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=-3.2!) USER MOD Set 1.2: A 121 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 87 ASN : amide:sc= 2.67 K(o=3.3,f=-8!) USER MOD Set 2.2: A 90 THR OG1 : rot 168:sc= 0.61 USER MOD Single : A 81 LYS NZ :NH3+ 163:sc= 1.22 (180deg=0.841) USER MOD Single : A 83 LYS NZ :NH3+ 159:sc= 2.11 (180deg=1.58) 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 89 HIS : no HD1:sc= -0.113 X(o=-0.11,f=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.169 USER MOD Single : A 97 LYS NZ :NH3+ 170:sc= 1.22 (180deg=1.07) USER MOD Single : A 100 ASN : amide:sc= 0.00438 K(o=0.0044,f=-1.2) USER MOD Single : A 101 HIS : no HE2:sc= 0.744 K(o=0.74,f=-2.3!) USER MOD Single : A 102 LYS NZ :NH3+ 163:sc= 1.22 (180deg=1.09) USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 LYS NZ :NH3+ -152:sc= 1.15 (180deg=0.567) USER MOD Single : A 108 LYS NZ :NH3+ -152:sc= 2.36 (180deg=-0.146) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot 86:sc= 1.23 USER MOD Single : A 125 HIS : no HD1:sc= 1.25 K(o=1.2,f=-4.1!) 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 -30:sc= -0.241 (180deg=-0.389) 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= -0.197 (180deg=-0.197) USER MOD Single : C 21 DT C7 :methyl 150:sc= -1.34 (180deg=-1.34) USER MOD Single : C 24 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 79 -1.058 6.667 9.561 1.00 1.00 N ATOM 2 CA ALA A 79 0.068 6.060 8.799 1.00 1.00 C ATOM 3 C ALA A 79 0.396 6.865 7.541 1.00 1.00 C ATOM 4 O ALA A 79 -0.460 7.557 7.002 1.00 1.00 O ATOM 5 CB ALA A 79 -0.285 4.603 8.442 1.00 1.00 C ATOM 0 HA ALA A 79 0.959 6.073 9.426 1.00 1.00 H new ATOM 0 HB1 ALA A 79 0.537 4.156 7.884 1.00 1.00 H new ATOM 0 HB2 ALA A 79 -0.454 4.035 9.357 1.00 1.00 H new ATOM 0 HB3 ALA A 79 -1.188 4.586 7.832 1.00 1.00 H new ATOM 11 N ARG A 80 1.628 6.753 7.033 1.00 1.00 N ATOM 12 CA ARG A 80 2.118 7.378 5.776 1.00 1.00 C ATOM 13 C ARG A 80 1.491 6.754 4.510 1.00 1.00 C ATOM 14 O ARG A 80 2.173 6.149 3.691 1.00 1.00 O ATOM 15 CB ARG A 80 3.663 7.376 5.765 1.00 1.00 C ATOM 16 CG ARG A 80 4.227 8.278 6.876 1.00 1.00 C ATOM 17 CD ARG A 80 4.218 9.766 6.511 1.00 1.00 C ATOM 18 NE ARG A 80 4.333 10.601 7.725 1.00 1.00 N ATOM 19 CZ ARG A 80 3.345 11.169 8.391 1.00 1.00 C ATOM 20 NH1 ARG A 80 2.101 11.081 8.033 1.00 1.00 N ATOM 21 NH2 ARG A 80 3.561 11.911 9.429 1.00 1.00 N ATOM 0 H ARG A 80 2.350 6.203 7.498 1.00 1.00 H new ATOM 0 HA ARG A 80 1.786 8.416 5.753 1.00 1.00 H new ATOM 0 HB2 ARG A 80 4.029 6.358 5.898 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.023 7.720 4.795 1.00 1.00 H new ATOM 0 HG2 ARG A 80 3.644 8.130 7.785 1.00 1.00 H new ATOM 0 HG3 ARG A 80 5.249 7.972 7.099 1.00 1.00 H new ATOM 0 HD2 ARG A 80 5.043 9.985 5.833 1.00 1.00 H new ATOM 0 HD3 ARG A 80 3.297 10.010 5.981 1.00 1.00 H new ATOM 0 HE ARG A 80 5.275 10.754 8.086 1.00 1.00 H new ATOM 0 HH11 ARG A 80 1.847 10.552 7.199 1.00 1.00 H new ATOM 0 HH12 ARG A 80 1.377 11.541 8.586 1.00 1.00 H new ATOM 0 HH21 ARG A 80 4.515 12.070 9.753 1.00 1.00 H new ATOM 0 HH22 ARG A 80 2.777 12.337 9.924 1.00 1.00 H new ATOM 35 N LYS A 81 0.165 6.851 4.394 1.00 1.00 N ATOM 36 CA LYS A 81 -0.689 6.375 3.307 1.00 1.00 C ATOM 37 C LYS A 81 -0.268 7.000 1.982 1.00 1.00 C ATOM 38 O LYS A 81 -0.070 8.208 1.850 1.00 1.00 O ATOM 39 CB LYS A 81 -2.146 6.747 3.629 1.00 1.00 C ATOM 40 CG LYS A 81 -2.740 5.956 4.808 1.00 1.00 C ATOM 41 CD LYS A 81 -3.834 6.754 5.535 1.00 1.00 C ATOM 42 CE LYS A 81 -4.569 5.857 6.545 1.00 1.00 C ATOM 43 NZ LYS A 81 -5.368 6.658 7.516 1.00 1.00 N ATOM 0 H LYS A 81 -0.386 7.305 5.123 1.00 1.00 H new ATOM 0 HA LYS A 81 -0.593 5.293 3.214 1.00 1.00 H new ATOM 0 HB2 LYS A 81 -2.198 7.812 3.854 1.00 1.00 H new ATOM 0 HB3 LYS A 81 -2.759 6.578 2.744 1.00 1.00 H new ATOM 0 HG2 LYS A 81 -3.156 5.017 4.443 1.00 1.00 H new ATOM 0 HG3 LYS A 81 -1.947 5.701 5.511 1.00 1.00 H new ATOM 0 HD2 LYS A 81 -3.390 7.606 6.051 1.00 1.00 H new ATOM 0 HD3 LYS A 81 -4.543 7.154 4.811 1.00 1.00 H new ATOM 0 HE2 LYS A 81 -5.227 5.171 6.011 1.00 1.00 H new ATOM 0 HE3 LYS A 81 -3.844 5.248 7.085 1.00 1.00 H new ATOM 0 HZ1 LYS A 81 -6.062 6.042 7.986 1.00 1.00 H new ATOM 0 HZ2 LYS A 81 -4.734 7.072 8.229 1.00 1.00 H new ATOM 0 HZ3 LYS A 81 -5.866 7.419 7.012 1.00 1.00 H new ATOM 57 N VAL A 82 -0.140 6.125 1.003 1.00 1.00 N ATOM 58 CA VAL A 82 0.084 6.455 -0.403 1.00 1.00 C ATOM 59 C VAL A 82 -1.164 7.071 -1.025 1.00 1.00 C ATOM 60 O VAL A 82 -2.273 6.549 -0.898 1.00 1.00 O ATOM 61 CB VAL A 82 0.433 5.184 -1.199 1.00 1.00 C ATOM 62 CG1 VAL A 82 0.578 5.455 -2.706 1.00 1.00 C ATOM 63 CG2 VAL A 82 1.721 4.542 -0.685 1.00 1.00 C ATOM 0 H VAL A 82 -0.191 5.119 1.167 1.00 1.00 H new ATOM 0 HA VAL A 82 0.906 7.169 -0.444 1.00 1.00 H new ATOM 0 HB VAL A 82 -0.403 4.500 -1.050 1.00 1.00 H new ATOM 0 HG11 VAL A 82 0.824 4.526 -3.221 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -0.360 5.849 -3.097 1.00 1.00 H new ATOM 0 HG13 VAL A 82 1.373 6.182 -2.870 1.00 1.00 H new ATOM 0 HG21 VAL A 82 1.939 3.647 -1.268 1.00 1.00 H new ATOM 0 HG22 VAL A 82 2.545 5.249 -0.784 1.00 1.00 H new ATOM 0 HG23 VAL A 82 1.599 4.271 0.364 1.00 1.00 H new ATOM 73 N LYS A 83 -0.976 8.155 -1.771 1.00 1.00 N ATOM 74 CA LYS A 83 -1.981 8.730 -2.647 1.00 1.00 C ATOM 75 C LYS A 83 -1.545 8.433 -4.071 1.00 1.00 C ATOM 76 O LYS A 83 -0.436 8.779 -4.485 1.00 1.00 O ATOM 77 CB LYS A 83 -2.153 10.239 -2.453 1.00 1.00 C ATOM 78 CG LYS A 83 -3.346 10.541 -1.544 1.00 1.00 C ATOM 79 CD LYS A 83 -3.426 12.051 -1.306 1.00 1.00 C ATOM 80 CE LYS A 83 -4.748 12.434 -0.642 1.00 1.00 C ATOM 81 NZ LYS A 83 -4.663 13.772 -0.018 1.00 1.00 N ATOM 0 H LYS A 83 -0.095 8.669 -1.780 1.00 1.00 H new ATOM 0 HA LYS A 83 -2.951 8.289 -2.415 1.00 1.00 H new ATOM 0 HB2 LYS A 83 -1.245 10.660 -2.020 1.00 1.00 H new ATOM 0 HB3 LYS A 83 -2.297 10.720 -3.421 1.00 1.00 H new ATOM 0 HG2 LYS A 83 -4.268 10.183 -2.003 1.00 1.00 H new ATOM 0 HG3 LYS A 83 -3.238 10.016 -0.595 1.00 1.00 H new ATOM 0 HD2 LYS A 83 -2.594 12.368 -0.677 1.00 1.00 H new ATOM 0 HD3 LYS A 83 -3.326 12.578 -2.255 1.00 1.00 H new ATOM 0 HE2 LYS A 83 -5.547 12.425 -1.384 1.00 1.00 H new ATOM 0 HE3 LYS A 83 -5.007 11.693 0.114 1.00 1.00 H new ATOM 0 HZ1 LYS A 83 -5.620 14.159 0.105 1.00 1.00 H new ATOM 0 HZ2 LYS A 83 -4.199 13.694 0.909 1.00 1.00 H new ATOM 0 HZ3 LYS A 83 -4.110 14.406 -0.629 1.00 1.00 H new ATOM 95 N GLN A 84 -2.391 7.716 -4.798 1.00 1.00 N ATOM 96 CA GLN A 84 -2.224 7.594 -6.228 1.00 1.00 C ATOM 97 C GLN A 84 -2.852 8.877 -6.763 1.00 1.00 C ATOM 98 O GLN A 84 -3.879 9.333 -6.262 1.00 1.00 O ATOM 99 CB GLN A 84 -2.887 6.317 -6.783 1.00 1.00 C ATOM 100 CG GLN A 84 -3.618 6.484 -8.120 1.00 1.00 C ATOM 101 CD GLN A 84 -4.215 5.167 -8.608 1.00 1.00 C ATOM 102 OE1 GLN A 84 -5.413 4.938 -8.523 1.00 1.00 O ATOM 103 NE2 GLN A 84 -3.418 4.253 -9.123 1.00 1.00 N ATOM 0 H GLN A 84 -3.194 7.215 -4.418 1.00 1.00 H new ATOM 0 HA GLN A 84 -1.183 7.488 -6.532 1.00 1.00 H new ATOM 0 HB2 GLN A 84 -2.120 5.551 -6.901 1.00 1.00 H new ATOM 0 HB3 GLN A 84 -3.597 5.946 -6.044 1.00 1.00 H new ATOM 0 HG2 GLN A 84 -4.411 7.224 -8.011 1.00 1.00 H new ATOM 0 HG3 GLN A 84 -2.924 6.868 -8.868 1.00 1.00 H new ATOM 0 HE21 GLN A 84 -2.417 4.433 -9.199 1.00 1.00 H new ATOM 0 HE22 GLN A 84 -3.802 3.365 -9.446 1.00 1.00 H new ATOM 112 N TYR A 85 -2.263 9.416 -7.814 1.00 1.00 N ATOM 113 CA TYR A 85 -2.810 10.547 -8.550 1.00 1.00 C ATOM 114 C TYR A 85 -2.869 10.160 -10.027 1.00 1.00 C ATOM 115 O TYR A 85 -1.961 9.494 -10.519 1.00 1.00 O ATOM 116 CB TYR A 85 -1.938 11.792 -8.313 1.00 1.00 C ATOM 117 CG TYR A 85 -1.698 12.187 -6.868 1.00 1.00 C ATOM 118 CD1 TYR A 85 -2.648 12.982 -6.201 1.00 1.00 C ATOM 119 CD2 TYR A 85 -0.501 11.833 -6.214 1.00 1.00 C ATOM 120 CE1 TYR A 85 -2.406 13.448 -4.896 1.00 1.00 C ATOM 121 CE2 TYR A 85 -0.244 12.296 -4.909 1.00 1.00 C ATOM 122 CZ TYR A 85 -1.190 13.117 -4.252 1.00 1.00 C ATOM 123 OH TYR A 85 -0.946 13.584 -2.999 1.00 1.00 O ATOM 0 H TYR A 85 -1.377 9.077 -8.188 1.00 1.00 H new ATOM 0 HA TYR A 85 -3.816 10.793 -8.208 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -0.970 11.625 -8.786 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -2.402 12.635 -8.824 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -3.573 13.237 -6.696 1.00 1.00 H new ATOM 0 HD2 TYR A 85 0.221 11.205 -6.715 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -3.143 14.054 -4.389 1.00 1.00 H new ATOM 0 HE2 TYR A 85 0.675 12.024 -4.410 1.00 1.00 H new ATOM 0 HH TYR A 85 -0.069 13.267 -2.697 1.00 1.00 H new ATOM 133 N LYS A 86 -3.911 10.580 -10.745 1.00 1.00 N ATOM 134 CA LYS A 86 -4.099 10.327 -12.182 1.00 1.00 C ATOM 135 C LYS A 86 -4.466 11.630 -12.886 1.00 1.00 C ATOM 136 O LYS A 86 -5.201 12.433 -12.325 1.00 1.00 O ATOM 137 CB LYS A 86 -5.176 9.240 -12.350 1.00 1.00 C ATOM 138 CG LYS A 86 -5.547 8.979 -13.821 1.00 1.00 C ATOM 139 CD LYS A 86 -6.354 7.683 -13.960 1.00 1.00 C ATOM 140 CE LYS A 86 -6.655 7.404 -15.439 1.00 1.00 C ATOM 141 NZ LYS A 86 -7.482 6.176 -15.608 1.00 1.00 N ATOM 0 H LYS A 86 -4.672 11.122 -10.335 1.00 1.00 H new ATOM 0 HA LYS A 86 -3.179 9.965 -12.642 1.00 1.00 H new ATOM 0 HB2 LYS A 86 -4.821 8.312 -11.901 1.00 1.00 H new ATOM 0 HB3 LYS A 86 -6.071 9.536 -11.803 1.00 1.00 H new ATOM 0 HG2 LYS A 86 -6.127 9.817 -14.208 1.00 1.00 H new ATOM 0 HG3 LYS A 86 -4.641 8.914 -14.423 1.00 1.00 H new ATOM 0 HD2 LYS A 86 -5.796 6.851 -13.531 1.00 1.00 H new ATOM 0 HD3 LYS A 86 -7.286 7.764 -13.400 1.00 1.00 H new ATOM 0 HE2 LYS A 86 -7.177 8.257 -15.872 1.00 1.00 H new ATOM 0 HE3 LYS A 86 -5.719 7.291 -15.986 1.00 1.00 H new ATOM 0 HZ1 LYS A 86 -7.666 6.018 -16.619 1.00 1.00 H new ATOM 0 HZ2 LYS A 86 -6.973 5.358 -15.217 1.00 1.00 H new ATOM 0 HZ3 LYS A 86 -8.385 6.294 -15.106 1.00 1.00 H new ATOM 155 N ASN A 87 -3.963 11.836 -14.097 1.00 1.00 N ATOM 156 CA ASN A 87 -4.113 13.100 -14.818 1.00 1.00 C ATOM 157 C ASN A 87 -5.074 12.992 -16.027 1.00 1.00 C ATOM 158 O ASN A 87 -4.702 12.395 -17.042 1.00 1.00 O ATOM 159 CB ASN A 87 -2.711 13.557 -15.219 1.00 1.00 C ATOM 160 CG ASN A 87 -2.684 14.944 -15.821 1.00 1.00 C ATOM 161 OD1 ASN A 87 -3.634 15.429 -16.416 1.00 1.00 O ATOM 162 ND2 ASN A 87 -1.604 15.654 -15.657 1.00 1.00 N ATOM 0 H ASN A 87 -3.437 11.130 -14.611 1.00 1.00 H new ATOM 0 HA ASN A 87 -4.581 13.844 -14.173 1.00 1.00 H new ATOM 0 HB2 ASN A 87 -2.065 13.537 -14.341 1.00 1.00 H new ATOM 0 HB3 ASN A 87 -2.297 12.849 -15.937 1.00 1.00 H new ATOM 0 HD21 ASN A 87 -1.558 16.605 -16.024 1.00 1.00 H new ATOM 0 HD22 ASN A 87 -0.804 15.259 -15.162 1.00 1.00 H new ATOM 169 N PRO A 88 -6.280 13.603 -15.965 1.00 1.00 N ATOM 170 CA PRO A 88 -7.239 13.656 -17.074 1.00 1.00 C ATOM 171 C PRO A 88 -6.688 14.192 -18.411 1.00 1.00 C ATOM 172 O PRO A 88 -7.196 13.829 -19.474 1.00 1.00 O ATOM 173 CB PRO A 88 -8.385 14.550 -16.575 1.00 1.00 C ATOM 174 CG PRO A 88 -8.331 14.407 -15.057 1.00 1.00 C ATOM 175 CD PRO A 88 -6.841 14.258 -14.787 1.00 1.00 C ATOM 0 HA PRO A 88 -7.541 12.638 -17.318 1.00 1.00 H new ATOM 0 HB2 PRO A 88 -8.246 15.586 -16.883 1.00 1.00 H new ATOM 0 HB3 PRO A 88 -9.347 14.225 -16.973 1.00 1.00 H new ATOM 0 HG2 PRO A 88 -8.748 15.279 -14.553 1.00 1.00 H new ATOM 0 HG3 PRO A 88 -8.894 13.540 -14.712 1.00 1.00 H new ATOM 0 HD2 PRO A 88 -6.376 15.230 -14.623 1.00 1.00 H new ATOM 0 HD3 PRO A 88 -6.665 13.664 -13.890 1.00 1.00 H new ATOM 183 N HIS A 89 -5.662 15.054 -18.379 1.00 1.00 N ATOM 184 CA HIS A 89 -5.114 15.752 -19.555 1.00 1.00 C ATOM 185 C HIS A 89 -3.995 14.983 -20.276 1.00 1.00 C ATOM 186 O HIS A 89 -3.744 15.244 -21.454 1.00 1.00 O ATOM 187 CB HIS A 89 -4.614 17.142 -19.125 1.00 1.00 C ATOM 188 CG HIS A 89 -5.646 17.955 -18.381 1.00 1.00 C ATOM 189 ND1 HIS A 89 -6.711 18.637 -18.944 1.00 1.00 N ATOM 190 CD2 HIS A 89 -5.690 18.147 -17.028 1.00 1.00 C ATOM 191 CE1 HIS A 89 -7.389 19.244 -17.949 1.00 1.00 C ATOM 192 NE2 HIS A 89 -6.780 18.964 -16.776 1.00 1.00 N ATOM 0 H HIS A 89 -5.177 15.292 -17.514 1.00 1.00 H new ATOM 0 HA HIS A 89 -5.924 15.836 -20.279 