -4.585 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.517 12.023 -4.322 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.276 13.337 -2.667 1.00 1.00 H new ATOM 133 N LYS A 86 -3.871 10.630 -10.788 1.00 1.00 N ATOM 134 CA LYS A 86 -4.046 10.363 -12.225 1.00 1.00 C ATOM 135 C LYS A 86 -4.436 11.659 -12.928 1.00 1.00 C ATOM 136 O LYS A 86 -5.248 12.404 -12.398 1.00 1.00 O ATOM 137 CB LYS A 86 -5.100 9.257 -12.396 1.00 1.00 C ATOM 138 CG LYS A 86 -5.493 9.012 -13.862 1.00 1.00 C ATOM 139 CD LYS A 86 -6.310 7.719 -13.997 1.00 1.00 C ATOM 140 CE LYS A 86 -6.609 7.436 -15.479 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.433 6.203 -15.651 1.00 1.00 N ATOM 0 H LYS A 86 -4.633 11.180 -10.392 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.120 10.012 -12.680 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.716 8.330 -11.970 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -5.991 9.523 -11.828 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.075 9.856 -14.233 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.596 8.947 -14.478 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.759 6.884 -13.563 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.243 7.809 -13.440 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.133 8.287 -15.913 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.672 7.326 -16.025 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.614 6.045 -16.663 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -6.922 5.386 -15.259 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.338 6.318 -15.151 1.00 1.00 H new ATOM 155 N ASN A 87 -3.859 11.932 -14.096 1.00 1.00 N ATOM 156 CA ASN A 87 -4.039 13.217 -14.780 1.00 1.00 C ATOM 157 C ASN A 87 -4.946 13.099 -16.029 1.00 1.00 C ATOM 158 O ASN A 87 -4.517 12.532 -17.037 1.00 1.00 O ATOM 159 CB ASN A 87 -2.648 13.765 -15.102 1.00 1.00 C ATOM 160 CG ASN A 87 -2.673 15.163 -15.683 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.634 15.615 -16.285 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.620 15.911 -15.490 1.00 1.00 N ATOM 0 H ASN A 87 -3.257 11.276 -14.595 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.565 13.917 -14.131 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.047 13.768 -14.193 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.156 13.095 -15.807 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.603 16.868 -15.842 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.815 15.538 -14.988 1.00 1.00 H new ATOM 169 N PRO A 88 -6.171 13.668 -16.010 1.00 1.00 N ATOM 170 CA PRO A 88 -7.094 13.703 -17.154 1.00 1.00 C ATOM 171 C PRO A 88 -6.512 14.272 -18.461 1.00 1.00 C ATOM 172 O PRO A 88 -6.973 13.912 -19.547 1.00 1.00 O ATOM 173 CB PRO A 88 -8.279 14.562 -16.689 1.00 1.00 C ATOM 174 CG PRO A 88 -8.276 14.416 -15.169 1.00 1.00 C ATOM 175 CD PRO A 88 -6.790 14.307 -14.854 1.00 1.00 C ATOM 0 HA PRO A 88 -7.359 12.679 -17.417 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.158 15.603 -16.989 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.217 14.213 -17.120 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.734 15.275 -14.678 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.826 13.533 -14.845 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.357 15.291 -14.676 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.626 13.719 -13.951 1.00 1.00 H new ATOM 183 N HIS A 89 -5.511 15.160 -18.376 1.00 1.00 N ATOM 184 CA HIS A 89 -4.922 15.887 -19.517 1.00 1.00 C ATOM 185 C HIS A 89 -3.752 15.161 -20.203 1.00 1.00 C ATOM 186 O HIS A 89 -3.390 15.531 -21.319 1.00 1.00 O ATOM 187 CB HIS A 89 -4.490 17.285 -19.042 1.00 1.00 C ATOM 188 CG HIS A 89 -5.601 18.055 -18.370 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.649 18.698 -19.006 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.758 18.226 -17.022 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.430 19.252 -18.057 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.907 18.980 -16.844 1.00 1.00 N ATOM 0 H HIS A 89 -5.074 15.401 -17.487 1.00 1.00 H new ATOM 0 HA HIS A 89 -5.695 15.954 -20.283 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.656 17.184 -18.348 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.127 17.856 -19.897 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.111 17.846 -16.245 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.329 19.822 -18.239 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.292 19.279 -15.948 1.00 1.00 H new ATOM 201 N THR A 90 -3.174 14.138 -19.564 1.00 1.00 N ATOM 202 CA THR A 90 -1.990 13.402 -20.064 1.00 1.00 C ATOM 203 C THR A 90 -2.170 11.879 -20.084 1.00 1.00 C ATOM 204 O THR A 90 -1.475 11.189 -20.833 1.00 1.00 O ATOM 205 CB THR A 90 -0.751 13.720 -19.217 1.00 1.00 C ATOM 206 OG1 THR A 90 -0.939 13.179 -17.933 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.510 15.213 -19.008 1.00 1.00 C ATOM 0 H THR A 90 -3.516 13.786 -18.669 1.00 1.00 H new ATOM 0 HA THR A 90 -1.862 13.741 -21.092 1.00 1.00 H new ATOM 0 HB THR A 90 0.098 13.302 -19.757 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.235 13.505 -17.335 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.383 15.356 -18.400 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.373 15.698 -19.974 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.369 15.653 -18.500 1.00 1.00 H new ATOM 215 N GLY A 91 -3.101 11.343 -19.285 1.00 1.00 N ATOM 216 CA GLY A 91 -3.291 9.906 -19.078 1.00 1.00 C ATOM 217 C GLY A 91 -2.209 9.251 -18.203 1.00 1.00 C ATOM 218 O GLY A 91 -2.164 8.025 -18.115 1.00 1.00 O ATOM 0 H GLY A 91 -3.758 11.913 -18.752 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.265 9.742 -18.617 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.309 9.409 -20.048 1.00 1.00 H new ATOM 222 N GLU A 92 -1.335 10.032 -17.558 1.00 1.00 N ATOM 223 CA GLU A 92 -0.331 9.547 -16.624 1.00 1.00 C ATOM 224 C GLU A 92 -0.928 9.363 -15.232 1.00 1.00 C ATOM 225 O GLU A 92 -1.929 9.975 -14.846 1.00 1.00 O ATOM 226 CB GLU A 92 0.859 10.512 -16.541 1.00 1.00 C ATOM 227 CG GLU A 92 1.804 10.367 -17.734 1.00 1.00 C ATOM 228 CD GLU A 92 2.807 9.212 -17.540 1.00 1.00 C ATOM 229 OE1 GLU A 92 2.399 8.026 -17.620 1.00 1.00 O ATOM 230 OE2 GLU A 92 4.015 9.477 -17.319 1.00 1.00 O ATOM 0 H GLU A 92 -1.312 11.044 -17.679 1.00 1.00 H new ATOM 0 HA GLU A 92 0.019 8.584 -16.995 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.491 11.537 -16.494 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.410 10.328 -15.619 1.00 1.00 H new ATOM 0 HG2 GLU A 92 1.221 10.193 -18.639 1.00 1.00 H new ATOM 0 HG3 GLU A 92 2.349 11.300 -17.880 1.00 1.00 H new ATOM 237 N VAL A 93 -0.237 8.536 -14.465 1.00 1.00 N ATOM 238 CA VAL A 93 -0.531 8.168 -13.081 1.00 1.00 C ATOM 239 C VAL A 93 0.765 8.172 -12.262 1.00 1.00 C ATOM 240 O VAL A 93 1.865 7.982 -12.785 1.00 1.00 O ATOM 241 CB VAL A 93 -1.185 6.776 -13.041 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.723 6.366 -11.652 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.357 6.683 -14.028 1.00 1.00 C ATOM 0 H VAL A 93 0.602 8.070 -14.812 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.223 8.892 -12.651 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.378 6.095 -13.312 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.167 5.373 -11.713 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -0.903 6.354 -10.934 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.478 7.082 -11.328 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.798 5.688 -13.976 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.110 7.428 -13.770 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -1.996 6.868 -15.040 1.00 1.00 H new ATOM 253 N ILE A 94 0.610 8.360 -10.958 1.00 1.00 N ATOM 254 CA ILE A 94 1.654 8.376 -9.929 1.00 1.00 C ATOM 255 C ILE A 94 1.102 7.767 -8.640 1.00 1.00 C ATOM 256 O ILE A 94 -0.105 7.646 -8.455 1.00 1.00 O ATOM 257 CB ILE A 94 2.172 9.803 -9.599 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.585 10.948 -10.449 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.709 9.833 -9.637 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.946 12.325 -9.893 1.00 1.00 C ATOM 0 H ILE A 94 -0.315 8.517 -10.557 1.00 1.00 H new ATOM 0 HA ILE A 94 2.489 7.801 -10.328 1.00 1.00 H new ATOM 0 HB ILE A 94 1.807 10.003 -8.592 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.952 10.864 -11.472 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.500 10.848 -10.490 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.059 10.839 -9.404 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.105 9.132 -8.902 1.00 1.00 H new ATOM 0 HG23 ILE A 94 4.054 9.550 -10.631 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.510 13.098 -10.525 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.556 12.422 -8.880 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.030 12.438 -9.877 1.00 1.00 H new ATOM 272 N GLU A 95 2.009 7.504 -7.707 1.00 1.00 N ATOM 273 CA GLU A 95 1.776 7.053 -6.336 1.00 1.00 C ATOM 274 C GLU A 95 2.866 7.628 -5.421 1.00 1.00 C ATOM 275 O GLU A 95 4.055 7.391 -5.646 1.00 1.00 O ATOM 276 CB GLU A 95 1.858 5.525 -6.278 1.00 1.00 C ATOM 277 CG GLU A 95 0.563 4.847 -6.718 1.00 1.00 C ATOM 278 CD GLU A 95 0.722 3.313 -6.762 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.941 2.684 -5.699 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.629 2.727 -7.869 1.00 1.00 O ATOM 0 H GLU A 95 3.005 7.608 -7.902 1.00 1.00 H new ATOM 0 HA GLU A 95 0.791 7.389 -6.012 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.675 5.185 -6.914 1.00 1.00 H new ATOM 0 HB3 GLU A 95 2.097 5.217 -5.260 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.241 5.112 -6.031 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.274 5.214 -7.703 1.00 1.00 H new ATOM 287 N THR A 96 2.471 8.386 -4.397 1.00 1.00 N ATOM 288 CA THR A 96 3.397 9.020 -3.438 1.00 1.00 C ATOM 289 C THR A 96 2.751 9.067 -2.049 1.00 1.00 C ATOM 290 O THR A 96 1.526 9.083 -1.936 1.00 1.00 O ATOM 291 CB THR A 96 3.855 10.433 -3.892 1.00 1.00 C ATOM 292 OG1 THR A 96 3.189 11.456 -3.174 1.00 1.00 O ATOM 293 CG2 THR A 96 3.624 10.763 -5.376 1.00 1.00 C ATOM 0 H THR A 96 1.489 8.583 -4.202 1.00 1.00 H new ATOM 0 HA THR A 96 4.299 8.409 -3.395 1.00 1.00 H new ATOM 0 HB THR A 96 4.927 10.401 -3.698 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.503 12.331 -3.484 1.00 1.00 H new ATOM 0 HG21 THR A 96 3.980 11.772 -5.584 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.169 10.051 -5.996 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.559 10.700 -5.601 1.00 1.00 H new ATOM 301 N LYS A 97 3.539 9.088 -0.971 1.00 1.00 N ATOM 302 CA LYS A 97 3.043 9.258 0.412 1.00 1.00 C ATOM 303 C LYS A 97 3.153 10.726 0.876 1.00 1.00 C ATOM 304 O LYS A 97 3.020 11.017 2.069 1.00 1.00 O ATOM 305 CB LYS A 97 3.809 8.313 1.354 1.00 1.00 C ATOM 306 CG LYS A 97 3.831 6.836 0.914 1.00 1.00 C ATOM 307 CD LYS A 97 4.925 6.031 1.635 1.00 1.00 C ATOM 308 CE LYS A 97 5.270 4.713 0.918 1.00 1.00 C ATOM 309 NZ LYS A 97 6.044 4.947 -0.340 1.00 1.00 N ATOM 0 H LYS A 97 4.552 8.987 -1.026 1.00 1.00 H new ATOM 0 HA LYS A 97 1.985 8.998 0.438 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.836 8.666 1.442 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.364 8.375 2.347 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.859 6.385 1.114 1.00 1.00 H new ATOM 0 HG3 LYS A 97 3.992 6.782 -0.163 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.825 6.641 1.715 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.597 5.811 2.651 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.849 4.077 1.587 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.351 4.176 0.684 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.300 4.033 -0.765 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.462 5.490 -1.010 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.909 5.481 -0.121 1.00 1.00 H new ATOM 323 N GLY A 98 3.447 11.629 -0.064 1.00 1.00 N ATOM 324 CA GLY A 98 3.738 13.045 0.132 1.00 1.00 C ATOM 325 C GLY A 98 5.034 13.494 -0.553 1.00 1.00 C ATOM 326 O GLY A 98 5.606 12.795 -1.394 1.00 1.00 O ATOM 0 H GLY A 98 3.490 11.368 -1.049 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.907 13.637 -0.252 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.809 13.251 1.200 1.00 1.00 H new ATOM 330 N GLY A 99 5.488 14.679 -0.155 1.00 1.00 N ATOM 331 CA GLY A 99 6.792 15.238 -0.491 1.00 1.00 C ATOM 332 C GLY A 99 6.974 15.779 -1.918 1.00 1.00 C ATOM 333 O GLY A 99 6.172 15.572 -2.832 1.00 1.00 O ATOM 0 H GLY A 99 4.934 15.301 0.434 1.00 1.00 H new ATOM 0 HA2 GLY A 99 7.003 16.048 0.207 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.544 14.467 -0.323 1.00 1.00 H new ATOM 337 N ASN A 100 8.093 16.479 -2.088 1.00 1.00 N ATOM 338 CA ASN A 100 8.670 16.939 -3.346 1.00 1.00 C ATOM 339 C ASN A 100 8.924 15.718 -4.263 1.00 1.00 C ATOM 340 O ASN A 100 9.862 14.949 -4.054 1.00 1.00 O ATOM 341 CB ASN A 100 9.937 17.742 -2.967 1.00 1.00 C ATOM 342 CG ASN A 100 10.999 17.923 -4.040 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.785 17.756 -5.235 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.185 18.299 -3.608 1.00 1.00 N ATOM 0 H ASN A 100 8.662 16.760 -1.289 1.00 1.00 H new ATOM 0 HA ASN A 100 8.014 17.592 -3.921 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.622 18.731 -2.635 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.403 17.252 -2.112 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.943 18.456 -4.272 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.345 18.433 -2.610 1.00 1.00 H new ATOM 351 N HIS A 101 8.033 15.510 -5.247 1.00 1.00 N ATOM 352 CA HIS A 101 8.108 14.441 -6.256 1.00 1.00 C ATOM 353 C HIS A 101 7.910 15.037 -7.658 1.00 1.00 C ATOM 354 O HIS A 101 6.883 15.667 -7.901 1.00 1.00 O ATOM 355 CB HIS A 101 7.091 13.343 -5.883 1.00 1.00 C ATOM 356 CG HIS A 101 7.283 12.061 -6.658 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.207 11.062 -6.383 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.572 11.677 -7.762 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.052 10.091 -7.305 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.072 10.447 -8.161 1.00 1.00 N ATOM 0 H HIS A 101 7.212 16.103 -5.366 1.00 1.00 H new ATOM 0 HA HIS A 101 9.091 13.970 -6.273 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.172 13.130 -4.817 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.082 13.717 -6.058 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.883 11.063 -5.619 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.772 12.228 -8.234 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.621 9.174 -7.351 1.00 1.00 H new ATOM 369 N LYS A 102 8.861 14.830 -8.581 1.00 1.00 N ATOM 370 CA LYS A 102 8.939 15.513 -9.897 1.00 1.00 C ATOM 371 C LYS A 102 7.612 15.632 -10.659 1.00 1.00 C ATOM 372 O LYS A 102 7.100 16.739 -10.773 1.00 1.00 O ATOM 373 CB LYS A 102 10.081 14.909 -10.725 1.00 1.00 C ATOM 374 CG LYS A 102 10.263 15.655 -12.059 1.00 1.00 C ATOM 375 CD LYS A 102 11.710 15.592 -12.547 1.00 1.00 C ATOM 376 CE LYS A 102 12.564 16.703 -11.912 1.00 1.00 C ATOM 377 NZ LYS A 102 13.996 16.583 -12.301 1.00 1.00 N ATOM 0 H LYS A 102 9.622 14.166 -8.436 1.00 1.00 H new ATOM 0 HA LYS A 102 9.172 16.559 -9.695 1.00 1.00 H new ATOM 0 HB2 LYS A 102 11.008 14.951 -10.154 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.874 13.857 -10.920 1.00 1.00 H new ATOM 0 HG2 LYS A 102 9.605 15.221 -12.812 1.00 1.00 H new ATOM 0 HG3 LYS A 102 9.964 16.696 -11.938 1.00 1.00 H new ATOM 0 HD2 LYS A 102 12.136 14.619 -12.303 1.00 1.00 H new ATOM 0 HD3 LYS A 102 11.734 15.688 -13.633 1.00 1.00 H new ATOM 0 HE2 LYS A 102 12.183 17.677 -12.220 1.00 1.00 H new ATOM 0 HE3 LYS A 102 12.476 16.655 -10.827 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 14.449 17.518 -12.251 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 14.479 15.930 -11.652 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 14.062 16.218 -13.272 1.00 1.00 H new ATOM 391 N THR A 103 7.004 14.524 -11.094 1.00 1.00 N ATOM 392 CA THR A 103 5.758 14.565 -11.904 1.00 1.00 C ATOM 393 C THR A 103 4.614 15.280 -11.181 1.00 1.00 C ATOM 394 O THR A 103 3.926 16.112 -11.768 1.00 1.00 O ATOM 395 CB THR A 103 5.306 13.158 -12.327 1.00 1.00 C ATOM 396 OG1 THR A 103 6.378 12.500 -12.973 1.00 1.00 O ATOM 397 CG2 THR A 103 4.120 13.235 -13.292 1.00 1.00 C ATOM 0 H THR A 103 7.346 13.582 -10.905 1.00 1.00 H new ATOM 0 HA THR A 103 6.003 15.138 -12.798 1.00 1.00 H new ATOM 0 HB THR A 103 5.002 12.609 -11.436 1.00 1.00 H new ATOM 0 HG1 THR A 103 6.095 11.601 -13.243 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.817 12.228 -13.578 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.286 13.740 -12.804 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.411 13.793 -14.182 1.00 1.00 H new ATOM 405 N LEU A 104 4.466 15.020 -9.877 1.00 1.00 N ATOM 406 CA LEU A 104 3.454 15.650 -9.024 1.00 1.00 C ATOM 407 C LEU A 104 3.638 17.177 -8.966 1.00 1.00 C ATOM 408 O LEU A 104 2.659 17.917 -9.025 1.00 1.00 O ATOM 409 CB LEU A 104 3.526 14.970 -7.638 1.00 1.00 C ATOM 410 CG LEU A 104 2.471 15.415 -6.609 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.046 15.189 -7.110 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.646 14.617 -5.321 1.00 1.00 C ATOM 0 H LEU A 104 5.056 14.355 -9.377 1.00 1.00 H new ATOM 0 HA LEU A 104 2.455 15.507 -9.435 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.434 13.893 -7.779 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.515 15.153 -7.217 1.00 1.00 H new ATOM 0 HG LEU A 104 2.619 16.482 -6.440 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.337 15.518 -6.350 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.887 15.759 -8.025 1.00 1.00 H new ATOM 0 HD13 LEU A 104 0.895 14.129 -7.312 1.00 1.00 H new ATOM 0 HD21 LEU A 104 1.899 14.933 -4.593 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.522 13.555 -5.531 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.643 14.792 -4.917 1.00 1.00 H new ATOM 424 N LYS A 105 4.888 17.663 -8.937 1.00 1.00 N ATOM 425 CA LYS A 105 5.204 19.101 -9.000 1.00 1.00 C ATOM 426 C LYS A 105 4.907 19.713 -10.370 1.00 1.00 C ATOM 427 O LYS A 105 4.470 20.860 -10.419 1.00 1.00 O ATOM 428 CB LYS A 105 6.672 19.345 -8.597 1.00 1.00 C ATOM 429 CG LYS A 105 6.957 19.153 -7.092 1.00 1.00 C ATOM 430 CD LYS A 105 6.215 20.120 -6.146 1.00 1.00 C ATOM 431 CE LYS A 105 6.379 21.598 -6.554 1.00 1.00 C ATOM 432 NZ LYS A 105 5.782 22.511 -5.540 1.00 1.00 N ATOM 0 H LYS A 105 5.713 17.068 -8.869 1.00 1.00 H new ATOM 0 HA LYS A 105 4.550 19.604 -8.288 1.00 1.00 H new ATOM 0 HB2 LYS A 105 7.310 18.668 -9.165 1.00 1.00 H new ATOM 0 HB3 LYS A 105 6.951 20.360 -8.881 1.00 1.00 H new ATOM 0 HG2 LYS A 105 6.694 18.131 -6.818 1.00 1.00 H new ATOM 0 HG3 LYS A 105 8.029 19.262 -6.926 1.00 1.00 H new ATOM 0 HD2 LYS A 105 5.155 19.867 -6.133 1.00 1.00 H new ATOM 0 HD3 LYS A 105 6.587 19.985 -5.130 1.00 1.00 H new ATOM 0 HE2 LYS A 105 7.438 21.828 -6.675 1.00 1.00 H new ATOM 0 HE3 LYS A 105 5.904 21.765 -7.521 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 5.568 23.428 -5.982 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 4.905 22.092 -5.169 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 6.455 22.651 -4.760 1.00 1.00 H new ATOM 446 N GLU A 106 5.055 18.976 -11.472 1.00 1.00 N ATOM 447 CA GLU A 106 4.725 19.497 -12.804 1.00 1.00 C ATOM 448 C GLU A 106 3.224 19.686 -12.958 1.00 1.00 C ATOM 449 O GLU A 106 2.759 20.694 -13.476 1.00 1.00 O ATOM 450 CB GLU A 106 5.172 18.573 -13.939 1.00 1.00 C ATOM 451 CG GLU A 106 6.600 18.085 -13.792 1.00 1.00 C ATOM 452 CD GLU A 106 7.136 17.501 -15.116 1.00 1.00 C ATOM 453 OE1 GLU A 106 6.946 16.287 -15.376 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.746 18.256 -15.911 1.00 1.00 O ATOM 0 H GLU A 106 5.401 18.016 -11.471 1.00 1.00 H new ATOM 0 HA GLU A 106 5.259 20.445 -12.877 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.504 17.712 -13.981 1.00 1.00 H new ATOM 0 HB3 GLU A 106 5.072 19.101 -14.888 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.237 18.910 -13.473 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.648 17.325 -13.012 1.00 1.00 H new ATOM 461 N TRP A 107 2.454 18.719 -12.469 1.00 1.00 N ATOM 462 CA TRP A 107 0.989 18.799 -12.507 1.00 1.00 C ATOM 463 C TRP A 107 0.442 19.984 -11.695 1.00 1.00 C ATOM 464 O TRP A 107 -0.481 20.672 -12.139 1.00 1.00 O ATOM 465 CB TRP A 107 0.373 17.485 -12.027 1.00 1.00 C ATOM 466 CG TRP A 107 0.637 16.249 -12.827 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.459 