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -3.734 17.022 -18.493 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -4.298 17.694 -20.010 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -5.007 17.740 -16.297 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -8.273 19.853 -18.070 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -7.074 19.298 -15.858 1.00 1.00 H new ATOM 201 N THR A 90 -3.327 14.045 -19.593 1.00 1.00 N ATOM 202 CA THR A 90 -2.120 13.353 -20.100 1.00 1.00 C ATOM 203 C THR A 90 -2.206 11.823 -20.058 1.00 1.00 C ATOM 204 O THR A 90 -1.440 11.150 -20.753 1.00 1.00 O ATOM 205 CB THR A 90 -0.868 13.790 -19.320 1.00 1.00 C ATOM 206 OG1 THR A 90 -0.969 13.337 -17.992 1.00 1.00 O ATOM 207 CG2 THR A 90 -0.688 15.303 -19.244 1.00 1.00 C ATOM 0 H THR A 90 -3.607 13.737 -18.662 1.00 1.00 H new ATOM 0 HA THR A 90 -2.051 13.648 -21.147 1.00 1.00 H new ATOM 0 HB THR A 90 -0.021 13.364 -19.857 1.00 1.00 H new ATOM 0 HG1 THR A 90 -0.101 13.433 -17.547 1.00 1.00 H new ATOM 0 HG21 THR A 90 0.215 15.534 -18.679 1.00 1.00 H new ATOM 0 HG22 THR A 90 -0.600 15.710 -20.251 1.00 1.00 H new ATOM 0 HG23 THR A 90 -1.550 15.747 -18.747 1.00 1.00 H new ATOM 215 N GLY A 91 -3.132 11.255 -19.270 1.00 1.00 N ATOM 216 CA GLY A 91 -3.238 9.808 -19.045 1.00 1.00 C ATOM 217 C GLY A 91 -2.113 9.220 -18.171 1.00 1.00 C ATOM 218 O GLY A 91 -1.966 7.999 -18.089 1.00 1.00 O ATOM 0 H GLY A 91 -3.835 11.795 -18.766 1.00 1.00 H new ATOM 0 HA2 GLY A 91 -4.198 9.594 -18.574 1.00 1.00 H new ATOM 0 HA3 GLY A 91 -3.236 9.301 -20.010 1.00 1.00 H new ATOM 222 N GLU A 92 -1.308 10.069 -17.527 1.00 1.00 N ATOM 223 CA GLU A 92 -0.281 9.702 -16.572 1.00 1.00 C ATOM 224 C GLU A 92 -0.924 9.383 -15.220 1.00 1.00 C ATOM 225 O GLU A 92 -1.933 9.962 -14.816 1.00 1.00 O ATOM 226 CB GLU A 92 0.682 10.880 -16.364 1.00 1.00 C ATOM 227 CG GLU A 92 1.542 11.258 -17.573 1.00 1.00 C ATOM 228 CD GLU A 92 2.342 12.550 -17.298 1.00 1.00 C ATOM 229 OE1 GLU A 92 1.738 13.569 -16.877 1.00 1.00 O ATOM 230 OE2 GLU A 92 3.579 12.549 -17.520 1.00 1.00 O ATOM 0 H GLU A 92 -1.364 11.077 -17.670 1.00 1.00 H new ATOM 0 HA GLU A 92 0.255 8.834 -16.957 1.00 1.00 H new ATOM 0 HB2 GLU A 92 0.100 11.753 -16.069 1.00 1.00 H new ATOM 0 HB3 GLU A 92 1.344 10.641 -15.531 1.00 1.00 H new ATOM 0 HG2 GLU A 92 2.228 10.443 -17.805 1.00 1.00 H new ATOM 0 HG3 GLU A 92 0.906 11.398 -18.447 1.00 1.00 H new ATOM 237 N VAL A 93 -0.263 8.504 -14.485 1.00 1.00 N ATOM 238 CA VAL A 93 -0.560 8.122 -13.102 1.00 1.00 C ATOM 239 C VAL A 93 0.744 8.138 -12.290 1.00 1.00 C ATOM 240 O VAL A 93 1.842 7.955 -12.820 1.00 1.00 O ATOM 241 CB VAL A 93 -1.207 6.725 -13.057 1.00 1.00 C ATOM 242 CG1 VAL A 93 -1.735 6.315 -11.667 1.00 1.00 C ATOM 243 CG2 VAL A 93 -2.387 6.628 -14.035 1.00 1.00 C ATOM 0 H VAL A 93 0.546 8.004 -14.855 1.00 1.00 H new ATOM 0 HA VAL A 93 -1.265 8.832 -12.671 1.00 1.00 H new ATOM 0 HB VAL A 93 -0.398 6.048 -13.332 1.00 1.00 H new ATOM 0 HG11 VAL A 93 -2.174 5.319 -11.724 1.00 1.00 H new ATOM 0 HG12 VAL A 93 -0.912 6.308 -10.953 1.00 1.00 H new ATOM 0 HG13 VAL A 93 -2.493 7.028 -11.341 1.00 1.00 H new ATOM 0 HG21 VAL A 93 -2.823 5.631 -13.981 1.00 1.00 H new ATOM 0 HG22 VAL A 93 -3.141 7.369 -13.770 1.00 1.00 H new ATOM 0 HG23 VAL A 93 -2.035 6.815 -15.049 1.00 1.00 H new ATOM 253 N ILE A 94 0.601 8.333 -10.986 1.00 1.00 N ATOM 254 CA ILE A 94 1.655 8.344 -9.967 1.00 1.00 C ATOM 255 C ILE A 94 1.122 7.730 -8.672 1.00 1.00 C ATOM 256 O ILE A 94 -0.086 7.607 -8.485 1.00 1.00 O ATOM 257 CB ILE A 94 2.175 9.769 -9.630 1.00 1.00 C ATOM 258 CG1 ILE A 94 1.536 10.925 -10.431 1.00 1.00 C ATOM 259 CG2 ILE A 94 3.708 9.819 -9.737 1.00 1.00 C ATOM 260 CD1 ILE A 94 1.921 12.296 -9.872 1.00 1.00 C ATOM 0 H ILE A 94 -0.319 8.500 -10.578 1.00 1.00 H new ATOM 0 HA ILE A 94 2.483 7.770 -10.384 1.00 1.00 H new ATOM 0 HB ILE A 94 1.857 9.943 -8.602 1.00 1.00 H new ATOM 0 HG12 ILE A 94 1.848 10.859 -11.473 1.00 1.00 H new ATOM 0 HG13 ILE A 94 0.451 10.820 -10.416 1.00 1.00 H new ATOM 0 HG21 ILE A 94 4.057 10.824 -9.498 1.00 1.00 H new ATOM 0 HG22 ILE A 94 4.145 9.107 -9.037 1.00 1.00 H new ATOM 0 HG23 ILE A 94 4.010 9.562 -10.752 1.00 1.00 H new ATOM 0 HD11 ILE A 94 1.448 13.077 -10.467 1.00 1.00 H new ATOM 0 HD12 ILE A 94 1.586 12.375 -8.838 1.00 1.00 H new ATOM 0 HD13 ILE A 94 3.004 12.414 -9.912 1.00 1.00 H new ATOM 272 N GLU A 95 2.037 7.458 -7.747 1.00 1.00 N ATOM 273 CA GLU A 95 1.813 7.006 -6.373 1.00 1.00 C ATOM 274 C GLU A 95 2.908 7.572 -5.460 1.00 1.00 C ATOM 275 O GLU A 95 4.094 7.303 -5.672 1.00 1.00 O ATOM 276 CB GLU A 95 1.887 5.476 -6.320 1.00 1.00 C ATOM 277 CG GLU A 95 0.569 4.822 -6.720 1.00 1.00 C ATOM 278 CD GLU A 95 0.703 3.288 -6.796 1.00 1.00 C ATOM 279 OE1 GLU A 95 0.989 2.640 -5.760 1.00 1.00 O ATOM 280 OE2 GLU A 95 0.528 2.715 -7.900 1.00 1.00 O ATOM 0 H GLU A 95 3.032 7.554 -7.952 1.00 1.00 H new ATOM 0 HA GLU A 95 0.833 7.349 -6.042 1.00 1.00 H new ATOM 0 HB2 GLU A 95 2.679 5.129 -6.984 1.00 1.00 H new ATOM 0 HB3 GLU A 95 2.155 5.162 -5.311 1.00 1.00 H new ATOM 0 HG2 GLU A 95 -0.204 5.086 -5.998 1.00 1.00 H new ATOM 0 HG3 GLU A 95 0.248 5.209 -7.687 1.00 1.00 H new ATOM 287 N THR A 96 2.519 8.359 -4.455 1.00 1.00 N ATOM 288 CA THR A 96 3.449 9.003 -3.506 1.00 1.00 C ATOM 289 C THR A 96 2.790 9.107 -2.124 1.00 1.00 C ATOM 290 O THR A 96 1.568 9.214 -2.027 1.00 1.00 O ATOM 291 CB THR A 96 3.936 10.394 -3.993 1.00 1.00 C ATOM 292 OG1 THR A 96 3.304 11.447 -3.295 1.00 1.00 O ATOM 293 CG2 THR A 96 3.707 10.706 -5.483 1.00 1.00 C ATOM 0 H THR A 96 1.539 8.574 -4.269 1.00 1.00 H new ATOM 0 HA THR A 96 4.337 8.374 -3.439 1.00 1.00 H new ATOM 0 HB THR A 96 5.008 10.333 -3.805 1.00 1.00 H new ATOM 0 HG1 THR A 96 3.637 12.306 -3.628 1.00 1.00 H new ATOM 0 HG21 THR A 96 4.086 11.703 -5.708 1.00 1.00 H new ATOM 0 HG22 THR A 96 4.232 9.971 -6.093 1.00 1.00 H new ATOM 0 HG23 THR A 96 2.640 10.665 -5.704 1.00 1.00 H new ATOM 301 N LYS A 97 3.563 9.069 -1.035 1.00 1.00 N ATOM 302 CA LYS A 97 3.047 9.245 0.341 1.00 1.00 C ATOM 303 C LYS A 97 