16.112 -13.896 1.00 1.00 C ATOM 468 CD2 TRP A 107 0.069 14.927 -12.596 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.439 14.805 -14.331 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.643 14.024 -13.534 1.00 1.00 C ATOM 471 CE3 TRP A 107 -0.879 14.399 -11.693 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.352 12.659 -13.541 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.237 13.040 -11.738 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.610 12.169 -12.646 1.00 1.00 C ATOM 0 H TRP A 107 2.816 17.867 -12.040 1.00 1.00 H new ATOM 0 HA TRP A 107 0.703 18.970 -13.545 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.722 17.305 -11.010 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.707 17.623 -11.973 1.00 1.00 H new ATOM 0 HD1 TRP A 107 2.041 16.906 -14.339 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.952 14.462 -15.143 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.335 15.047 -10.959 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.858 11.992 -14.223 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -1.998 12.663 -11.071 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -0.870 11.121 -12.654 1.00 1.00 H new ATOM 485 N LYS A 108 1.057 20.290 -10.545 1.00 1.00 N ATOM 486 CA LYS A 108 0.730 21.503 -9.770 1.00 1.00 C ATOM 487 C LYS A 108 1.097 22.788 -10.518 1.00 1.00 C ATOM 488 O LYS A 108 0.404 23.789 -10.362 1.00 1.00 O ATOM 489 CB LYS A 108 1.450 21.505 -8.417 1.00 1.00 C ATOM 490 CG LYS A 108 0.888 20.441 -7.474 1.00 1.00 C ATOM 491 CD LYS A 108 1.521 20.609 -6.094 1.00 1.00 C ATOM 492 CE LYS A 108 1.132 19.420 -5.208 1.00 1.00 C ATOM 493 NZ LYS A 108 1.638 19.598 -3.825 1.00 1.00 N ATOM 0 H LYS A 108 1.787 19.714 -10.126 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.349 21.481 -9.619 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.514 21.328 -8.571 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.354 22.488 -7.955 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.196 20.535 -7.404 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.097 19.445 -7.864 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.606 20.670 -6.184 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.186 21.541 -5.639 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.047 19.314 -5.191 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.535 18.500 -5.631 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 1.814 18.667 -3.397 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.524 20.142 -3.847 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 0.931 20.110 -3.260 1.00 1.00 H new ATOM 507 N ALA A 109 2.154 22.766 -11.335 1.00 1.00 N ATOM 508 CA ALA A 109 2.539 23.909 -12.149 1.00 1.00 C ATOM 509 C ALA A 109 1.542 24.127 -13.297 1.00 1.00 C ATOM 510 O ALA A 109 1.026 25.228 -13.500 1.00 1.00 O ATOM 511 CB ALA A 109 3.939 23.653 -12.722 1.00 1.00 C ATOM 0 H ALA A 109 2.762 21.955 -11.446 1.00 1.00 H new ATOM 0 HA ALA A 109 2.540 24.805 -11.528 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.242 24.502 -13.335 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.649 23.524 -11.905 1.00 1.00 H new ATOM 0 HB3 ALA A 109 3.922 22.751 -13.334 1.00 1.00 H new ATOM 517 N LYS A 110 1.285 23.043 -14.042 1.00 1.00 N ATOM 518 CA LYS A 110 0.553 23.035 -15.292 1.00 1.00 C ATOM 519 C LYS A 110 -0.971 23.205 -15.163 1.00 1.00 C ATOM 520 O LYS A 110 -1.579 23.786 -16.061 1.00 1.00 O ATOM 521 CB LYS A 110 0.929 21.779 -16.100 1.00 1.00 C ATOM 522 CG LYS A 110 2.355 21.899 -16.679 1.00 1.00 C ATOM 523 CD LYS A 110 2.671 20.957 -17.852 1.00 1.00 C ATOM 524 CE LYS A 110 2.721 19.458 -17.507 1.00 1.00 C ATOM 525 NZ LYS A 110 3.340 18.677 -18.622 1.00 1.00 N ATOM 0 H LYS A 110 1.601 22.113 -13.768 1.00 1.00 H new ATOM 0 HA LYS A 110 0.861 23.930 -15.832 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.865 20.899 -15.461 1.00 1.00 H new ATOM 0 HB3 LYS A 110 0.214 21.637 -16.911 1.00 1.00 H new ATOM 0 HG2 LYS A 110 2.510 22.926 -17.008 1.00 1.00 H new ATOM 0 HG3 LYS A 110 3.071 21.709 -15.879 1.00 1.00 H new ATOM 0 HD2 LYS A 110 1.921 21.108 -18.628 1.00 1.00 H new ATOM 0 HD3 LYS A 110 3.632 21.246 -18.278 1.00 1.00 H new ATOM 0 HE2 LYS A 110 3.294 19.310 -16.591 1.00 1.00 H new ATOM 0 HE3 LYS A 110 1.713 19.090 -17.315 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 3.364 17.669 -18.368 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.778 18.803 -19.488 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 4.310 19.015 -18.786 1.00 1.00 H new ATOM 539 N TRP A 111 -1.567 22.766 -14.044 1.00 1.00 N ATOM 540 CA TRP A 111 -3.020 22.866 -13.794 1.00 1.00 C ATOM 541 C TRP A 111 -3.384 23.368 -12.386 1.00 1.00 C ATOM 542 O TRP A 111 -4.201 24.285 -12.277 1.00 1.00 O ATOM 543 CB TRP A 111 -3.691 21.510 -14.081 1.00 1.00 C ATOM 544 CG TRP A 111 -3.485 20.997 -15.476 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.190 21.367 -16.567 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.460 20.080 -15.959 1.00 1.00 C ATOM 547 NE1 TRP A 111 -3.662 20.758 -17.691 1.00 1.00 N ATOM 548 CE2 TRP A 111 -2.580 19.961 -17.373 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.421 19.363 -15.338 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -1.708 19.164 -18.132 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -0.520 18.584 -16.092 1.00 1.00 C ATOM 552 CH2 TRP A 111 -0.681 18.459 -17.482 1.00 1.00 C ATOM 0 H TRP A 111 -1.054 22.328 -13.279 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.400 23.626 -14.477 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.307 20.773 -13.376 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.761 21.602 -13.895 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -5.037 22.037 -16.562 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.026 20.882 -18.636 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.312 19.410 -14.265 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -1.825 19.094 -19.203 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 0.298 18.081 -15.599 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.017 17.823 -18.049 1.00 1.00 H new ATOM 563 N GLY A 112 -2.776 22.824 -11.323 1.00 1.00 N ATOM 564 CA GLY A 112 -2.889 23.364 -9.952 1.00 1.00 C ATOM 565 C GLY A 112 -3.041 22.307 -8.851 1.00 1.00 C ATOM 566 O GLY A 112 -3.575 21.230 -9.111 1.00 1.00 O ATOM 0 H GLY A 112 -2.188 21.993 -11.385 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -2.004 23.964 -9.740 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.747 24.036 -9.911 1.00 1.00 H new ATOM 570 N PRO A 113 -2.639 22.593 -7.597 1.00 1.00 N ATOM 571 CA PRO A 113 -2.762 21.651 -6.477 1.00 1.00 C ATOM 572 C PRO A 113 -4.210 21.244 -6.167 1.00 1.00 C ATOM 573 O PRO A 113 -4.453 20.086 -5.839 1.00 1.00 O ATOM 574 CB PRO A 113 -2.086 22.321 -5.279 1.00 1.00 C ATOM 575 CG PRO A 113 -2.068 23.807 -5.634 1.00 1.00 C ATOM 576 CD PRO A 113 -1.989 23.823 -7.159 1.00 1.00 C ATOM 0 HA PRO A 113 -2.279 20.708 -6.734 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.640 22.139 -4.358 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -1.077 21.937 -5.126 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.964 24.314 -5.276 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.214 24.314 -5.185 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.491 24.699 -7.569 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.954 23.862 -7.498 1.00 1.00 H new ATOM 584 N GLU A 114 -5.184 22.143 -6.344 1.00 1.00 N ATOM 585 CA GLU A 114 -6.607 21.850 -6.114 1.00 1.00 C ATOM 586 C GLU A 114 -7.100 20.740 -7.040 1.00 1.00 C ATOM 587 O GLU A 114 -7.755 19.786 -6.620 1.00 1.00 O ATOM 588 CB GLU A 114 -7.454 23.097 -6.386 1.00 1.00 C ATOM 589 CG GLU A 114 -6.904 24.379 -5.762 1.00 1.00 C ATOM 590 CD GLU A 114 -7.919 25.531 -5.890 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.918 26.237 -6.930 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.730 25.744 -4.953 1.00 1.00 O ATOM 0 H GLU A 114 -5.009 23.099 -6.652 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.708 21.534 -5.076 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.537 23.238 -7.464 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.462 22.927 -6.009 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.674 24.207 -4.711 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.970 24.655 -6.252 1.00 1.00 H new ATOM 599 N ALA A 115 -6.724 20.878 -8.311 1.00 1.00 N ATOM 600 CA ALA A 115 -6.991 19.915 -9.367 1.00 1.00 C ATOM 601 C ALA A 115 -6.359 18.565 -9.019 1.00 1.00 C ATOM 602 O ALA A 115 -7.029 17.538 -8.923 1.00 1.00 O ATOM 603 CB ALA A 115 -6.415 20.463 -10.679 1.00 1.00 C ATOM 0 H ALA A 115 -6.207 21.694 -8.640 1.00 1.00 H new ATOM 0 HA ALA A 115 -8.065 19.763 -9.476 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.606 19.754 -11.484 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.889 21.416 -10.915 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.340 20.610 -10.571 1.00 1.00 H new ATOM 609 N VAL A 116 -5.053 18.619 -8.761 1.00 1.00 N ATOM 610 CA VAL A 116 -4.189 17.480 -8.509 1.00 1.00 C ATOM 611 C VAL A 116 -4.679 16.642 -7.327 1.00 1.00 C ATOM 612 O VAL A 116 -4.828 15.427 -7.452 1.00 1.00 O ATOM 613 CB VAL A 116 -2.754 17.993 -8.315 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.777 16.992 -7.696 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.206 18.427 -9.679 1.00 1.00 C ATOM 0 H VAL A 116 -4.549 19.505 -8.721 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.211 16.806 -9.366 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.826 18.815 -7.602 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.794 17.453 -7.603 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.135 16.697 -6.709 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.705 16.111 -8.334 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.187 18.795 -9.561 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.208 17.576 -10.360 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.833 19.220 -10.087 1.00 1.00 H new ATOM 625 N GLU A 117 -4.999 17.280 -6.201 1.00 1.00 N ATOM 626 CA GLU A 117 -5.559 16.602 -5.029 1.00 1.00 C ATOM 627 C GLU A 117 -6.971 16.051 -5.297 1.00 1.00 C ATOM 628 O GLU A 117 -7.312 14.975 -4.799 1.00 1.00 O ATOM 629 CB GLU A 117 -5.619 17.561 -3.828 1.00 1.00 C ATOM 630 CG GLU A 117 -4.240 17.923 -3.266 1.00 1.00 C ATOM 631 CD GLU A 117 -4.400 18.831 -2.029 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.783 18.326 -0.944 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.168 20.062 -2.130 1.00 1.00 O ATOM 0 H GLU A 117 -4.877 18.285 -6.074 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.898 15.764 -4.807 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.132 18.475 -4.128 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.216 17.105 -3.038 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.698 17.017 -2.995 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -3.649 18.432 -4.028 1.00 1.00 H new ATOM 640 N SER A 118 -7.782 16.745 -6.104 1.00 1.00 N ATOM 641 CA SER A 118 -9.143 16.295 -6.450 1.00 1.00 C ATOM 642 C SER A 118 -9.144 15.029 -7.317 1.00 1.00 C ATOM 643 O SER A 118 -10.055 14.206 -7.209 1.00 1.00 O ATOM 644 CB SER A 118 -9.949 17.390 -7.159 1.00 1.00 C ATOM 645 OG SER A 118 -10.118 18.529 -6.333 1.00 1.00 O ATOM 0 H SER A 118 -7.519 17.631 -6.536 1.00 1.00 H new ATOM 0 HA SER A 118 -9.619 16.062 -5.498 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.441 17.679 -8.079 1.00 1.00 H new ATOM 0 HB3 SER A 118 -10.925 16.998 -7.444 1.00 1.00 H new ATOM 0 HG SER A 118 -9.410 19.180 -6.524 1.00 1.00 H new ATOM 651 N TRP A 119 -8.111 14.838 -8.146 1.00 1.00 N ATOM 652 CA TRP A 119 -7.907 13.621 -8.934 1.00 1.00 C ATOM 653 C TRP A 119 -7.415 12.409 -8.112 1.00 1.00 C ATOM 654 O TRP A 119 -7.359 11.298 -8.648 1.00 1.00 O ATOM 655 CB TRP A 119 -6.886 13.881 -10.051 1.00 1.00 C ATOM 656 CG TRP A 119 -7.046 15.071 -10.953 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.205 15.683 -11.290 1.00 1.00 C ATOM 658 CD2 TRP A 119 -5.997 15.799 -11.670 1.00 1.00 C ATOM 659 NE1 TRP A 119 -7.945 16.758 -12.124 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.596 16.877 -12.389 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.597 15.649 -11.793 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -5.846 17.775 -13.165 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -3.836 16.536 -12.583 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.453 17.602 -13.258 1.00 1.00 C ATOM 0 H TRP A 119 -7.382 15.537 -8.289 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.890 13.370 -9.333 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.905 13.960 -9.582 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.866 12.994 -10.685 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.187 15.379 -10.958 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.661 17.383 -12.495 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.102 14.842 -11.274 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.332 18.588 -13.684 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -2.769 16.394 -12.670 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -3.860 18.287 -13.846 1.00 1.00 H new ATOM 675 N ALA A 120 -7.004 12.589 -6.846 1.00 1.00 N ATOM 676 CA ALA A 120 -6.349 11.545 -6.074 1.00 1.00 C ATOM 677 C ALA A 120 -7.264 10.384 -5.652 1.00 1.00 C ATOM 678 O ALA A 120 -8.500 10.429 -5.682 1.00 1.00 O ATOM 679 CB ALA A 120 -5.638 12.140 -4.847 1.00 1.00 C ATOM 0 H ALA A 120 -7.121 13.466 -6.338 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.618 11.107 -6.753 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.155 11.342 -4.284 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.887 12.859 -5.175 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.368 12.642 -4.212 1.00 1.00 H new ATOM 685 N THR A 121 -6.566 9.364 -5.174 1.00 1.00 N ATOM 686 CA THR A 121 -7.012 8.037 -4.730 1.00 1.00 C ATOM 687 C THR A 121 -6.169 7.638 -3.529 1.00 1.00 C ATOM 688 O THR A 121 -4.974 7.897 -3.517 1.00 1.00 O ATOM 689 CB THR A 121 -6.765 7.029 -5.859 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.504 7.373 -7.015 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.198 5.631 -5.439 1.00 1.00 C ATOM 0 H THR A 121 -5.555 9.450 -5.074 1.00 1.00 H new ATOM 0 HA THR A 121 -8.071 8.054 -4.472 1.00 1.00 H new ATOM 0 HB THR A 121 -5.697 7.049 -6.074 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.329 6.717 -7.722 1.00 1.00 H new ATOM 0 HG21 THR A 121 -7.014 4.932 -6.255 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.630 5.322 -4.562 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.261 5.636 -5.199 1.00 1.00 H new ATOM 699 N LEU A 122 -6.751 6.961 -2.540 1.00 1.00 N ATOM 700 CA LEU A 122 -6.072 6.576 -1.294 1.00 1.00 C ATOM 701 C LEU A 122 -5.786 5.071 -1.302 1.00 1.00 C ATOM 702 O LEU A 122 -6.691 4.248 -1.449 1.00 1.00 O ATOM 703 CB LEU A 122 -6.936 7.045 -0.109 1.00 1.00 C ATOM 704 CG LEU A 122 -6.147 7.285 1.195 1.00 1.00 C ATOM 705 CD1 LEU A 122 -7.085 7.869 2.248 1.00 1.00 C ATOM 706 CD2 LEU A 122 -5.513 6.020 1.774 1.00 1.00 C ATOM 0 H LEU A 122 -7.724 6.657 -2.578 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.100 7.060 -1.197 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.444 7.968 -0.388 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -7.709 6.300 0.079 1.00 1.00 H new ATOM 0 HG LEU A 122 -5.337 7.969 0.941 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -6.533 8.041 3.172 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -7.493 8.814 1.888 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -7.900 7.170 2.437 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -4.976 6.268 2.689 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -6.293 5.292 1.997 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -4.818 5.597 1.049 1.00 1.00 H new ATOM 718 N LEU A 123 -4.504 4.733 -1.149 1.00 1.00 N ATOM 719 CA LEU A 123 -3.942 3.390 -1.232 1.00 1.00 C ATOM 720 C LEU A 123 -3.203 3.033 0.070 1.00 1.00 C ATOM 721 O LEU A 123 -2.467 3.834 0.649 1.00 1.00 O ATOM 722 CB LEU A 123 -2.993 3.332 -2.444 1.00 1.00 C ATOM 723 CG LEU A 123 -3.630 3.684 -3.797 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.552 3.563 -4.868 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.783 2.757 -4.187 1.00 1.00 C ATOM 0 H LEU A 123 -3.790 5.435 -0.952 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.740 2.659 -1.362 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.161 4.013 -2.265 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.575 2.328 -2.509 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.036 4.692 -3.712 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -2.977 3.808 -5.841 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.738 4.252 -4.644 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -2.169 2.542 -4.885 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.186 3.063 -5.152 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.419 1.732 -4.254 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.567 2.814 -3.432 1.00 1.00 H new ATOM 737 N GLY A 124 -3.417 1.799 0.518 1.00 1.00 N ATOM 738 CA GLY A 124 -2.814 1.243 1.736 1.00 1.00 C ATOM 739 C GLY A 124 -1.279 1.125 1.695 1.00 1.00 C ATOM 740 O GLY A 124 -0.665 1.094 0.623 1.00 1.00 O ATOM 0 H GLY A 124 -4.028 1.139 0.037 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -3.095 1.869 2.583 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -3.237 0.255 1.916 1.00 1.00 H new ATOM 744 N HIS A 125 -0.663 1.045 2.884 1.00 1.00 N ATOM 745 CA HIS A 125 0.784 0.890 3.108 1.00 1.00 C ATOM 746 C HIS A 125 1.055 0.198 4.461 1.00 1.00 C ATOM 747 O HIS A 125 1.696 -0.878 4.462 1.00 1.00 O ATOM 748 CB HIS A 125 1.465 2.264 3.013 1.00 1.00 C ATOM 749 CG HIS A 125 2.934 2.304 3.373 1.00 1.00 C ATOM 750 ND1 HIS A 125 3.584 3.377 3.961 1.00 1.00 N ATOM 751 CD2 HIS A 125 3.861 1.313 3.194 1.00 1.00 C ATOM 752 CE1 HIS A 125 4.875 3.036 4.166 1.00 1.00 C ATOM 753 NE2 HIS A 125 5.064 1.783 3.700 1.00 1.00 N ATOM 0 H HIS A 125 -1.185 1.089 3.759 1.00 1.00 H new ATOM 0 HA HIS A 125 1.208 0.248 2.336 1.00 1.00 H new ATOM 0 HB2 HIS A 125 1.351 2.634 1.994 1.00 1.00 H new ATOM 0 HB3 HIS A 125 0.933 2.957 3.665 1.00 1.00 H new ATOM 0 HD1 HIS A 125 3.159 4.273 4.199 1.00 1.00 H new ATOM 0 HD2 HIS A 125 3.688 0.347 2.743 1.00 1.00 H new ATOM 0 HE1 HIS A 125 5.628 3.660 4.625 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.693 27.747 6.565 1.00 1.00 O ATOM 764 C5' DC B 1 -3.865 28.871 7.437 1.00 1.00 C ATOM 765 C4' DC B 1 -3.065 28.786 8.754 1.00 1.00 C ATOM 766 O4' DC B 1 -3.574 27.760 9.598 1.00 1.00 O ATOM 767 C3' DC B 1 -1.572 28.534 8.504 1.00 1.00 C ATOM 768 O3' DC B 1 -0.782 29.461 9.253 1.00 1.00 O ATOM 769 C2' DC B 1 -1.401 27.079 8.922 1.00 1.00 C ATOM 770 C1' DC B 1 -2.535 26.848 9.920 1.00 1.00 C ATOM 771 N1 DC B 1 -3.079 25.469 9.900 1.00 1.00 N ATOM 772 C2 DC B 1 -3.262 24.755 11.090 1.00 1.00 C ATOM 773 O2 DC B 1 -2.923 25.204 12.185 1.00 1.00 O ATOM 774 N3 DC B 1 -3.830 23.522 11.076 1.00 1.00 N ATOM 775 C4 DC B 1 -4.164 23.004 9.908 1.00 1.00 C ATOM 776 N4 DC B 1 -4.734 21.833 9.953 1.00 1.00 N ATOM 777 C5 DC B 1 -3.991 23.680 8.667 1.00 1.00 C ATOM 778 C6 DC B 1 -3.450 24.916 8.712 1.00 1.00 C ATOM 0 H5' DC B 1 -4.924 28.971 7.675 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.571 29.776 6.905 1.00 1.00 H new ATOM 0 H4' DC B 1 -3.178 29.752 9.246 1.00 1.00 H new ATOM 0 H3' DC B 1 -1.243 28.686 7.476 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.477 26.406 8.068 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.426 26.906 9.378 1.00 1.00 H new ATOM 0 HO5' DC B 1 -4.232 27.875 5.756 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.135 27.001 10.922 1.00 1.00 H new ATOM 0 H41 DC B 1 -5.020 21.371 9.089 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.895 21.378 10.852 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.280 23.224 7.731 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.310 25.472 7.797 1.00 1.00 H new ATOM 791 P DG B 2 0.840 29.509 9.176 1.00 1.00 P ATOM 792 OP1 DG B 2 1.263 30.894 9.522 1.00 1.00 O ATOM 793 OP2 DG B 2 1.276 28.943 7.869 1.00 1.00 O ATOM 794 O5' DG B 2 1.330 28.504 10.356 1.00 1.00 O ATOM 795 C5' DG B 2 1.160 28.840 11.733 1.00 1.00 C ATOM 796 C4' DG B 2 1.717 27.792 12.722 1.00 1.00 C ATOM 797 O4' DG B 2 0.855 26.655 12.811 1.00 1.00 O ATOM 798 C3' DG B 2 3.132 27.299 12.361 1.00 1.00 C ATOM 799 O3' DG B 2 3.958 27.306 13.526 1.00 1.00 O ATOM 800 C2' DG