3.114 10.721 0.798 1.00 1.00 C ATOM 304 O LYS A 97 2.945 11.017 1.984 1.00 1.00 O ATOM 305 CB LYS A 97 3.828 8.334 1.302 1.00 1.00 C ATOM 306 CG LYS A 97 3.874 6.851 0.890 1.00 1.00 C ATOM 307 CD LYS A 97 4.939 6.056 1.664 1.00 1.00 C ATOM 308 CE LYS A 97 5.275 4.712 1.001 1.00 1.00 C ATOM 309 NZ LYS A 97 6.079 4.893 -0.242 1.00 1.00 N ATOM 0 H LYS A 97 4.571 8.915 -1.075 1.00 1.00 H new ATOM 0 HA LYS A 97 1.995 8.961 0.352 1.00 1.00 H new ATOM 0 HB2 LYS A 97 4.849 8.706 1.384 1.00 1.00 H new ATOM 0 HB3 LYS A 97 3.382 8.408 2.294 1.00 1.00 H new ATOM 0 HG2 LYS A 97 2.896 6.400 1.058 1.00 1.00 H new ATOM 0 HG3 LYS A 97 4.078 6.780 -0.178 1.00 1.00 H new ATOM 0 HD2 LYS A 97 5.847 6.654 1.743 1.00 1.00 H new ATOM 0 HD3 LYS A 97 4.586 5.877 2.680 1.00 1.00 H new ATOM 0 HE2 LYS A 97 5.828 4.088 1.704 1.00 1.00 H new ATOM 0 HE3 LYS A 97 4.352 4.183 0.763 1.00 1.00 H new ATOM 0 HZ1 LYS A 97 6.429 3.969 -0.567 1.00 1.00 H new ATOM 0 HZ2 LYS A 97 5.484 5.318 -0.982 1.00 1.00 H new ATOM 0 HZ3 LYS A 97 6.886 5.519 -0.045 1.00 1.00 H new ATOM 323 N GLY A 98 3.414 11.624 -0.140 1.00 1.00 N ATOM 324 CA GLY A 98 3.716 13.037 0.063 1.00 1.00 C ATOM 325 C GLY A 98 5.027 13.479 -0.596 1.00 1.00 C ATOM 326 O GLY A 98 5.608 12.768 -1.426 1.00 1.00 O ATOM 0 H GLY A 98 3.454 11.366 -1.126 1.00 1.00 H new ATOM 0 HA2 GLY A 98 2.897 13.637 -0.335 1.00 1.00 H new ATOM 0 HA3 GLY A 98 3.769 13.240 1.133 1.00 1.00 H new ATOM 330 N GLY A 99 5.486 14.665 -0.202 1.00 1.00 N ATOM 331 CA GLY A 99 6.797 15.215 -0.526 1.00 1.00 C ATOM 332 C GLY A 99 6.983 15.774 -1.946 1.00 1.00 C ATOM 333 O GLY A 99 6.181 15.575 -2.861 1.00 1.00 O ATOM 0 H GLY A 99 4.929 15.294 0.376 1.00 1.00 H new ATOM 0 HA2 GLY A 99 7.016 16.012 0.184 1.00 1.00 H new ATOM 0 HA3 GLY A 99 7.541 14.434 -0.368 1.00 1.00 H new ATOM 337 N ASN A 100 8.103 16.480 -2.106 1.00 1.00 N ATOM 338 CA ASN A 100 8.675 16.958 -3.363 1.00 1.00 C ATOM 339 C ASN A 100 8.910 15.749 -4.305 1.00 1.00 C ATOM 340 O ASN A 100 9.830 14.956 -4.097 1.00 1.00 O ATOM 341 CB ASN A 100 9.952 17.733 -2.971 1.00 1.00 C ATOM 342 CG ASN A 100 11.013 17.939 -4.042 1.00 1.00 C ATOM 343 OD1 ASN A 100 10.801 17.796 -5.239 1.00 1.00 O ATOM 344 ND2 ASN A 100 12.197 18.307 -3.604 1.00 1.00 N ATOM 0 H ASN A 100 8.673 16.751 -1.305 1.00 1.00 H new ATOM 0 HA ASN A 100 8.024 17.629 -3.924 1.00 1.00 H new ATOM 0 HB2 ASN A 100 9.649 18.714 -2.606 1.00 1.00 H new ATOM 0 HB3 ASN A 100 10.417 17.211 -2.135 1.00 1.00 H new ATOM 0 HD21 ASN A 100 12.955 18.478 -4.265 1.00 1.00 H new ATOM 0 HD22 ASN A 100 12.358 18.422 -2.603 1.00 1.00 H new ATOM 351 N HIS A 101 8.021 15.566 -5.298 1.00 1.00 N ATOM 352 CA HIS A 101 8.099 14.505 -6.319 1.00 1.00 C ATOM 353 C HIS A 101 7.916 15.085 -7.736 1.00 1.00 C ATOM 354 O HIS A 101 6.994 15.869 -7.950 1.00 1.00 O ATOM 355 CB HIS A 101 7.095 13.394 -5.946 1.00 1.00 C ATOM 356 CG HIS A 101 7.301 12.103 -6.702 1.00 1.00 C ATOM 357 ND1 HIS A 101 8.232 11.115 -6.415 1.00 1.00 N ATOM 358 CD2 HIS A 101 6.590 11.692 -7.796 1.00 1.00 C ATOM 359 CE1 HIS A 101 8.088 10.130 -7.322 1.00 1.00 C ATOM 360 NE2 HIS A 101 7.101 10.461 -8.179 1.00 1.00 N ATOM 0 H HIS A 101 7.206 16.168 -5.416 1.00 1.00 H new ATOM 0 HA HIS A 101 9.090 14.052 -6.337 1.00 1.00 H new ATOM 0 HB2 HIS A 101 7.171 13.194 -4.877 1.00 1.00 H new ATOM 0 HB3 HIS A 101 6.083 13.755 -6.132 1.00 1.00 H new ATOM 0 HD1 HIS A 101 8.907 11.132 -5.651 1.00 1.00 H new ATOM 0 HD2 HIS A 101 5.782 12.226 -8.273 1.00 1.00 H new ATOM 0 HE1 HIS A 101 8.670 9.221 -7.357 1.00 1.00 H new ATOM 369 N LYS A 102 8.751 14.673 -8.704 1.00 1.00 N ATOM 370 CA LYS A 102 8.881 15.264 -10.061 1.00 1.00 C ATOM 371 C LYS A 102 7.553 15.466 -10.806 1.00 1.00 C ATOM 372 O LYS A 102 7.103 16.598 -10.951 1.00 1.00 O ATOM 373 CB LYS A 102 9.944 14.450 -10.832 1.00 1.00 C ATOM 374 CG LYS A 102 10.521 15.182 -12.034 1.00 1.00 C ATOM 375 CD LYS A 102 9.719 14.955 -13.317 1.00 1.00 C ATOM 376 CE LYS A 102 10.462 15.777 -14.352 1.00 1.00 C ATOM 377 NZ LYS A 102 9.879 15.629 -15.714 1.00 1.00 N ATOM 0 H LYS A 102 9.384 13.886 -8.564 1.00 1.00 H new ATOM 0 HA LYS A 102 9.224 16.295 -9.969 1.00 1.00 H new ATOM 0 HB2 LYS A 102 10.755 14.192 -10.151 1.00 1.00 H new ATOM 0 HB3 LYS A 102 9.499 13.513 -11.167 1.00 1.00 H new ATOM 0 HG2 LYS A 102 10.556 16.250 -11.819 1.00 1.00 H new ATOM 0 HG3 LYS A 102 11.549 14.855 -12.192 1.00 1.00 H new ATOM 0 HD2 LYS A 102 9.689 13.900 -13.589 1.00 1.00 H new ATOM 0 HD3 LYS A 102 8.686 15.286 -13.208 1.00 1.00 H new ATOM 0 HE2 LYS A 102 10.441 16.828 -14.062 1.00 1.00 H new ATOM 0 HE3 LYS A 102 11.508 15.473 -14.372 1.00 1.00 H new ATOM 0 HZ1 LYS A 102 10.215 16.403 -16.321 1.00 1.00 H new ATOM 0 HZ2 LYS A 102 10.173 14.718 -16.120 1.00 1.00 H new ATOM 0 HZ3 LYS A 102 8.841 15.662 -15.653 1.00 1.00 H new ATOM 391 N THR A 103 6.878 14.392 -11.221 1.00 1.00 N ATOM 392 CA THR A 103 5.643 14.485 -12.038 1.00 1.00 C ATOM 393 C THR A 103 4.520 15.213 -11.296 1.00 1.00 C ATOM 394 O THR A 103 3.830 16.058 -11.867 1.00 1.00 O ATOM 395 CB THR A 103 5.165 13.098 -12.487 1.00 1.00 C ATOM 396 OG1 THR A 103 6.228 12.439 -13.143 1.00 1.00 O ATOM 397 CG2 THR A 103 3.988 13.215 -13.451 1.00 1.00 C ATOM 0 H THR A 103 7.161 13.435 -11.008 1.00 1.00 H new ATOM 0 HA THR A 103 5.897 15.070 -12.922 1.00 1.00 H new ATOM 0 HB THR A 103 4.845 12.536 -11.609 1.00 1.00 H new ATOM 0 HG1 THR A 103 5.933 11.550 -13.433 1.00 1.00 H new ATOM 0 HG21 THR A 103 3.667 12.219 -13.755 1.00 1.00 H new ATOM 0 HG22 THR A 103 3.163 13.727 -12.957 1.00 1.00 H new ATOM 0 HG23 THR A 103 4.293 13.782 -14.330 1.00 1.00 H new ATOM 405 N LEU A 104 4.394 14.951 -9.989 1.00 1.00 N ATOM 406 CA LEU A 104 3.421 15.598 -9.103 1.00 1.00 C ATOM 407 C LEU A 104 3.605 17.128 -9.081 1.00 1.00 C ATOM 408 O LEU A 104 2.622 17.866 -9.128 1.00 1.00 O ATOM 409 CB LEU A 104 3.557 14.952 -7.706 1.00 1.00 C ATOM 410 CG LEU A 104 2.528 15.397 -6.651 1.00 1.00 C ATOM 411 CD1 LEU A 104 1.099 15.064 -7.077 1.00 1.00 C ATOM 412 CD2 LEU A 104 2.807 14.675 -5.334 1.00 1.00 C ATOM 0 H LEU A 104 4.979 14.268 -9.508 1.00 1.00 H new ATOM 0 HA LEU A 104 2.406 15.443 -9.469 1.00 1.00 H new ATOM 0 HB2 LEU A 104 3.486 13.870 -7.820 1.00 1.00 H new ATOM 0 HB3 LEU A 104 4.555 15.167 -7.324 1.00 1.00 H new ATOM 0 HG LEU A 104 2.621 16.477 -6.539 1.00 1.00 H new ATOM 0 HD11 LEU A 104 0.403 15.394 -6.306 1.00 1.00 H new ATOM 0 HD12 LEU A 104 0.871 15.573 -8.014 1.00 1.00 H new ATOM 0 HD13 LEU A 104 1.002 13.987 -7.216 1.00 1.00 H new ATOM 0 HD21 LEU A 104 2.079 14.989 -4.586 1.00 1.00 H new ATOM 0 HD22 LEU A 104 2.730 13.598 -5.486 1.00 1.00 H new ATOM 0 HD23 LEU A 104 3.811 14.922 -4.989 1.00 1.00 H new ATOM 424 N LYS A 105 4.857 17.613 -9.086 1.00 1.00 N ATOM 425 CA LYS A 105 5.175 19.045 -9.163 1.00 1.00 C ATOM 426 C LYS A 105 4.797 19.650 -10.513 1.00 1.00 C ATOM 427 O LYS A 105 4.304 20.774 -10.548 1.00 1.00 O ATOM 428 CB LYS A 105 6.666 19.262 -8.824 1.00 1.00 C ATOM 429 CG LYS A 105 7.145 20.724 -8.901 1.00 1.00 C ATOM 430 CD LYS A 105 6.444 21.708 -7.945 1.00 1.00 C ATOM 431 CE LYS A 105 6.866 21.475 -6.487 1.00 1.00 C ATOM 432 NZ LYS A 105 6.187 22.427 -5.563 1.00 1.00 N ATOM 0 H LYS A 105 5.683 17.016 -9.036 1.00 1.00 H new ATOM 0 HA LYS A 105 4.571 19.573 -8.425 1.00 1.00 H new ATOM 0 HB2 LYS A 105 6.853 18.887 -7.818 1.00 1.00 H new ATOM 0 HB3 LYS A 105 7.269 18.662 -9.505 1.00 1.00 H new ATOM 0 HG2 LYS A 105 8.215 20.748 -8.696 1.00 1.00 H new ATOM 0 HG3 LYS A 105 7.008 21.079 -9.923 1.00 1.00 H new ATOM 0 HD2 LYS A 105 6.683 22.731 -8.235 1.00 1.00 H new ATOM 0 HD3 LYS A 105 5.363 21.596 -8.034 1.00 1.00 H new ATOM 0 HE2 LYS A 105 6.627 20.452 -6.197 1.00 1.00 H new ATOM 0 HE3 LYS A 105 7.946 21.587 -6.397 1.00 1.00 H new ATOM 0 HZ1 LYS A 105 6.786 22.588 -4.729 1.00 1.00 H new ATOM 0 HZ2 LYS A 105 6.025 23.330 -6.053 1.00 1.00 H new ATOM 0 HZ3 LYS A 105 5.275 22.028 -5.262 1.00 1.00 H new ATOM 446 N GLU A 106 4.947 18.918 -11.616 1.00 1.00 N ATOM 447 CA GLU A 106 4.590 19.451 -12.936 1.00 1.00 C ATOM 448 C GLU A 106 3.090 19.660 -13.060 1.00 1.00 C ATOM 449 O GLU A 106 2.633 20.685 -13.547 1.00 1.00 O ATOM 450 CB GLU A 106 5.028 18.533 -14.075 1.00 1.00 C ATOM 451 CG GLU A 106 6.465 18.074 -13.912 1.00 1.00 C ATOM 452 CD GLU A 106 7.064 17.578 -15.238 1.00 1.00 C ATOM 453 OE1 GLU A 106 7.455 18.417 -16.084 1.00 1.00 O ATOM 454 OE2 GLU A 106 7.203 16.346 -15.429 1.00 1.00 O ATOM 0 H GLU A 106 5.309 17.964 -11.626 1.00 1.00 H new ATOM 0 HA GLU A 106 5.116 20.402 -13.019 1.00 1.00 H new ATOM 0 HB2 GLU A 106 4.372 17.664 -14.113 1.00 1.00 H new ATOM 0 HB3 GLU A 106 4.920 19.056 -15.025 1.00 1.00 H new ATOM 0 HG2 GLU A 106 7.067 18.897 -13.527 1.00 1.00 H new ATOM 0 HG3 GLU A 106 6.509 17.274 -13.173 1.00 1.00 H new ATOM 461 N TRP A 107 2.320 18.702 -12.561 1.00 1.00 N ATOM 462 CA TRP A 107 0.857 18.819 -12.538 1.00 1.00 C ATOM 463 C TRP A 107 0.370 20.008 -11.692 1.00 1.00 C ATOM 464 O TRP A 107 -0.564 20.710 -12.086 1.00 1.00 O ATOM 465 CB TRP A 107 0.228 17.517 -12.049 1.00 1.00 C ATOM 466 CG TRP A 107 0.451 16.259 -12.834 1.00 1.00 C ATOM 467 CD1 TRP A 107 1.233 16.080 -13.928 1.00 1.00 C ATOM 468 CD2 TRP A 107 -0.135 14.954 -12.551 1.00 1.00 C ATOM 469 NE1 TRP A 107 1.192 14.751 -14.308 1.00 1.00 N ATOM 470 CE2 TRP A 107 0.446 14.001 -13.432 1.00 1.00 C ATOM 471 CE3 TRP A 107 -1.095 14.478 -11.634 1.00 1.00 C ATOM 472 CZ2 TRP A 107 0.179 12.632 -13.337 1.00 1.00 C ATOM 473 CZ3 TRP A 107 -1.451 13.115 -11.606 1.00 1.00 C ATOM 474 CH2 TRP A 107 -0.793 12.188 -12.433 1.00 1.00 C ATOM 0 H TRP A 107 2.678 17.833 -12.165 1.00 1.00 H new ATOM 0 HA TRP A 107 0.536 19.010 -13.562 1.00 1.00 H new ATOM 0 HB2 TRP A 107 0.587 17.339 -11.035 1.00 1.00 H new ATOM 0 HB3 TRP A 107 -0.848 17.677 -11.983 1.00 1.00 H new ATOM 0 HD1 TRP A 107 1.799 16.854 -14.424 1.00 1.00 H new ATOM 0 HE1 TRP A 107 1.657 14.375 -15.134 1.00 1.00 H new ATOM 0 HE3 TRP A 107 -1.563 15.166 -10.945 1.00 1.00 H new ATOM 0 HZ2 TRP A 107 0.716 11.926 -13.953 1.00 1.00 H new ATOM 0 HZ3 TRP A 107 -2.236 12.780 -10.944 1.00 1.00 H new ATOM 0 HH2 TRP A 107 -1.036 11.138 -12.371 1.00 1.00 H new ATOM 485 N LYS A 108 1.036 20.301 -10.565 1.00 1.00 N ATOM 486 CA LYS A 108 0.756 21.514 -9.771 1.00 1.00 C ATOM 487 C LYS A 108 1.091 22.797 -10.539 1.00 1.00 C ATOM 488 O LYS A 108 0.372 23.785 -10.412 1.00 1.00 O ATOM 489 CB LYS A 108 1.547 21.510 -8.457 1.00 1.00 C ATOM 490 CG LYS A 108 1.025 20.460 -7.481 1.00 1.00 C ATOM 491 CD LYS A 108 1.719 20.642 -6.132 1.00 1.00 C ATOM 492 CE LYS A 108 1.328 19.490 -5.206 1.00 1.00 C ATOM 493 NZ LYS A 108 1.854 19.715 -3.840 1.00 1.00 N ATOM 0 H LYS A 108 1.776 19.714 -10.179 1.00 1.00 H new ATOM 0 HA LYS A 108 -0.313 21.499 -9.560 1.00 1.00 H new ATOM 0 HB2 LYS A 108 2.599 21.319 -8.667 1.00 1.00 H new ATOM 0 HB3 LYS A 108 1.489 22.496 -7.995 1.00 1.00 H new ATOM 0 HG2 LYS A 108 -0.054 20.558 -7.365 1.00 1.00 H new ATOM 0 HG3 LYS A 108 1.214 19.459 -7.869 1.00 1.00 H new ATOM 0 HD2 LYS A 108 2.800 20.666 -6.266 1.00 1.00 H new ATOM 0 HD3 LYS A 108 1.432 21.595 -5.688 1.00 1.00 H new ATOM 0 HE2 LYS A 108 0.243 19.396 -5.172 1.00 1.00 H new ATOM 0 HE3 LYS A 108 1.717 18.551 -5.601 1.00 1.00 H new ATOM 0 HZ1 LYS A 108 2.012 18.799 -3.374 1.00 1.00 H new ATOM 0 HZ2 LYS A 108 2.753 20.235 -3.895 1.00 1.00 H new ATOM 0 HZ3 LYS A 108 1.167 20.270 -3.290 1.00 1.00 H new ATOM 507 N ALA A 109 2.157 22.781 -11.350 1.00 1.00 N ATOM 508 CA ALA A 109 2.535 23.910 -12.189 1.00 1.00 C ATOM 509 C ALA A 109 1.489 24.148 -13.287 1.00 1.00 C ATOM 510 O ALA A 109 1.025 25.271 -13.508 1.00 1.00 O ATOM 511 CB ALA A 109 3.901 23.625 -12.829 1.00 1.00 C ATOM 0 H ALA A 109 2.780 21.978 -11.438 1.00 1.00 H new ATOM 0 HA ALA A 109 2.592 24.806 -11.571 1.00 1.00 H new ATOM 0 HB1 ALA A 109 4.190 24.466 -13.459 1.00 1.00 H new ATOM 0 HB2 ALA A 109 4.647 23.484 -12.047 1.00 1.00 H new ATOM 0 HB3 ALA A 109 3.837 22.722 -13.437 1.00 1.00 H new ATOM 517 N LYS A 110 1.132 23.055 -13.975 1.00 1.00 N ATOM 518 CA LYS A 110 0.317 23.043 -15.174 1.00 1.00 C ATOM 519 C LYS A 110 -1.156 