B 2 2.825 25.909 11.801 1.00 1.00 C ATOM 801 C1' DG B 2 1.629 25.478 12.648 1.00 1.00 C ATOM 802 N9 DG B 2 0.815 24.423 12.009 1.00 1.00 N ATOM 803 C8 DG B 2 0.387 24.380 10.712 1.00 1.00 C ATOM 804 N7 DG B 2 -0.371 23.357 10.420 1.00 1.00 N ATOM 805 C5 DG B 2 -0.419 22.640 11.625 1.00 1.00 C ATOM 806 C6 DG B 2 -1.071 21.402 11.975 1.00 1.00 C ATOM 807 O6 DG B 2 -1.820 20.696 11.302 1.00 1.00 O ATOM 808 N1 DG B 2 -0.796 20.975 13.255 1.00 1.00 N ATOM 809 C2 DG B 2 -0.033 21.671 14.129 1.00 1.00 C ATOM 810 N2 DG B 2 0.138 21.130 15.306 1.00 1.00 N ATOM 811 N3 DG B 2 0.555 22.839 13.875 1.00 1.00 N ATOM 812 C4 DG B 2 0.333 23.272 12.596 1.00 1.00 C ATOM 0 H5' DG B 2 0.097 28.979 11.931 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.648 29.796 11.924 1.00 1.00 H new ATOM 0 H4' DG B 2 1.771 28.308 13.681 1.00 1.00 H new ATOM 0 H3' DG B 2 3.693 27.906 11.650 1.00 1.00 H new ATOM 0 H2' DG B 2 2.581 25.942 10.739 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.670 25.229 11.913 1.00 1.00 H new ATOM 0 H1' DG B 2 1.968 25.048 13.590 1.00 1.00 H new ATOM 0 H8 DG B 2 0.654 25.133 9.985 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.189 20.085 13.561 1.00 1.00 H new ATOM 0 H21 DG B 2 0.703 21.606 16.009 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.294 20.231 15.522 1.00 1.00 H new ATOM 824 P DC B 3 5.517 26.842 13.515 1.00 1.00 P ATOM 825 OP1 DC B 3 6.243 27.669 14.521 1.00 1.00 O ATOM 826 OP2 DC B 3 6.024 26.830 12.115 1.00 1.00 O ATOM 827 O5' DC B 3 5.449 25.312 14.050 1.00 1.00 O ATOM 828 C5' DC B 3 5.061 25.031 15.396 1.00 1.00 C ATOM 829 C4' DC B 3 4.964 23.532 15.723 1.00 1.00 C ATOM 830 O4' DC B 3 3.885 22.948 15.006 1.00 1.00 O ATOM 831 C3' DC B 3 6.256 22.751 15.428 1.00 1.00 C ATOM 832 O3' DC B 3 6.817 22.262 16.648 1.00 1.00 O ATOM 833 C2' DC B 3 5.796 21.638 14.487 1.00 1.00 C ATOM 834 C1' DC B 3 4.269 21.665 14.556 1.00 1.00 C ATOM 835 N1 DC B 3 3.642 21.413 13.236 1.00 1.00 N ATOM 836 C2 DC B 3 2.853 20.274 13.039 1.00 1.00 C ATOM 837 O2 DC B 3 2.708 19.415 13.911 1.00 1.00 O ATOM 838 N3 DC B 3 2.208 20.072 11.866 1.00 1.00 N ATOM 839 C4 DC B 3 2.377 20.956 10.907 1.00 1.00 C ATOM 840 N4 DC B 3 1.712 20.716 9.812 1.00 1.00 N ATOM 841 C5 DC B 3 3.192 22.118 11.028 1.00 1.00 C ATOM 842 C6 DC B 3 3.815 22.312 12.220 1.00 1.00 C ATOM 0 H5' DC B 3 4.095 25.497 15.589 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.779 25.494 16.073 1.00 1.00 H new ATOM 0 H4' DC B 3 4.794 23.465 16.798 1.00 1.00 H new ATOM 0 H3' DC B 3 7.048 23.346 14.973 1.00 1.00 H new ATOM 0 H2' DC B 3 6.148 21.811 13.470 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.188 20.670 14.800 1.00 1.00 H new ATOM 0 H1' DC B 3 3.936 20.877 15.231 1.00 1.00 H new ATOM 0 H41 DC B 3 1.788 21.353 9.019 1.00 1.00 H new ATOM 0 H42 DC B 3 1.116 19.891 9.748 1.00 1.00 H new ATOM 0 H5 DC B 3 3.309 22.813 10.210 1.00 1.00 H new ATOM 0 H6 DC B 3 4.447 23.176 12.365 1.00 1.00 H new ATOM 854 P DA B 4 8.281 21.557 16.726 1.00 1.00 P ATOM 855 OP1 DA B 4 8.729 21.593 18.147 1.00 1.00 O ATOM 856 OP2 DA B 4 9.164 22.168 15.691 1.00 1.00 O ATOM 857 O5' DA B 4 8.010 20.013 16.313 1.00 1.00 O ATOM 858 C5' DA B 4 7.194 19.170 17.121 1.00 1.00 C ATOM 859 C4' DA B 4 6.895 17.799 16.490 1.00 1.00 C ATOM 860 O4' DA B 4 5.937 17.897 15.438 1.00 1.00 O ATOM 861 C3' DA B 4 8.147 17.077 15.946 1.00 1.00 C ATOM 862 O3' DA B 4 8.275 15.792 16.554 1.00 1.00 O ATOM 863 C2' DA B 4 7.856 17.050 14.445 1.00 1.00 C ATOM 864 C1' DA B 4 6.333 17.011 14.406 1.00 1.00 C ATOM 865 N9 DA B 4 5.800 17.493 13.120 1.00 1.00 N ATOM 866 C8 DA B 4 6.118 18.667 12.501 1.00 1.00 C ATOM 867 N7 DA B 4 5.447 18.908 11.406 1.00 1.00 N ATOM 868 C5 DA B 4 4.659 17.752 11.278 1.00 1.00 C ATOM 869 C6 DA B 4 3.717 17.290 10.330 1.00 1.00 C ATOM 870 N6 DA B 4 3.330 17.990 9.287 1.00 1.00 N ATOM 871 N1 DA B 4 3.151 16.083 10.423 1.00 1.00 N ATOM 872 C2 DA B 4 3.484 15.340 11.468 1.00 1.00 C ATOM 873 N3 DA B 4 4.329 15.635 12.452 1.00 1.00 N ATOM 874 C4 DA B 4 4.889 16.869 12.299 1.00 1.00 C ATOM 0 H5' DA B 4 6.252 19.679 17.323 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.686 19.017 18.081 1.00 1.00 H new ATOM 0 H4' DA B 4 6.493 17.205 17.310 1.00 1.00 H new ATOM 0 H3' DA B 4 9.105 17.551 16.160 1.00 1.00 H new ATOM 0 H2' DA B 4 8.253 17.930 13.939 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.297 16.178 13.962 1.00 1.00 H new ATOM 0 H1' DA B 4 5.961 15.994 14.530 1.00 1.00 H new ATOM 0 H8 DA B 4 6.866 19.344 12.886 1.00 1.00 H new ATOM 0 H61 DA B 4 2.646 17.602 8.637 1.00 1.00 H new ATOM 0 H62 DA B 4 3.714 18.921 9.127 1.00 1.00 H new ATOM 0 H2 DA B 4 3.009 14.372 11.529 1.00 1.00 H new ATOM 886 P DT B 5 9.584 14.851 16.344 1.00 1.00 P ATOM 887 OP1 DT B 5 9.690 13.940 17.519 1.00 1.00 O ATOM 888 OP2 DT B 5 10.758 15.704 16.008 1.00 1.00 O ATOM 889 O5' DT B 5 9.208 13.968 15.038 1.00 1.00 O ATOM 890 C5' DT B 5 8.152 13.012 15.087 1.00 1.00 C ATOM 891 C4' DT B 5 7.874 12.335 13.737 1.00 1.00 C ATOM 892 O4' DT B 5 7.232 13.237 12.839 1.00 1.00 O ATOM 893 C3' DT B 5 9.136 11.769 13.057 1.00 1.00 C ATOM 894 O3' DT B 5 8.962 10.377 12.822 1.00 1.00 O ATOM 895 C2' DT B 5 9.228 12.635 11.798 1.00 1.00 C ATOM 896 C1' DT B 5 7.770 13.027 11.549 1.00 1.00 C ATOM 897 N1 DT B 5 7.570 14.251 10.724 1.00 1.00 N ATOM 898 C2 DT B 5 6.618 14.200 9.695 1.00 1.00 C ATOM 899 O2 DT B 5 6.031 13.172 9.368 1.00 1.00 O ATOM 900 N3 DT B 5 6.354 15.364 9.015 1.00 1.00 N ATOM 901 C4 DT B 5 7.012 16.555 9.206 1.00 1.00 C ATOM 902 O4 DT B 5 6.687 17.521 8.523 1.00 1.00 O ATOM 903 C5 DT B 5 8.058 16.527 10.230 1.00 1.00 C ATOM 904 C7 DT B 5 8.919 17.750 10.481 1.00 1.00 C ATOM 905 C6 DT B 5 8.286 15.407 10.961 1.00 1.00 C ATOM 0 H5' DT B 5 7.243 13.505 15.431 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.399 12.247 15.824 1.00 1.00 H new ATOM 0 H4' DT B 5 7.220 11.494 13.966 1.00 1.00 H new ATOM 0 H3' DT B 5 10.061 11.817 13.631 1.00 1.00 H new ATOM 0 H2' DT B 5 9.861 13.509 11.953 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.648 12.083 10.957 1.00 1.00 H new ATOM 0 H1' DT B 5 7.286 12.238 10.973 1.00 1.00 H new ATOM 0 H3 DT B 5 5.613 15.343 8.315 1.00 1.00 H new ATOM 0 H71 DT B 5 9.228 17.769 11.526 1.00 1.00 H new ATOM 0 H72 DT B 5 9.801 17.711 9.842 1.00 1.00 H new ATOM 0 H73 DT B 5 8.347 18.650 10.256 1.00 1.00 H new ATOM 0 H6 DT B 5 9.037 15.420 11.737 1.00 1.00 H new ATOM 918 P DA B 6 10.065 9.451 12.071 1.00 1.00 P ATOM 919 OP1 DA B 6 10.079 8.114 12.734 1.00 1.00 O ATOM 920 OP2 DA B 6 11.352 10.191 11.942 1.00 1.00 O ATOM 921 O5' DA B 6 9.404 9.299 10.600 1.00 1.00 O ATOM 922 C5' DA B 6 8.154 8.631 10.439 1.00 1.00 C ATOM 923 C4' DA B 6 7.643 8.558 8.993 1.00 1.00 C ATOM 924 O4' DA B 6 7.260 9.853 8.531 1.00 1.00 O ATOM 925 C3' DA B 6 8.662 7.965 8.007 1.00 1.00 C ATOM 926 O3' DA B 6 7.974 7.066 7.143 1.00 1.00 O ATOM 927 C2' DA B 6 9.218 9.229 7.362 1.00 1.00 C ATOM 928 C1' DA B 6 8.024 10.180 7.381 1.00 1.00 C ATOM 929 N9 DA B 6 8.424 11.598 7.437 1.00 1.00 N ATOM 930 C8 DA B 6 9.434 12.164 8.170 1.00 1.00 C ATOM 931 N7 DA B 6 9.598 13.449 7.985 1.00 1.00 N ATOM 932 C5 DA B 6 8.617 13.739 7.027 1.00 1.00 C ATOM 933 C6 DA B 6 8.221 14.906 6.331 1.00 1.00 C ATOM 934 N6 DA B 6 8.777 16.095 6.477 1.00 1.00 N ATOM 935 N1 DA B 6 7.239 14.872 5.434 1.00 1.00 N ATOM 936 C2 DA B 6 6.634 13.716 5.213 1.00 1.00 C ATOM 937 N3 DA B 6 6.871 12.547 5.796 1.00 1.00 N ATOM 938 C4 DA B 6 7.891 12.624 6.696 1.00 1.00 C ATOM 0 H5' DA B 6 7.406 9.138 11.048 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.247 7.617 10.828 1.00 1.00 H new ATOM 0 H4' DA B 6 6.785 7.887 9.021 1.00 1.00 H new ATOM 0 H3' DA B 6 9.473 7.359 8.410 1.00 1.00 H new ATOM 0 H2' DA B 6 10.062 9.630 7.923 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.569 9.043 6.347 1.00 1.00 H new ATOM 0 H1' DA B 6 7.456 10.060 6.459 1.00 1.00 H new ATOM 0 H8 DA B 6 10.049 11.592 8.850 1.00 1.00 H new ATOM 0 H61 DA B 6 8.433 16.889 5.937 1.00 1.00 H new ATOM 0 H62 DA B 6 9.551 16.219 7.130 1.00 1.00 H new ATOM 0 H2 DA B 6 5.852 13.725 4.468 1.00 1.00 H new ATOM 950 P DT B 7 8.692 6.257 5.937 1.00 1.00 P ATOM 951 OP1 DT B 7 7.880 5.041 5.651 1.00 1.00 O ATOM 952 OP2 DT B 7 10.147 6.096 6.227 1.00 1.00 O ATOM 953 O5' DT B 7 8.511 7.291 4.711 1.00 1.00 O ATOM 954 C5' DT B 7 7.206 7.676 4.302 1.00 1.00 C ATOM 955 C4' DT B 7 7.202 8.834 3.304 1.00 1.00 C ATOM 956 O4' DT B 7 7.699 10.015 3.910 1.00 1.00 O ATOM 957 C3' DT B 7 8.019 8.561 2.031 1.00 1.00 C ATOM 958 O3' DT B 7 7.184 8.757 0.896 1.00 1.00 O ATOM 959 C2' DT B 7 9.105 9.623 2.128 1.00 1.00 C ATOM 960 C1' DT B 7 8.370 10.718 2.891 1.00 1.00 C ATOM 961 N1 DT B 7 9.279 11.740 3.460 1.00 1.00 N ATOM 962 C2 DT B 7 9.127 13.069 3.050 1.00 1.00 C ATOM 963 O2 DT B 7 8.329 13.447 2.193 1.00 1.00 O ATOM 964 N3 DT B 7 9.943 13.992 3.652 1.00 1.00 N ATOM 965 C4 DT B 7 10.946 13.722 4.545 1.00 1.00 C ATOM 966 O4 DT B 7 11.613 14.671 4.960 1.00 1.00 O ATOM 967 C5 DT B 7 11.098 12.305 4.888 1.00 1.00 C ATOM 968 C7 DT B 7 12.187 11.868 5.851 1.00 1.00 C ATOM 969 C6 DT B 7 10.269 11.372 4.344 1.00 1.00 C ATOM 0 H5' DT B 7 6.627 7.961 5.180 1.00 1.00 H new ATOM 0 H5'' DT B 7 6.705 6.818 3.854 1.00 1.00 H new ATOM 0 H4' DT B 7 6.160 8.954 3.007 1.00 1.00 H new ATOM 0 H3' DT B 7 8.422 7.553 1.937 1.00 1.00 H new ATOM 0 H2' DT B 7 9.985 9.266 2.663 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.443 9.959 1.148 1.00 1.00 H new ATOM 0 H1' DT B 7 7.705 11.285 2.239 1.00 1.00 H new ATOM 0 H3 DT B 7 9.789 14.971 3.412 1.00 1.00 H new ATOM 0 H71 DT B 7 11.861 10.978 6.390 1.00 1.00 H new ATOM 0 H72 DT B 7 13.096 11.642 5.294 1.00 1.00 H new ATOM 0 H73 DT B 7 12.387 12.670 6.562 1.00 1.00 H new ATOM 0 H6 DT B 7 10.389 10.332 4.609 1.00 1.00 H new ATOM 982 P DA B 8 7.468 8.071 -0.530 1.00 1.00 P ATOM 983 OP1 DA B 8 6.177 8.058 -1.263 1.00 1.00 O ATOM 984 OP2 DA B 8 8.136 6.762 -0.298 1.00 1.00 O ATOM 985 O5' DA B 8 8.482 9.069 -1.269 1.00 1.00 O ATOM 986 C5' DA B 8 7.990 10.187 -1.992 1.00 1.00 C ATOM 987 C4' DA B 8 9.079 11.142 -2.502 1.00 1.00 C ATOM 988 O4' DA B 8 9.503 12.003 -1.458 1.00 1.00 O ATOM 989 C3' DA B 8 10.329 10.458 -3.098 1.00 1.00 C ATOM 990 O3' DA B 8 10.390 10.657 -4.510 1.00 1.00 O ATOM 991 C2' DA B 8 11.473 11.127 -2.330 1.00 1.00 C ATOM 992 C1' DA B 8 10.836 12.369 -1.726 