23.411 -14.925 1.00 1.00 C ATOM 520 O LYS A 110 -1.747 24.108 -15.751 1.00 1.00 O ATOM 521 CB LYS A 110 0.423 21.672 -15.856 1.00 1.00 C ATOM 522 CG LYS A 110 1.694 21.474 -16.695 1.00 1.00 C ATOM 523 CD LYS A 110 1.587 20.112 -17.402 1.00 1.00 C ATOM 524 CE LYS A 110 2.840 19.664 -18.160 1.00 1.00 C ATOM 525 NZ LYS A 110 3.159 20.533 -19.329 1.00 1.00 N ATOM 0 H LYS A 110 1.422 22.120 -13.690 1.00 1.00 H new ATOM 0 HA LYS A 110 0.710 23.820 -15.829 1.00 1.00 H new ATOM 0 HB2 LYS A 110 0.383 20.896 -15.091 1.00 1.00 H new ATOM 0 HB3 LYS A 110 -0.446 21.532 -16.498 1.00 1.00 H new ATOM 0 HG2 LYS A 110 1.797 22.276 -17.426 1.00 1.00 H new ATOM 0 HG3 LYS A 110 2.579 21.506 -16.060 1.00 1.00 H new ATOM 0 HD2 LYS A 110 1.343 19.354 -16.658 1.00 1.00 H new ATOM 0 HD3 LYS A 110 0.753 20.150 -18.103 1.00 1.00 H new ATOM 0 HE2 LYS A 110 3.689 19.659 -17.476 1.00 1.00 H new ATOM 0 HE3 LYS A 110 2.702 18.639 -18.504 1.00 1.00 H new ATOM 0 HZ1 LYS A 110 4.016 20.180 -19.801 1.00 1.00 H new ATOM 0 HZ2 LYS A 110 2.364 20.519 -19.999 1.00 1.00 H new ATOM 0 HZ3 LYS A 110 3.320 21.508 -19.003 1.00 1.00 H new ATOM 539 N TRP A 111 -1.726 22.973 -13.792 1.00 1.00 N ATOM 540 CA TRP A 111 -3.152 23.160 -13.456 1.00 1.00 C ATOM 541 C TRP A 111 -3.387 23.652 -12.017 1.00 1.00 C ATOM 542 O TRP A 111 -4.029 24.690 -11.840 1.00 1.00 O ATOM 543 CB TRP A 111 -3.934 21.864 -13.725 1.00 1.00 C ATOM 544 CG TRP A 111 -3.805 21.325 -15.119 1.00 1.00 C ATOM 545 CD1 TRP A 111 -4.473 21.769 -16.207 1.00 1.00 C ATOM 546 CD2 TRP A 111 -2.896 20.295 -15.606 1.00 1.00 C ATOM 547 NE1 TRP A 111 -4.027 21.100 -17.332 1.00 1.00 N ATOM 548 CE2 TRP A 111 -3.034 20.196 -17.021 1.00 1.00 C ATOM 549 CE3 TRP A 111 -1.941 19.464 -14.993 1.00 1.00 C ATOM 550 CZ2 TRP A 111 -2.253 19.318 -17.790 1.00 1.00 C ATOM 551 CZ3 TRP A 111 -1.136 18.597 -15.756 1.00 1.00 C ATOM 552 CH2 TRP A 111 -1.299 18.509 -17.149 1.00 1.00 C ATOM 0 H TRP A 111 -1.205 22.472 -13.072 1.00 1.00 H new ATOM 0 HA TRP A 111 -3.523 23.953 -14.106 1.00 1.00 H new ATOM 0 HB2 TRP A 111 -3.596 21.101 -13.024 1.00 1.00 H new ATOM 0 HB3 TRP A 111 -4.989 22.044 -13.517 1.00 1.00 H new ATOM 0 HD1 TRP A 111 -5.239 22.531 -16.199 1.00 1.00 H new ATOM 0 HE1 TRP A 111 -4.387 21.256 -18.273 1.00 1.00 H new ATOM 0 HE3 TRP A 111 -1.823 19.491 -13.920 1.00 1.00 H new ATOM 0 HZ2 TRP A 111 -2.384 19.265 -18.861 1.00 1.00 H new ATOM 0 HZ3 TRP A 111 -0.386 17.994 -15.266 1.00 1.00 H new ATOM 0 HH2 TRP A 111 -0.694 17.823 -17.724 1.00 1.00 H new ATOM 563 N GLY A 112 -2.862 22.955 -10.998 1.00 1.00 N ATOM 564 CA GLY A 112 -2.883 23.420 -9.598 1.00 1.00 C ATOM 565 C GLY A 112 -2.981 22.305 -8.547 1.00 1.00 C ATOM 566 O GLY A 112 -3.487 21.223 -8.847 1.00 1.00 O ATOM 0 H GLY A 112 -2.409 22.049 -11.120 1.00 1.00 H new ATOM 0 HA2 GLY A 112 -1.979 23.999 -9.409 1.00 1.00 H new ATOM 0 HA3 GLY A 112 -3.727 24.097 -9.468 1.00 1.00 H new ATOM 570 N PRO A 113 -2.555 22.542 -7.292 1.00 1.00 N ATOM 571 CA PRO A 113 -2.591 21.528 -6.232 1.00 1.00 C ATOM 572 C PRO A 113 -4.010 21.068 -5.860 1.00 1.00 C ATOM 573 O PRO A 113 -4.207 19.908 -5.510 1.00 1.00 O ATOM 574 CB PRO A 113 -1.855 22.141 -5.036 1.00 1.00 C ATOM 575 CG PRO A 113 -1.929 23.647 -5.286 1.00 1.00 C ATOM 576 CD PRO A 113 -1.942 23.771 -6.806 1.00 1.00 C ATOM 0 HA PRO A 113 -2.108 20.614 -6.578 1.00 1.00 H new ATOM 0 HB2 PRO A 113 -2.330 21.869 -4.093 1.00 1.00 H new ATOM 0 HB3 PRO A 113 -0.822 21.796 -4.983 1.00 1.00 H new ATOM 0 HG2 PRO A 113 -2.825 24.081 -4.843 1.00 1.00 H new ATOM 0 HG3 PRO A 113 -1.075 24.166 -4.851 1.00 1.00 H new ATOM 0 HD2 PRO A 113 -2.510 24.645 -7.123 1.00 1.00 H new ATOM 0 HD3 PRO A 113 -0.932 23.888 -7.199 1.00 1.00 H new ATOM 584 N GLU A 114 -5.008 21.946 -5.994 1.00 1.00 N ATOM 585 CA GLU A 114 -6.424 21.629 -5.748 1.00 1.00 C ATOM 586 C GLU A 114 -6.922 20.553 -6.712 1.00 1.00 C ATOM 587 O GLU A 114 -7.543 19.565 -6.323 1.00 1.00 O ATOM 588 CB GLU A 114 -7.288 22.877 -5.953 1.00 1.00 C ATOM 589 CG GLU A 114 -6.737 24.135 -5.280 1.00 1.00 C ATOM 590 CD GLU A 114 -7.761 25.286 -5.322 1.00 1.00 C ATOM 591 OE1 GLU A 114 -7.768 26.066 -6.307 1.00 1.00 O ATOM 592 OE2 GLU A 114 -8.566 25.424 -4.367 1.00 1.00 O ATOM 0 H GLU A 114 -4.856 22.913 -6.281 1.00 1.00 H new ATOM 0 HA GLU A 114 -6.503 21.270 -4.722 1.00 1.00 H new ATOM 0 HB2 GLU A 114 -7.389 23.064 -7.022 1.00 1.00 H new ATOM 0 HB3 GLU A 114 -8.289 22.680 -5.568 1.00 1.00 H new ATOM 0 HG2 GLU A 114 -6.479 23.913 -4.245 1.00 1.00 H new ATOM 0 HG3 GLU A 114 -5.818 24.444 -5.779 1.00 1.00 H new ATOM 599 N ALA A 115 -6.590 20.760 -7.988 1.00 1.00 N ATOM 600 CA ALA A 115 -6.885 19.850 -9.088 1.00 1.00 C ATOM 601 C ALA A 115 -6.249 18.483 -8.821 1.00 1.00 C ATOM 602 O ALA A 115 -6.908 17.446 -8.802 1.00 1.00 O ATOM 603 CB ALA A 115 -6.320 20.452 -10.378 1.00 1.00 C ATOM 0 H ALA A 115 -6.091 21.596 -8.291 1.00 1.00 H new ATOM 0 HA ALA A 115 -7.962 19.714 -9.183 1.00 1.00 H new ATOM 0 HB1 ALA A 115 -6.531 19.785 -11.214 1.00 1.00 H new ATOM 0 HB2 ALA A 115 -6.784 21.421 -10.561 1.00 1.00 H new ATOM 0 HB3 ALA A 115 -5.242 20.579 -10.278 1.00 1.00 H new ATOM 609 N VAL A 116 -4.947 18.533 -8.540 1.00 1.00 N ATOM 610 CA VAL A 116 -4.082 17.391 -8.318 1.00 1.00 C ATOM 611 C VAL A 116 -4.588 16.507 -7.176 1.00 1.00 C ATOM 612 O VAL A 116 -4.742 15.300 -7.354 1.00 1.00 O ATOM 613 CB VAL A 116 -2.654 17.911 -8.094 1.00 1.00 C ATOM 614 CG1 VAL A 116 -1.674 16.891 -7.513 1.00 1.00 C ATOM 615 CG2 VAL A 116 -2.098 18.413 -9.434 1.00 1.00 C ATOM 0 H VAL A 116 -4.449 19.419 -8.459 1.00 1.00 H new ATOM 0 HA VAL A 116 -4.085 16.741 -9.193 1.00 1.00 H new ATOM 0 HB VAL A 116 -2.740 18.702 -7.349 1.00 1.00 H new ATOM 0 HG11 VAL A 116 -0.695 17.355 -7.393 1.00 1.00 H new ATOM 0 HG12 VAL A 116 -2.036 16.550 -6.543 1.00 1.00 H new ATOM 0 HG13 VAL A 116 -1.592 16.040 -8.189 1.00 1.00 H new ATOM 0 HG21 VAL A 116 -1.084 18.786 -9.290 1.00 1.00 H new ATOM 0 HG22 VAL A 116 -2.085 17.593 -10.153 1.00 1.00 H new ATOM 0 HG23 VAL A 116 -2.730 19.217 -9.812 1.00 1.00 H new ATOM 625 N GLU A 117 -4.938 17.101 -6.031 1.00 1.00 N ATOM 626 CA GLU A 117 -5.558 16.398 -4.902 1.00 1.00 C ATOM 627 C GLU A 117 -6.950 15.842 -5.245 1.00 1.00 C ATOM 628 O GLU A 117 -7.305 14.744 -4.813 1.00 1.00 O ATOM 629 CB GLU A 117 -5.728 17.386 -3.733 1.00 1.00 C ATOM 630 CG GLU A 117 -4.444 17.643 -2.940 1.00 1.00 C ATOM 631 CD GLU A 117 -4.274 16.564 -1.848 1.00 1.00 C ATOM 632 OE1 GLU A 117 -4.099 15.371 -2.181 1.00 1.00 O ATOM 633 OE2 GLU A 117 -4.402 16.870 -0.638 1.00 1.00 O ATOM 0 H GLU A 117 -4.797 18.097 -5.859 1.00 1.00 H new ATOM 0 HA GLU A 117 -4.906 15.563 -4.645 1.00 1.00 H new ATOM 0 HB2 GLU A 117 -6.097 18.334 -4.124 1.00 1.00 H new ATOM 0 HB3 GLU A 117 -6.490 17.002 -3.055 1.00 1.00 H new ATOM 0 HG2 GLU A 117 -3.584 17.633 -3.610 1.00 1.00 H new ATOM 0 HG3 GLU A 117 -4.480 18.632 -2.483 1.00 1.00 H new ATOM 640 N SER A 118 -7.745 16.582 -6.030 1.00 1.00 N ATOM 641 CA SER A 118 -9.113 16.178 -6.400 1.00 1.00 C ATOM 642 C SER A 118 -9.138 14.916 -7.267 1.00 1.00 C ATOM 643 O SER A 118 -10.087 14.131 -7.193 1.00 1.00 O ATOM 644 CB SER A 118 -9.868 17.306 -7.118 1.00 1.00 C ATOM 645 OG SER A 118 -10.014 18.439 -6.279 1.00 1.00 O ATOM 0 H SER A 118 -7.460 17.477 -6.427 1.00 1.00 H new ATOM 0 HA SER A 118 -9.618 15.956 -5.460 1.00 1.00 H new ATOM 0 HB2 SER A 118 -9.331 17.588 -8.024 1.00 1.00 H new ATOM 0 HB3 SER A 118 -10.851 16.950 -7.427 1.00 1.00 H new ATOM 0 HG SER A 118 -9.217 19.005 -6.352 1.00 1.00 H new ATOM 651 N TRP A 119 -8.083 14.685 -8.052 1.00 1.00 N ATOM 652 CA TRP A 119 -7.891 13.467 -8.846 1.00 1.00 C ATOM 653 C TRP A 119 -7.339 12.264 -8.046 1.00 1.00 C ATOM 654 O TRP A 119 -7.193 11.182 -8.618 1.00 1.00 O ATOM 655 CB TRP A 119 -6.942 13.754 -10.020 1.00 1.00 C ATOM 656 CG TRP A 119 -7.180 14.967 -10.875 1.00 1.00 C ATOM 657 CD1 TRP A 119 -8.374 15.537 -11.156 1.00 1.00 C ATOM 658 CD2 TRP A 119 -6.185 15.769 -11.590 1.00 1.00 C ATOM 659 NE1 TRP A 119 -8.188 16.652 -11.950 1.00 1.00 N ATOM 660 CE2 TRP A 119 -6.855 16.841 -12.252 1.00 1.00 C ATOM 661 CE3 TRP A 119 -4.782 15.693 -11.755 1.00 1.00 C ATOM 662 CZ2 TRP A 119 -6.171 17.799 -13.014 1.00 1.00 C ATOM 663 CZ3 TRP A 119 -4.087 16.643 -12.530 1.00 1.00 C ATOM 664 CH2 TRP A 119 -4.776 17.698 -13.152 1.00 1.00 C ATOM 0 H TRP A 119 -7.320 15.354 -8.156 1.00 1.00 H new ATOM 0 HA TRP A 119 -8.885 13.185 -9.193 1.00 1.00 H new ATOM 0 HB2 TRP A 119 -5.933 13.831 -9.615 1.00 1.00 H new ATOM 0 HB3 TRP A 119 -6.957 12.883 -10.675 1.00 1.00 H new ATOM 0 HD1 TRP A 119 -9.331 15.174 -10.811 1.00 1.00 H new ATOM 0 HE1 TRP A 119 -8.941 17.259 -12.272 1.00 1.00 H new ATOM 0 HE3 TRP A 119 -4.234 14.893 -11.279 1.00 1.00 H new ATOM 0 HZ2 TRP A 119 -6.710 18.605 -13.489 1.00 1.00 H new ATOM 0 HZ3 TRP A 119 -3.017 16.560 -12.647 1.00 1.00 H new ATOM 0 HH2 TRP A 119 -4.235 18.429 -13.734 1.00 1.00 H new ATOM 675 N ALA A 120 -6.971 12.422 -6.766 1.00 1.00 N ATOM 676 CA ALA A 120 -6.309 11.377 -6.003 1.00 1.00 C ATOM 677 C ALA A 120 -7.201 10.181 -5.623 1.00 1.00 C ATOM 678 O ALA A 120 -8.434 10.194 -5.678 1.00 1.00 O ATOM 679 CB ALA A 120 -5.628 11.958 -4.754 1.00 1.00 C ATOM 0 H ALA A 120 -7.128 13.281 -6.239 1.00 1.00 H new ATOM 0 HA ALA A 120 -5.559 10.971 -6.681 1.00 1.00 H new ATOM 0 HB1 ALA A 120 -5.140 11.156 -4.200 1.00 1.00 H new ATOM 0 HB2 ALA A 120 -4.885 12.696 -5.055 1.00 1.00 H new ATOM 0 HB3 ALA A 120 -6.376 12.434 -4.120 1.00 1.00 H new ATOM 685 N THR A 121 -6.488 9.170 -5.148 1.00 1.00 N ATOM 686 CA THR A 121 -6.916 7.833 -4.709 1.00 1.00 C ATOM 687 C THR A 121 -6.093 7.432 -3.494 1.00 1.00 C ATOM 688 O THR A 121 -4.877 7.576 -3.497 1.00 1.00 O ATOM 689 CB THR A 121 -6.644 6.821 -5.822 1.00 1.00 C ATOM 690 OG1 THR A 121 -7.413 7.118 -6.973 1.00 1.00 O ATOM 691 CG2 THR A 121 -7.015 5.415 -5.358 1.00 1.00 C ATOM 0 H THR A 121 -5.478 9.271 -5.046 1.00 1.00 H new ATOM 0 HA THR A 121 -7.979 7.850 -4.469 1.00 1.00 H new ATOM 0 HB THR A 121 -5.582 6.875 -6.063 1.00 1.00 H new ATOM 0 HG1 THR A 121 -7.222 6.459 -7.673 1.00 1.00 H new ATOM 0 HG21 THR A 121 -6.817 4.703 -6.159 1.00 1.00 H new ATOM 0 HG22 THR A 121 -6.420 5.152 -4.483 1.00 1.00 H new ATOM 0 HG23 THR A 121 -8.073 5.385 -5.099 1.00 1.00 H new ATOM 699 N LEU A 122 -6.745 6.881 -2.478 1.00 1.00 N ATOM 700 CA LEU A 122 -6.115 6.393 -1.254 1.00 1.00 C ATOM 701 C LEU A 122 -5.678 4.935 -1.430 1.00 1.00 C ATOM 702 O LEU A 122 -6.486 4.069 -1.766 1.00 1.00 O ATOM 703 CB LEU A 122 -7.124 6.550 -0.105 1.00 1.00 C ATOM 704 CG LEU A 122 -6.744 5.823 1.201 1.00 1.00 C ATOM 705 CD1 LEU A 122 -5.402 6.267 1.788 1.00 1.00 C ATOM 706 CD2 LEU A 122 -7.823 6.053 2.260 1.00 1.00 C ATOM 0 H LEU A 122 -7.757 6.757 -2.481 1.00 1.00 H new ATOM 0 HA LEU A 122 -5.218 6.969 -1.024 1.00 1.00 H new ATOM 0 HB2 LEU A 122 -7.244 7.612 0.110 1.00 1.00 H new ATOM 0 HB3 LEU A 122 -8.093 6.181 -0.440 1.00 1.00 H new ATOM 0 HG LEU A 122 -6.657 4.769 0.936 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -5.204 5.711 2.705 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -4.608 6.073 1.067 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -5.437 7.333 2.011 1.00 1.00 H new ATOM 0 HD21 LEU A 122 -7.547 5.536 3.179 1.00 1.00 H new ATOM 0 HD22 LEU A 122 -7.917 7.121 2.458 1.00 1.00 H new ATOM 0 HD23 LEU A 122 -8.776 5.666 1.899 1.00 1.00 H new ATOM 718 N LEU A 123 -4.404 4.685 -1.144 1.00 1.00 N ATOM 719 CA LEU A 123 -3.742 3.390 -1.162 1.00 1.00 C ATOM 720 C LEU A 123 -2.938 3.180 0.138 1.00 1.00 C ATOM 721 O LEU A 123 -2.356 4.099 0.717 1.00 1.00 O ATOM 722 CB LEU A 123 -2.822 3.331 -2.397 1.00 1.00 C ATOM 723 CG LEU A 123 -3.526 3.565 -3.742 1.00 1.00 C ATOM 724 CD1 LEU A 123 -2.469 3.561 -4.838 1.00 1.00 C ATOM 725 CD2 LEU A 123 -4.544 2.477 -4.096 1.00 1.00 C ATOM 0 H LEU A 123 -3.766 5.434 -0.876 1.00 1.00 H new ATOM 0 HA LEU A 123 -4.481 2.591 -1.222 1.00 1.00 H new ATOM 0 HB2 LEU A 123 -2.035 4.076 -2.281 1.00 1.00 H new ATOM 0 HB3 LEU A 123 -2.336 2.356 -2.423 1.00 1.00 H new ATOM 0 HG LEU A 123 -4.060 4.512 -3.660 1.00 1.00 H new