1.00 1.00 C ATOM 993 N9 DA B 8 11.466 12.801 -0.460 1.00 1.00 N ATOM 994 C8 DA B 8 11.713 12.083 0.689 1.00 1.00 C ATOM 995 N7 DA B 8 12.256 12.778 1.658 1.00 1.00 N ATOM 996 C5 DA B 8 12.373 14.058 1.096 1.00 1.00 C ATOM 997 C6 DA B 8 12.843 15.326 1.532 1.00 1.00 C ATOM 998 N6 DA B 8 13.271 15.628 2.746 1.00 1.00 N ATOM 999 N1 DA B 8 12.821 16.385 0.728 1.00 1.00 N ATOM 1000 C2 DA B 8 12.331 16.231 -0.487 1.00 1.00 C ATOM 1001 N3 DA B 8 11.847 15.133 -1.042 1.00 1.00 N ATOM 1002 C4 DA B 8 11.905 14.072 -0.193 1.00 1.00 C ATOM 0 H5' DA B 8 7.305 10.745 -1.353 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.411 9.828 -2.843 1.00 1.00 H new ATOM 0 H4' DA B 8 8.603 11.688 -3.316 1.00 1.00 H new ATOM 0 H3' DA B 8 10.350 9.374 -2.989 1.00 1.00 H new ATOM 0 H2' DA B 8 11.874 10.469 -1.559 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.300 11.384 -2.991 1.00 1.00 H new ATOM 0 H1' DA B 8 10.944 13.204 -2.418 1.00 1.00 H new ATOM 0 H8 DA B 8 11.478 11.033 0.784 1.00 1.00 H new ATOM 0 H61 DA B 8 13.588 16.575 2.954 1.00 1.00 H new ATOM 0 H62 DA B 8 13.284 14.914 3.474 1.00 1.00 H new ATOM 0 H2 DA B 8 12.324 17.115 -1.108 1.00 1.00 H new ATOM 1014 P DT B 9 11.623 10.092 -5.421 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.046 9.566 -6.687 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.513 9.208 -4.617 1.00 1.00 O ATOM 1017 O5' DT B 9 12.399 11.469 -5.743 1.00 1.00 O ATOM 1018 C5' DT B 9 11.739 12.507 -6.462 1.00 1.00 C ATOM 1019 C4' DT B 9 12.598 13.760 -6.679 1.00 1.00 C ATOM 1020 O4' DT B 9 12.791 14.438 -5.447 1.00 1.00 O ATOM 1021 C3' DT B 9 13.961 13.439 -7.307 1.00 1.00 C ATOM 1022 O3' DT B 9 14.176 14.282 -8.435 1.00 1.00 O ATOM 1023 C2' DT B 9 14.913 13.664 -6.139 1.00 1.00 C ATOM 1024 C1' DT B 9 14.170 14.664 -5.249 1.00 1.00 C ATOM 1025 N1 DT B 9 14.487 14.529 -3.804 1.00 1.00 N ATOM 1026 C2 DT B 9 14.810 15.691 -3.088 1.00 1.00 C ATOM 1027 O2 DT B 9 14.789 16.830 -3.566 1.00 1.00 O ATOM 1028 N3 DT B 9 15.169 15.527 -1.770 1.00 1.00 N ATOM 1029 C4 DT B 9 15.200 14.330 -1.092 1.00 1.00 C ATOM 1030 O4 DT B 9 15.482 14.340 0.103 1.00 1.00 O ATOM 1031 C5 DT B 9 14.847 13.157 -1.890 1.00 1.00 C ATOM 1032 C7 DT B 9 14.881 11.778 -1.261 1.00 1.00 C ATOM 1033 C6 DT B 9 14.485 13.292 -3.191 1.00 1.00 C ATOM 0 H5' DT B 9 10.834 12.788 -5.924 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.426 12.121 -7.432 1.00 1.00 H new ATOM 0 H4' DT B 9 12.057 14.398 -7.378 1.00 1.00 H new ATOM 0 H3' DT B 9 14.080 12.435 -7.714 1.00 1.00 H new ATOM 0 H2' DT B 9 15.122 12.735 -5.609 1.00 1.00 H new ATOM 0 H2'' DT B 9 15.871 14.062 -6.475 1.00 1.00 H new ATOM 0 H1' DT B 9 14.480 15.671 -5.529 1.00 1.00 H new ATOM 0 H3 DT B 9 15.435 16.364 -1.251 1.00 1.00 H new ATOM 0 H71 DT B 9 14.139 11.141 -1.741 1.00 1.00 H new ATOM 0 H72 DT B 9 15.872 11.343 -1.392 1.00 1.00 H new ATOM 0 H73 DT B 9 14.657 11.858 -0.197 1.00 1.00 H new ATOM 0 H6 DT B 9 14.191 12.419 -3.755 1.00 1.00 H new ATOM 1046 P DG B 10 15.528 14.227 -9.329 1.00 1.00 P ATOM 1047 OP1 DG B 10 15.189 14.691 -10.702 1.00 1.00 O ATOM 1048 OP2 DG B 10 16.192 12.904 -9.166 1.00 1.00 O ATOM 1049 O5' DG B 10 16.440 15.360 -8.621 1.00 1.00 O ATOM 1050 C5' DG B 10 16.026 16.724 -8.601 1.00 1.00 C ATOM 1051 C4' DG B 10 16.986 17.651 -7.838 1.00 1.00 C ATOM 1052 O4' DG B 10 16.889 17.436 -6.430 1.00 1.00 O ATOM 1053 C3' DG B 10 18.456 17.470 -8.264 1.00 1.00 C ATOM 1054 O3' DG B 10 19.038 18.747 -8.528 1.00 1.00 O ATOM 1055 C2' DG B 10 19.031 16.750 -7.046 1.00 1.00 C ATOM 1056 C1' DG B 10 18.205 17.344 -5.909 1.00 1.00 C ATOM 1057 N9 DG B 10 18.221 16.517 -4.687 1.00 1.00 N ATOM 1058 C8 DG B 10 18.021 15.168 -4.599 1.00 1.00 C ATOM 1059 N7 DG B 10 18.062 14.686 -3.386 1.00 1.00 N ATOM 1060 C5 DG B 10 18.358 15.815 -2.606 1.00 1.00 C ATOM 1061 C6 DG B 10 18.572 15.964 -1.188 1.00 1.00 C ATOM 1062 O6 DG B 10 18.473 15.123 -0.292 1.00 1.00 O ATOM 1063 N1 DG B 10 18.953 17.233 -0.818 1.00 1.00 N ATOM 1064 C2 DG B 10 19.072 18.261 -1.688 1.00 1.00 C ATOM 1065 N2 DG B 10 19.464 19.399 -1.184 1.00 1.00 N ATOM 1066 N3 DG B 10 18.835 18.196 -2.998 1.00 1.00 N ATOM 1067 C4 DG B 10 18.491 16.935 -3.403 1.00 1.00 C ATOM 0 H5' DG B 10 15.037 16.787 -8.147 1.00 1.00 H new ATOM 0 H5'' DG B 10 15.930 17.080 -9.627 1.00 1.00 H new ATOM 0 H4' DG B 10 16.681 18.667 -8.087 1.00 1.00 H new ATOM 0 H3' DG B 10 18.632 16.911 -9.183 1.00 1.00 H new ATOM 0 H2' DG B 10 18.911 15.669 -7.116 1.00 1.00 H new ATOM 0 H2'' DG B 10 20.096 16.945 -6.922 1.00 1.00 H new ATOM 0 H1' DG B 10 18.613 18.306 -5.600 1.00 1.00 H new ATOM 0 H8 DG B 10 17.843 14.548 -5.466 1.00 1.00 H new ATOM 0 H1 DG B 10 19.157 17.408 0.166 1.00 1.00 H new ATOM 0 H21 DG B 10 19.573 20.214 -1.788 1.00 1.00 H new ATOM 0 H22 DG B 10 19.661 19.474 -0.186 1.00 1.00 H new ATOM 1079 P DC B 11 20.533 18.936 -9.137 1.00 1.00 P ATOM 1080 OP1 DC B 11 20.458 19.949 -10.229 1.00 1.00 O ATOM 1081 OP2 DC B 11 21.121 17.604 -9.451 1.00 1.00 O ATOM 1082 O5' DC B 11 21.355 19.574 -7.892 1.00 1.00 O ATOM 1083 C5' DC B 11 21.026 20.870 -7.384 1.00 1.00 C ATOM 1084 C4' DC B 11 21.910 21.339 -6.214 1.00 1.00 C ATOM 1085 O4' DC B 11 21.648 20.558 -5.052 1.00 1.00 O ATOM 1086 C3' DC B 11 23.416 21.273 -6.530 1.00 1.00 C ATOM 1087 O3' DC B 11 24.066 22.465 -6.083 1.00 1.00 O ATOM 1088 C2' DC B 11 23.836 20.004 -5.789 1.00 1.00 C ATOM 1089 C1' DC B 11 22.849 19.947 -4.619 1.00 1.00 C ATOM 1090 N1 DC B 11 22.546 18.584 -4.109 1.00 1.00 N ATOM 1091 C2 DC B 11 22.580 18.327 -2.731 1.00 1.00 C ATOM 1092 O2 DC B 11 22.941 19.172 -1.910 1.00 1.00 O ATOM 1093 N3 DC B 11 22.217 17.115 -2.244 1.00 1.00 N ATOM 1094 C4 DC B 11 21.835 16.191 -3.099 1.00 1.00 C ATOM 1095 N4 DC B 11 21.449 15.063 -2.575 1.00 1.00 N ATOM 1096 C5 DC B 11 21.809 16.374 -4.506 1.00 1.00 C ATOM 1097 C6 DC B 11 22.170 17.596 -4.973 1.00 1.00 C ATOM 0 H5' DC B 11 19.986 20.866 -7.058 1.00 1.00 H new ATOM 0 H5'' DC B 11 21.103 21.595 -8.195 1.00 1.00 H new ATOM 0 H4' DC B 11 21.654 22.384 -6.040 1.00 1.00 H new ATOM 0 H3' DC B 11 23.678 21.224 -7.587 1.00 1.00 H new ATOM 0 H2' DC B 11 23.760 19.122 -6.424 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.868 20.061 -5.444 1.00 1.00 H new ATOM 0 H1' DC B 11 23.319 20.463 -3.782 1.00 1.00 H new ATOM 0 H41 DC B 11 21.139 14.300 -3.177 1.00 1.00 H new ATOM 0 H42 DC B 11 21.457 14.942 -1.562 1.00 1.00 H new ATOM 0 H5 DC B 11 21.516 15.578 -5.174 1.00 1.00 H new ATOM 0 H6 DC B 11 22.160 17.788 -6.036 1.00 1.00 H new ATOM 1109 P DG B 12 25.605 22.826 -6.473 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.803 24.287 -6.246 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.907 22.275 -7.824 1.00 1.00 O ATOM 1112 O5' DG B 12 26.496 22.018 -5.389 1.00 1.00 O ATOM 1113 C5' DG B 12 26.517 22.407 -4.019 1.00 1.00 C ATOM 1114 C4' DG B 12 27.068 21.315 -3.090 1.00 1.00 C ATOM 1115 O4' DG B 12 26.157 20.233 -2.971 1.00 1.00 O ATOM 1116 C3' DG B 12 28.415 20.702 -3.518 1.00 1.00 C ATOM 1117 O3' DG B 12 29.537 21.344 -2.913 1.00 1.00 O ATOM 1118 C2' DG B 12 28.309 19.254 -3.036 1.00 1.00 C ATOM 1119 C1' DG B 12 26.891 19.136 -2.464 1.00 1.00 C ATOM 1120 N9 DG B 12 26.233 17.870 -2.840 1.00 1.00 N ATOM 1121 C8 DG B 12 25.962 17.411 -4.098 1.00 1.00 C ATOM 1122 N7 DG B 12 25.407 16.226 -4.131 1.00 1.00 N ATOM 1123 C5 DG B 12 25.318 15.868 -2.776 1.00 1.00 C ATOM 1124 C6 DG B 12 24.822 14.684 -2.118 1.00 1.00 C ATOM 1125 O6 DG B 12 24.331 13.657 -2.592 1.00 1.00 O ATOM 1126 N1 DG B 12 24.932 14.732 -0.747 1.00 1.00 N ATOM 1127 C2 DG B 12 25.479 15.764 -0.065 1.00 1.00 C ATOM 1128 N2 DG B 12 25.568 15.637 1.230 1.00 1.00 N ATOM 1129 N3 DG B 12 25.948 16.877 -0.618 1.00 1.00 N ATOM 1130 C4 DG B 12 25.831 16.875 -1.982 1.00 1.00 C ATOM 0 H5' DG B 12 25.506 22.666 -3.706 1.00 1.00 H new ATOM 0 H5'' DG B 12 27.124 23.306 -3.912 1.00 1.00 H new ATOM 0 H4' DG B 12 27.217 21.844 -2.149 1.00 1.00 H new ATOM 0 H3' DG B 12 28.581 20.806 -4.590 1.00 1.00 H new ATOM 0 H2' DG B 12 28.465 18.552 -3.855 1.00 1.00 H new ATOM 0 H2'' DG B 12 29.061 19.033 -2.279 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.363 20.914 -3.218 1.00 1.00 H new ATOM 0 H1' DG B 12 26.936 19.142 -1.375 1.00 1.00 H new ATOM 0 H8 DG B 12 26.187 17.978 -4.989 1.00 1.00 H new ATOM 0 H1 DG B 12 24.579 13.939 -0.211 1.00 1.00 H new ATOM 0 H21 DG B 12 25.973 16.388 1.789 1.00 1.00 H new ATOM 0 H22 DG B 12 25.233 14.787 1.683 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.561 8.049 5.283 1.00 1.00 O ATOM 1145 C5' DC C 13 23.891 8.167 5.806 1.00 1.00 C ATOM 1146 C4' DC C 13 24.437 9.609 5.823 1.00 1.00 C ATOM 1147 O4' DC C 13 24.609 10.106 4.496 1.00 1.00 O ATOM 1148 C3' DC C 13 23.508 10.562 6.586 1.00 1.00 C ATOM 1149 O3' DC C 13 24.257 11.401 7.469 1.00 1.00 O ATOM 1150 C2' DC C 13 22.828 11.323 5.448 1.00 1.00 C ATOM 1151 C1' DC C 13 23.931 11.349 4.388 1.00 1.00 C ATOM 1152 N1 DC C 13 23.481 11.558 2.987 1.00 1.00 N ATOM 1153 C2 DC C 13 24.139 12.488 2.170 1.00 1.00 C ATOM 1154 O2 DC C 13 25.021 13.233 2.599 1.00 1.00 O ATOM 1155 N3 DC C 13 23.830 12.600 0.854 1.00 1.00 N ATOM 1156 C4 DC C 13 22.864 11.844 0.372 1.00 1.00 C ATOM 1157 N4 DC C 13 22.640 11.958 -0.907 1.00 1.00 N ATOM 1158 C5 DC C 13 22.141 10.901 1.158 1.00 1.00 C ATOM 1159 C6 DC C 13 22.485 10.788 2.462 1.00 1.00 C ATOM 0 H5' DC C 13 24.560 7.544 5.212 1.00 1.00 H new ATOM 0 H5'' DC C 13 23.906 7.772 6.822 1.00 1.00 H new ATOM 0 H4' DC C 13 25.400 9.570 6.332 1.00 1.00 H new ATOM 0 H3' DC C 13 22.788 10.074 7.243 1.00 1.00 H new ATOM 0 H2' DC C 13 21.932 10.814 5.093 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.526 12.326 5.749 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.284 7.109 5.302 1.00 1.00 H new ATOM 0 H1' DC C 13 24.561 12.216 4.588 1.00 1.00 H new ATOM 0 H41 DC C 13 21.907 11.403 -1.348 1.00 1.00 H new ATOM 0 H42 DC C 13 23.198 12.603 -1.467 1.00 1.00 H new ATOM 0 H5 DC C 13 21.351 10.301 0.731 1.00 1.00 H new ATOM 0 H6 DC C 13 21.966 10.082 3.093 1.00 1.00 H new ATOM 1172 P DG C 14 23.554 12.406 8.537 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.377 12.379 9.779 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.108 12.066 8.644 1.00 1.00 O ATOM 1175 O5' DG C 14 23.675 13.882 7.859 1.00 1.00 O ATOM 1176 C5' DG C 14 24.916 14.591 7.831 1.00 1.00 C ATOM 1177 C4' DG C 14 24.811 16.068 7.395 1.00 1.00 C ATOM 1178 O4' DG C 14 24.682 16.182 5.980 1.00 1.00 O ATOM 1179 C3' DG C 14 23.641 16.823 8.051 1.00 1.00 C ATOM 1180 O3' DG C 14 24.065 18.137 8.427 1.00 1.00 O ATOM 1181 C2' DG C 14 22.603 16.785 6.929 1.00 1.00 C ATOM 1182 C1' DG C 14 23.455 16.826 5.665 1.00 1.00 C ATOM 1183 N9 DG C 14 22.838 16.132 4.519 1.00 1.00 N ATOM 1184 C8 DG C 14 22.187 14.931 4.523 1.00 1.00 C ATOM 1185 N7 DG C 14 21.804 14.513 3.345 1.00 1.00 N ATOM 1186 C5 DG C 14 22.202 15.557 2.494 1.00 1.00 C ATOM 1187 C6 DG C 14 22.053 15.741 1.074 1.00 1.00 C ATOM 1188 O6 DG C 14 21.580 14.978 0.235 1.00 1.00 O ATOM 1189 N1 DG C 14 22.510 16.958 0.623 1.00 1.00 N ATOM 1190 C2 DG C 14 23.104 17.876 1.415 1.00 1.00 C ATOM 1191 N2 DG C 14 23.504 18.973 0.831 1.00 1.00 N ATOM 1192 N3 DG C 14 23.309 17.743 2.723 1.00 1.00 N ATOM 1193 C4 DG C 14 22.819 16.561 3.212 1.00 1.00 C ATOM 0 H5' DG C 14 25.597 14.075 7.154 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.363 14.551 8.824 1.00 1.00 H new ATOM 0 H4' DG C 14 25.740 16.527 7.732 1.00 1.00 H new ATOM 0 H3' DG C 14 23.250 16.406 8.979 1.00 1.00 H new ATOM 0 H2' DG C 14 21.993 15.883 6.975 1.00 1.00 H new ATOM 0 H2'' DG C 14 21.921 17.633 6.983 1.00 1.00 H new ATOM 0 H1' DG C 14 23.579 17.867 5.365 1.00 1.00 H new ATOM 0 H8 DG C 14 22.003 14.371 5.428 1.00 1.00 H new ATOM 0 H1 DG C 14 22.393 17.179 -0.366 1.00 1.00 H new ATOM 0 H21 DG C 14 23.960 19.704 1.377 1.00 1.00 H new ATOM 0 H22 DG C 14 23.361 19.099 -0.171 1.00 1.00 H new ATOM 1205 P DC C 15 23.088 19.205 9.171 1.00 1.00 P ATOM 1206 OP1 DC C 15 23.952 20.215 9.846 1.00 1.00 O ATOM 1207 OP2 DC C 15 22.091 18.464 9.994 1.00 1.00 O ATOM 1208 O5' DC C 15 22.306 19.934 7.951 1.00 1.00 O ATOM 1209 C5' DC C 15 23.013 20.739 7.010 1.00 1.00 C ATOM 1210 C4' DC C 15 22.218 21.015 5.723 1.00 1.00 C ATOM 1211 O4' DC C 15 21.980 19.820 4.997 1.00 1.00 O ATOM 1212 C3' DC C 15 20.859 21.703 5.934 1.00 1.00 C ATOM 1213 O3' DC C 15 21.001 23.112 5.752 1.00 1.00 O ATOM 1214 C2' DC C 15 19.961 21.016 4.896 1.00 1.00 C ATOM 1215 C1' DC C 15 20.889 20.071 4.137 1.00 1.00 C ATOM 1216 N1 DC C 15 20.213 18.808 3.764 1.00 1.00 N ATOM 1217 C2 DC C 15 19.908 18.545 2.423 1.00 1.00 C ATOM 1218 O2 DC C 15 20.139 19.354 1.523 1.00 1.00 O ATOM 1219 N3 DC C 15 19.353 17.365 2.058 1.00 1.00 N ATOM 1220 C4 DC C 15 19.072 16.494 3.002 1.00 1.00 C ATOM 1221 N4 DC C 15 18.545 15.378 2.582 1.00 1.00 N ATOM 1222 C5 DC C 15 19.318 16.717 4.388 1.00 1.00 C ATOM 1223 C6 DC C 15 19.891 17.898 4.731 1.00 1.00 C ATOM 0 H5' DC C 15 23.949 20.244 6.751 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.273 21.688 7.478 1.00 1.00 H new ATOM 0 H4' DC C 15 22.858 21.703 5.170 1.00 1.00 H new ATOM 0 H3' DC C 15 20.436 21.605 6.934 1.00 1.00 H new ATOM 0 H2' DC C 15 19.148 20.471 5.376 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.504 21.744 4.226 1.00 1.00 H new ATOM 0 H1' DC C 15 21.209 20.523 3.199 1.00 1.00 H new ATOM 0 H41 DC C 15 18.297 14.648 3.250 1.00 1.00 H new ATOM 0 H42 DC C 15 18.381 15.235 1.586 1.00 1.00 H new ATOM 0 H5 DC C 15 19.060 15.978 5.132 1.00 1.00 H new ATOM 0 H6 DC C 15 20.093 18.119 5.769 1.00 1.00 H new ATOM 1235 P DA C 16 19.762 24.158 5.894 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.338 25.521 6.075 1.00 1.00 O ATOM 1237 OP2 DA C 16 18.813 23.647 6.924 1.00 1.00 O ATOM 1238 O5' DA C 16 19.028 24.105 4.446 1.00 1.00 O ATOM 1239 C5' DA C 16 19.738 24.416 3.245 1.00 1.00 C ATOM 1240 C4' DA C 16 18.909 24.237 1.959 1.00 1.00 C ATOM 1241 O4' DA C 16 18.717 22.863 1.618 1.00 1.00 O ATOM 1242 C3' DA C 16 17.527 24.913 2.049 1.00 1.00 C ATOM 1243 O3' DA C 16 17.298 25.734 0.903 1.00 1.00 O ATOM 1244 C2' DA C 16 16.617 23.688 2.157 1.00 1.00 C ATOM 1245 C1' DA C 16 17.349 22.665 1.299 1.00 1.00 C ATOM 1246 N9 DA C 16 16.969 21.286 1.642 1.00 1.00 N ATOM 1247 C8 DA C 16 17.011 20.731 2.888 1.00 1.00 C ATOM 1248 N7 DA C 16 16.775 19.446 2.924 1.00 1.00 N ATOM 1249 C5 DA C 16 16.479 19.158 1.579 1.00 1.00 C ATOM 1250 C6 DA C 16 16.092 17.996 0.868 1.00 1.00 C ATOM 1251 N6 DA C 16 16.004 16.796 1.401 1.00 1.00 N ATOM 1252 N1 DA C 16 15.756 18.042 -0.423 1.00 1.00 N ATOM 1253 C2 DA C 16 15.827 19.215 -1.036 1.00 1.00 C ATOM 1254 N3 DA C 16 16.229 20.378 -0.526 1.00 1.00 N ATOM 1255 C4 DA C 16 16.541 20.282 0.799 1.00 1.00 C ATOM 0 H5' DA C 16 20.623 23.783 3.185 1.00 1.00 H new ATOM 0 H5'' DA C 16 20.087 25.447 3.299 1.00 1.00 H new ATOM 0 H4' DA C 16 19.496 24.722 1.179 1.00 1.00 H new ATOM 0 H3' DA C 16 17.379 25.608 2.875 1.00 1.00 H new ATOM 0 H2' DA C 16 16.509 23.351 3.188 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.614 23.892 1.781 1.00 1.00 H new ATOM 0 H1' DA C 16 17.116 22.795 0.242 1.00 1.00 H new ATOM 0 H8 DA C 16 17.223 21.309 3.776 1.00 1.00 H new ATOM 0 H61 DA C 16 15.718 16.003 0.827 1.00 1.00 H new ATOM 0 H62 DA C 16 16.222 16.659 2.388 1.00 1.00 H new ATOM 0 H2 DA C 16 15.523 19.230 -2.072 1.00 1.00 H new ATOM 1267 P DT C 17 16.016 26.729 0.778 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.351 27.780 -0.223 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.599 27.166 2.143 1.00 1.00 O ATOM 1270 O5' DT C 17 14.848 25.784 0.164 1.00 1.00 O ATOM 1271 C5' DT C 17 14.931 25.291 -1.168 1.00 1.00 C ATOM 1272 C4' DT C 17 13.859 24.243 -1.507 1.00 1.00 C ATOM 1273 O4' DT C 17 14.100 23.027 -0.807 1.00 1.00 O ATOM 1274 C3' DT C 17 12.415 24.695 -1.208 1.00 1.00 C ATOM 1275 O3' DT C 17 11.661 24.725 -2.417 1.00 1.00 O ATOM 1276 C2' DT C 17 11.950 23.642 -0.195 1.00 1.00 C ATOM 1277 C1' DT C 17 12.843 22.447 -0.533 1.00 1.00 C ATOM 1278 N1 DT C 17 12.968 21.438 0.551 1.00 1.00 N ATOM 1279 C2 DT C 17 12.798 20.086 0.222 1.00 1.00 C ATOM 1280 O2 DT C 17 12.521 19.663 -0.904 1.00 1.00 O ATOM 1281 N3 DT C 17 12.968 19.184 1.243 1.00 1.00 N ATOM 1282 C4 DT C 17 13.280 19.476 2.548 1.00 1.00 C ATOM 1283 O4 DT C 17 13.431 18.541 3.331 1.00 1.00 O ATOM 1284 C5 DT C 17 13.409 20.902 2.835 1.00 1.00 C ATOM 1285 C7 DT C 17 13.709 21.377 4.243 1.00 1.00 C ATOM 1286 C6 DT C 17 13.267 21.820 1.847 1.00 1.00 C ATOM 0 H5' DT C 17 15.917 24.853 -1.323 1.00 1.00 H new ATOM 0 H5'' DT C 17 14.841 26.127 -1.862 1.00 1.00 H new ATOM 0 H4' DT C 17 13.942 24.099 -2.584 1.00 1.00 H new ATOM 0 H3' DT C 17 12.306 25.703 -0.807 1.00 1.00 H new ATOM 0 H2' DT C 17 12.091 23.977 0.833 1.00 1.00 H new ATOM 0 H2'' DT C 17 10.892 23.405 -0.311 1.00 1.00 H new ATOM 0 H1' DT C 17 12.414 21.884 -1.362 1.00 1.00 H new ATOM 0 H3 DT C 17 12.851 18.198 1.009 1.00 1.00 H new ATOM 0 H71 DT C 17 14.272 22.309 4.200 1.00 1.00 H new ATOM 0 H72 DT C 17 12.774 21.542 4.778 1.00 1.00 H new ATOM 0 H73 DT C 17 14.297 20.621 4.764 1.00 1.00 H new ATOM 0 H6 DT C 17 13.390 22.868 2.076 1.00 1.00 H new ATOM 1299 P DA C 18 10.126 25.256 -2.484 1.00 1.00 P ATOM 1300 OP1 DA C 18 9.837 25.628 -3.896 1.00 1.00 O ATOM 1301 OP2 DA C 18 9.914 26.284 -1.425 1.00 1.00 O ATOM 1302 O5' DA C 18 9.262 23.939 -2.109 1.00 1.00 O ATOM 1303 C5' DA C 18 9.318 22.780 -2.928 1.00 1.00 C ATOM 1304 C4' DA C 18 8.464 21.610 -2.422 1.00 1.00 C ATOM 1305 O4' DA C 18 9.124 20.880 -1.403 1.00 1.00 O ATOM 1306 C3' DA C 18 7.072 21.996 -1.903 1.00 1.00 C ATOM 1307 O3' DA C 18 6.153 21.386 -2.804 1.00 1.00 O ATOM 1308 C2' DA C 18 7.100 21.472 -0.462 1.00 1.00 C ATOM 1309 C1' DA C 18 8.150 20.368 -0.515 1.00 1.00 C ATOM 1310 N9 DA C 18 8.827 20.026 0.757 1.00 1.00 N ATOM 1311 C8 DA C 18 9.207 20.851 1.781 1.00 1.00 C ATOM 1312 N7 DA C 18 9.781 20.239 2.790 1.00 1.00 N ATOM 1313 C5 DA C 18 9.760 18.895 2.393 1.00 1.00 C ATOM 1314 C6 DA C 18 10.144 17.658 2.974 1.00 1.00 C ATOM 1315 N6 DA C 18 10.644 17.475 4.183 1.00 1.00 N ATOM 1316 N1 DA C 18 10.018 16.514 2.309 1.00 1.00 N ATOM 1317 C2 DA C 18 9.537 16.560 1.080 1.00 1.00 C ATOM 1318 N3 DA C 18 9.101 17.620 0.414 1.00 1.00 N ATOM 1319 C4 DA C 18 9.228 18.766 1.136 1.00 1.00 C ATOM 0 H5' DA C 18 10.355 22.452 -3.004 1.00 1.00 H new ATOM 0 H5'' DA C 18 8.993 23.044 -3.934 1.00 1.00 H new ATOM 0 H4' DA C 18 8.322 20.999 -3.313 1.00 1.00 H new ATOM 0 H3' DA C 18 6.784 23.047 -1.871 1.00 1.00 H new ATOM 0 H2' DA C 18 7.373 22.254 0.246 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.127 21.089 -0.154 1.00 1.00 H new ATOM 0 H1' DA C 18 7.654 19.441 -0.803 1.00 1.00 H new ATOM 0 H8 DA C 18 9.047 21.919 1.760 1.00 1.00 H new ATOM 0 H61 DA C 18 10.886 16.535 4.498 1.00 1.00 H new ATOM 0 H62 DA C 18 10.788 18.273 4.801 1.00 1.00 H new ATOM 0 H2 DA C 18 9.494 15.618 0.553 1.00 1.00 H new ATOM 1331 P DT C 19 4.571 21.466 -2.643 1.00 1.00 P ATOM 1332 OP1 DT C 19 3.984 21.147 -3.962 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.169 22.700 -1.940 1.00 1.00 O ATOM 1334 O5' DT C 19 4.334 20.208 -1.744 1.00 1.00 O ATOM 1335 C5' DT C 19 4.592 18.900 -2.223 1.00 1.00 C ATOM 1336 C4' DT C 19 4.056 17.889 -1.213 1.00 1.00 C ATOM 1337 O4' DT C 19 5.049 17.731 -0.216 1.00 1.00 O ATOM 1338 C3' DT C 19 2.771 18.380 -0.510 1.00 1.00 C ATOM 1339 O3' DT C 19 1.818 17.363 -0.342 1.00 1.00 O ATOM 1340 C2' DT C 19 3.279 18.793 0.854 1.00 1.00 C ATOM 1341 C1' DT C 19 4.392 17.757 1.025 1.00 1.00 C ATOM 1342 N1 DT C 19 5.376 18.020 2.098 1.00 1.00 N ATOM 1343 C2 DT C 19 5.833 16.927 2.840 1.00 1.00 C ATOM 1344 O2 DT C 19 5.516 15.759 2.614 1.00 1.00 O ATOM 1345 N3 DT C 19 6.659 17.207 3.896 1.00 1.00 N ATOM 1346 C4 DT C 19 6.987 18.459 4.356 1.00 1.00 C ATOM 1347 O4 DT C 19 7.682 18.538 5.367 1.00 1.00 O ATOM 1348 C5 DT C 19 6.457 19.563 3.554 1.00 1.00 C ATOM 1349 C7 DT C 19 6.697 21.006 3.961 1.00 1.00 C ATOM 1350 C6 DT C 19 5.723 19.306 2.439 1.00 1.00 C ATOM 0 H5' DT C 19 5.663 18.756 -2.368 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.116 18.753 -3.193 1.00 1.00 H new ATOM 0 H4' DT C 19 3.821 16.965 -1.742 1.00 1.00 H new ATOM 0 H3' DT C 19 2.275 19.162 -1.085 1.00 1.00 H new ATOM 0 H2' DT C 19 3.652 19.817 0.871 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.514 18.719 1.627 1.00 1.00 H new ATOM 0 H1' DT C 19 3.935 16.815 1.329 1.00 1.00 H new ATOM 0 H3 DT C 19 7.069 16.412 4.386 1.00 1.00 H new ATOM 0 H71 DT C 19 6.728 21.635 3.071 1.00 1.00 H new ATOM 0 H72 DT C 19 5.890 21.339 4.613 1.00 1.00 H new ATOM 0 H73 DT C 19 7.646 21.081 4.491 1.00 1.00 H new ATOM 0 H6 DT C 19 5.407 20.126 1.811 1.00 1.00 H new ATOM 1363 P DA C 20 0.773 17.023 -1.517 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.512 17.016 -2.805 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.399 17.928 -1.375 1.00 1.00 O ATOM 1366 O5' DA C 20 0.410 15.528 -1.047 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.291 15.339 0.172 1.00 1.00 C ATOM 1368 C4' DA C 20 0.058 14.013 0.851 1.00 1.00 C ATOM 1369 O4' DA C 20 1.329 14.135 1.495 1.00 1.00 O ATOM 1370 C3' DA C 20 -0.994 13.770 1.934 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.332 12.397 2.025 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.285 14.347 3.152 1.00 1.00 C ATOM 1373 C1' DA C 20 1.184 14.052 2.901 1.00 1.00 C ATOM 1374 N9 DA C 20 2.022 15.074 3.576 1.00 1.00 N ATOM 1375 C8 DA C 20 2.137 16.399 3.230 1.00 1.00 C ATOM 1376 N7 DA C 20 2.854 17.124 4.044 1.00 1.00 N ATOM 1377 C5 DA C 20 3.254 16.186 5.007 1.00 1.00 C ATOM 1378 C6 DA C 20 4.057 16.255 6.168 1.00 1.00 C ATOM 1379 N6 DA C 20 4.659 17.357 6.573 1.00 1.00 N ATOM 1380 N1 DA C 20 4.273 15.186 6.938 1.00 1.00 N ATOM 1381 C2 DA C 20 3.706 14.048 6.556 1.00 1.00 C ATOM 1382 N3 DA C 20 2.932 13.820 5.498 1.00 1.00 N ATOM 1383 C4 DA C 20 2.749 14.942 4.744 1.00 1.00 C ATOM 0 H5' DA C 20 -1.363 15.373 -0.021 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.062 16.161 0.850 1.00 1.00 H new ATOM 0 H4' DA C 20 0.086 13.204 0.121 1.00 1.00 H new ATOM 0 H3' DA C 20 -1.968 14.229 1.768 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.466 15.418 3.248 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.633 13.881 4.074 1.00 1.00 H new ATOM 0 H1' DA C 20 1.493 13.080 3.286 1.00 1.00 H new ATOM 0 H8 DA C 20 1.668 16.810 2.348 1.00 1.00 H new ATOM 0 H61 DA C 20 5.227 17.346 7.420 1.00 1.00 H new ATOM 0 H62 DA C 20 4.557 18.220 6.039 1.00 1.00 H new ATOM 0 H2 DA C 20 3.899 13.194 7.188 1.00 1.00 H new ATOM 1395 P DT C 21 -2.644 11.911 2.823 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.054 10.584 2.300 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.657 12.998 2.770 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.124 11.755 4.328 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.167 10.759 4.651 1.00 1.00 C ATOM 1400 C4' DT C 21 -0.999 10.558 6.160 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.129 11.548 6.682 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.314 10.630 6.934 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.277 9.607 7.911 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.299 12.041 7.509 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.798 12.284 7.690 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.318 13.693 7.601 1.00 1.00 N ATOM 1407 C2 DT C 21 0.731 14.064 8.458 1.00 1.00 C ATOM 1408 O2 DT C 21 1.248 13.303 9.282 1.00 1.00 O ATOM 1409 N3 DT C 21 1.218 15.345 8.347 1.00 1.00 N ATOM 1410 C4 DT C 21 0.772 16.282 7.445 1.00 1.00 C ATOM 1411 O4 DT C 21 1.336 17.373 7.405 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.333 15.851 6.592 1.00 1.00 C ATOM 1413 C7 DT C 21 -0.933 16.828 5.597 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.829 14.590 6.677 1.00 1.00 C ATOM 0 H5' DT C 21 -0.205 11.033 4.217 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.465 9.815 4.195 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.591 9.555 6.286 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.228 10.471 6.362 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.752 12.764 6.831 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.841 12.105 8.452 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.584 11.977 8.714 1.00 1.00 H new ATOM 0 H3 DT C 21 1.967 15.621 8.982 1.00 1.00 H new ATOM 0 H71 DT C 21 -0.838 17.843 5.982 1.00 1.00 H new ATOM 0 H72 DT C 21 -0.405 16.749 4.646 1.00 1.00 H new ATOM 0 H73 DT C 21 -1.987 16.594 5.447 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.629 14.284 6.019 1.00 1.00 H new ATOM 1427 P DG C 22 -3.523 9.245 8.837 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.395 7.802 9.155 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.788 9.717 8.223 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.196 10.100 10.148 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.095 9.755 10.971 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.780 10.814 12.028 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.185 11.958 11.424 1.00 1.00 O ATOM 1434 C3' DG C 22 -3.009 11.271 12.836 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.736 11.085 14.223 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.134 12.731 12.398 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.680 13.083 12.119 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.522 14.321 11.341 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.176 14.683 10.198 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.833 15.852 9.725 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.890 16.314 10.658 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.132 17.541 10.733 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.079 18.480 9.938 1.00 1.00 O ATOM 1444 N1 DG C 22 0.629 17.647 11.876 1.00 1.00 N ATOM 1445 C2 DG C 22 0.701 16.682 12.820 1.00 1.00 C ATOM 1446 N2 DG C 22 1.455 16.930 13.855 1.00 1.00 N ATOM 1447 N3 DG C 22 0.075 15.510 12.771 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.719 15.388 11.665 1.00 1.00 C ATOM 0 H5' DG C 22 -1.216 9.602 10.345 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.303 8.807 11.466 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.091 10.335 12.723 1.00 1.00 H new ATOM 0 H3' DG C 22 -3.940 10.730 12.670 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.761 12.843 11.514 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.567 13.358 13.177 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.133 13.288 13.040 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.916 14.055 9.724 1.00 1.00 H new ATOM 0 H1 DG C 22 1.168 18.501 12.018 1.00 1.00 H new ATOM 0 H21 DG C 22 1.546 16.237 14.598 1.00 1.00 H new ATOM 0 H22 DG C 22 1.954 17.817 13.922 1.00 1.00 H new ATOM 1460 P DC C 23 -3.809 11.400 15.402 1.00 1.00 P ATOM 1461 OP1 DC C 23 -3.772 10.270 16.374 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.126 11.778 14.810 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.170 12.714 16.106 1.00 1.00 O ATOM 1464 C5' DC C 23 -1.895 12.648 16.747 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.460 13.951 17.447 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.115 14.949 16.489 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.541 14.510 18.389 1.00 1.00 C ATOM 1468 O3' DC C 23 -1.961 14.897 19.637 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.105 15.665 17.563 1.00 1.00 C ATOM 1470 C1' DC C 23 -1.917 16.098 16.699 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.302 16.676 15.386 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.788 17.914 14.978 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.038 18.592 15.685 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.111 18.428 13.766 1.00 1.00 N ATOM 1475 C4 DC C 23 -2.920 17.734 12.991 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.158 18.256 11.821 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.475 16.472 13.345 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.136 15.979 14.562 1.00 1.00 C ATOM 0 H5' DC C 23 -1.143 12.382 16.004 1.00 1.00 H new ATOM 0 H5'' DC C 23 -1.914 11.845 17.483 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.589 13.695 18.050 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.322 13.809 18.685 1.00 1.00 H new ATOM 0 H2' DC C 23 -3.951 15.347 16.953 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.458 16.478 18.198 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.389 16.892 17.226 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.775 17.777 11.165 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.727 19.143 11.561 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.133 15.934 12.678 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.530 15.026 14.882 1.00 1.00 H new ATOM 1490 P DG C 24 -2.860 15.255 20.942 1.00 1.00 P ATOM 1491 OP1 DG C 24 -1.977 15.182 22.140 1.00 1.00 O ATOM 1492 OP2 DG C 24 -4.097 14.425 20.927 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.290 16.801 20.716 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.334 17.852 20.826 1.00 1.00 C ATOM 1495 C4' DG C 24 -2.806 19.171 20.196 1.00 1.00 C ATOM 1496 O4' DG C 24 -2.800 19.109 18.779 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.222 19.630 20.589 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.244 20.472 21.744 1.00 1.00 O ATOM 1499 C2' DG C 24 -4.691 20.405 19.358 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.572 20.204 18.330 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.091 19.967 16.973 1.00 1.00 N ATOM 1502 C8 DG C 24 -4.897 18.948 16.548 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.271 19.041 15.296 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.667 20.238 14.864 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.696 20.940 13.600 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.269 20.648 12.548 1.00 1.00 O ATOM 1507 N1 DG C 24 -3.984 22.122 13.613 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.313 22.590 14.691 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.694 23.732 14.559 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.250 21.984 15.870 1.00 1.00 N ATOM 1511 C4 DG C 24 -3.946 20.807 15.894 1.00 1.00 C ATOM 0 H5' DG C 24 -1.405 17.541 20.348 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.109 18.020 21.879 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.085 19.887 20.591 1.00 1.00 H new ATOM 0 H3' DG C 24 -4.855 18.784 20.857 1.00 1.00 H new ATOM 0 H2' DG C 24 -5.643 20.024 18.988 1.00 1.00 H new ATOM 0 H2'' DG C 24 -4.836 21.461 19.585 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.168 20.731 21.942 1.00 1.00 H new ATOM 0 H1' DG C 24 -2.969 21.109 18.255 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.200 18.135 17.191 1.00 1.00 H new ATOM 0 H1 DG C 24 -3.962 22.677 12.758 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.175 24.125 15.344 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.729 24.232 13.670 1.00 1.00 H new TER 1524 DG C 24