ATOM 0 HD11 LEU A 123 -2.946 3.726 -5.804 1.00 1.00 H new ATOM 0 HD12 LEU A 123 -1.747 4.355 -4.650 1.00 1.00 H new ATOM 0 HD13 LEU A 123 -1.956 2.599 -4.846 1.00 1.00 H new ATOM 0 HD21 LEU A 123 -5.002 2.707 -5.058 1.00 1.00 H new ATOM 0 HD22 LEU A 123 -4.040 1.512 -4.155 1.00 1.00 H new ATOM 0 HD23 LEU A 123 -5.315 2.436 -3.327 1.00 1.00 H new ATOM 737 N GLY A 124 -2.908 1.932 0.586 1.00 1.00 N ATOM 738 CA GLY A 124 -2.060 1.471 1.700 1.00 1.00 C ATOM 739 C GLY A 124 -0.552 1.740 1.502 1.00 1.00 C ATOM 740 O GLY A 124 -0.082 1.896 0.371 1.00 1.00 O ATOM 0 H GLY A 124 -3.480 1.190 0.184 1.00 1.00 H new ATOM 0 HA2 GLY A 124 -2.387 1.960 2.617 1.00 1.00 H new ATOM 0 HA3 GLY A 124 -2.211 0.400 1.838 1.00 1.00 H new ATOM 744 N HIS A 125 0.203 1.793 2.610 1.00 1.00 N ATOM 745 CA HIS A 125 1.662 2.033 2.637 1.00 1.00 C ATOM 746 C HIS A 125 2.458 1.004 1.803 1.00 1.00 C ATOM 747 O HIS A 125 2.276 -0.219 2.015 1.00 1.00 O ATOM 748 CB HIS A 125 2.146 2.075 4.091 1.00 1.00 C ATOM 749 CG HIS A 125 3.627 2.331 4.256 1.00 1.00 C ATOM 750 ND1 HIS A 125 4.639 1.389 4.173 1.00 1.00 N ATOM 751 CD2 HIS A 125 4.205 3.523 4.596 1.00 1.00 C ATOM 752 CE1 HIS A 125 5.809 2.003 4.457 1.00 1.00 C ATOM 753 NE2 HIS A 125 5.569 3.303 4.719 1.00 1.00 N ATOM 0 H HIS A 125 -0.192 1.667 3.542 1.00 1.00 H new ATOM 0 HA HIS A 125 1.850 2.998 2.166 1.00 1.00 H new ATOM 0 HB2 HIS A 125 1.595 2.852 4.621 1.00 1.00 H new ATOM 0 HB3 HIS A 125 1.899 1.127 4.569 1.00 1.00 H new ATOM 0 HD2 HIS A 125 3.693 4.463 4.742 1.00 1.00 H new ATOM 0 HE1 HIS A 125 6.779 1.529 4.472 1.00 1.00 H new ATOM 0 HE2 HIS A 125 6.269 4.003 4.965 1.00 1.00 H new TER 762 HIS A 125 ATOM 763 O5' DC B 1 -3.671 28.094 6.591 1.00 1.00 O ATOM 764 C5' DC B 1 -3.825 29.206 7.482 1.00 1.00 C ATOM 765 C4' DC B 1 -3.002 29.093 8.783 1.00 1.00 C ATOM 766 O4' DC B 1 -3.510 28.061 9.623 1.00 1.00 O ATOM 767 C3' DC B 1 -1.517 28.831 8.503 1.00 1.00 C ATOM 768 O3' DC B 1 -0.703 29.736 9.253 1.00 1.00 O ATOM 769 C2' DC B 1 -1.355 27.369 8.894 1.00 1.00 C ATOM 770 C1' DC B 1 -2.474 27.136 9.911 1.00 1.00 C ATOM 771 N1 DC B 1 -3.034 25.763 9.878 1.00 1.00 N ATOM 772 C2 DC B 1 -3.212 25.036 11.060 1.00 1.00 C ATOM 773 O2 DC B 1 -2.852 25.465 12.158 1.00 1.00 O ATOM 774 N3 DC B 1 -3.801 23.813 11.041 1.00 1.00 N ATOM 775 C4 DC B 1 -4.162 23.317 9.873 1.00 1.00 C ATOM 776 N4 DC B 1 -4.751 22.154 9.913 1.00 1.00 N ATOM 777 C5 DC B 1 -3.996 24.007 8.639 1.00 1.00 C ATOM 778 C6 DC B 1 -3.432 25.233 8.689 1.00 1.00 C ATOM 0 H5' DC B 1 -4.879 29.307 7.740 1.00 1.00 H new ATOM 0 H5'' DC B 1 -3.535 30.118 6.960 1.00 1.00 H new ATOM 0 H4' DC B 1 -3.094 30.053 9.292 1.00 1.00 H new ATOM 0 H3' DC B 1 -1.204 28.999 7.472 1.00 1.00 H new ATOM 0 H2' DC B 1 -1.456 26.711 8.031 1.00 1.00 H new ATOM 0 H2'' DC B 1 -0.374 27.178 9.328 1.00 1.00 H new ATOM 0 HO5' DC B 1 -4.222 28.236 5.793 1.00 1.00 H new ATOM 0 H1' DC B 1 -2.053 27.272 10.907 1.00 1.00 H new ATOM 0 H41 DC B 1 -5.058 21.708 9.049 1.00 1.00 H new ATOM 0 H42 DC B 1 -4.904 21.691 10.809 1.00 1.00 H new ATOM 0 H5 DC B 1 -4.308 23.569 7.703 1.00 1.00 H new ATOM 0 H6 DC B 1 -3.296 25.797 7.778 1.00 1.00 H new ATOM 791 P DG B 2 0.918 29.766 9.154 1.00 1.00 P ATOM 792 OP1 DG B 2 1.363 31.145 9.497 1.00 1.00 O ATOM 793 OP2 DG B 2 1.329 29.203 7.838 1.00 1.00 O ATOM 794 O5' DG B 2 1.414 28.750 10.324 1.00 1.00 O ATOM 795 C5' DG B 2 1.264 29.076 11.706 1.00 1.00 C ATOM 796 C4' DG B 2 1.810 28.008 12.677 1.00 1.00 C ATOM 797 O4' DG B 2 0.929 26.885 12.754 1.00 1.00 O ATOM 798 C3' DG B 2 3.220 27.502 12.304 1.00 1.00 C ATOM 799 O3' DG B 2 4.052 27.485 13.463 1.00 1.00 O ATOM 800 C2' DG B 2 2.888 26.124 11.732 1.00 1.00 C ATOM 801 C1' DG B 2 1.687 25.698 12.573 1.00 1.00 C ATOM 802 N9 DG B 2 0.861 24.659 11.925 1.00 1.00 N ATOM 803 C8 DG B 2 0.431 24.633 10.629 1.00 1.00 C ATOM 804 N7 DG B 2 -0.338 23.623 10.325 1.00 1.00 N ATOM 805 C5 DG B 2 -0.386 22.891 11.522 1.00 1.00 C ATOM 806 C6 DG B 2 -1.050 21.654 11.860 1.00 1.00 C ATOM 807 O6 DG B 2 -1.808 20.964 11.178 1.00 1.00 O ATOM 808 N1 DG B 2 -0.780 21.215 13.138 1.00 1.00 N ATOM 809 C2 DG B 2 -0.008 21.893 14.015 1.00 1.00 C ATOM 810 N2 DG B 2 0.156 21.340 15.187 1.00 1.00 N ATOM 811 N3 DG B 2 0.594 23.056 13.770 1.00 1.00 N ATOM 812 C4 DG B 2 0.372 23.507 12.498 1.00 1.00 C ATOM 0 H5' DG B 2 0.206 29.234 11.917 1.00 1.00 H new ATOM 0 H5'' DG B 2 1.772 30.020 11.901 1.00 1.00 H new ATOM 0 H4' DG B 2 1.877 28.507 13.644 1.00 1.00 H new ATOM 0 H3' DG B 2 3.788 28.109 11.599 1.00 1.00 H new ATOM 0 H2' DG B 2 2.643 26.173 10.671 1.00 1.00 H new ATOM 0 H2'' DG B 2 3.722 25.430 11.835 1.00 1.00 H new ATOM 0 H1' DG B 2 2.020 25.251 13.510 1.00 1.00 H new ATOM 0 H8 DG B 2 0.706 25.391 9.910 1.00 1.00 H new ATOM 0 H1 DG B 2 -1.186 20.329 13.439 1.00 1.00 H new ATOM 0 H21 DG B 2 0.728 21.802 15.894 1.00 1.00 H new ATOM 0 H22 DG B 2 -0.288 20.446 15.396 1.00 1.00 H new ATOM 824 P DC B 3 5.604 27.001 13.434 1.00 1.00 P ATOM 825 OP1 DC B 3 6.353 27.805 14.440 1.00 1.00 O ATOM 826 OP2 DC B 3 6.099 26.988 12.027 1.00 1.00 O ATOM 827 O5' DC B 3 5.514 25.467 13.954 1.00 1.00 O ATOM 828 C5' DC B 3 5.120 25.178 15.294 1.00 1.00 C ATOM 829 C4' DC B 3 5.015 23.676 15.610 1.00 1.00 C ATOM 830 O4' DC B 3 3.927 23.109 14.895 1.00 1.00 O ATOM 831 C3' DC B 3 6.297 22.884 15.299 1.00 1.00 C ATOM 832 O3' DC B 3 6.862 22.381 16.510 1.00 1.00 O ATOM 833 C2' DC B 3 5.817 21.783 14.350 1.00 1.00 C ATOM 834 C1' DC B 3 4.293 21.828 14.423 1.00 1.00 C ATOM 835 N1 DC B 3 3.657 21.602 13.104 1.00 1.00 N ATOM 836 C2 DC B 3 2.851 20.479 12.898 1.00 1.00 C ATOM 837 O2 DC B 3 2.696 19.613 13.760 1.00 1.00 O ATOM 838 N3 DC B 3 2.203 20.297 11.724 1.00 1.00 N ATOM 839 C4 DC B 3 2.377 21.190 10.774 1.00 1.00 C ATOM 840 N4 DC B 3 1.706 20.969 9.679 1.00 1.00 N ATOM 841 C5 DC B 3 3.213 22.336 10.905 1.00 1.00 C ATOM 842 C6 DC B 3 3.842 22.507 12.096 1.00 1.00 C ATOM 0 H5' DC B 3 4.155 25.647 15.486 1.00 1.00 H new ATOM 0 H5'' DC B 3 5.837 25.633 15.978 1.00 1.00 H new ATOM 0 H4' DC B 3 4.855 23.602 16.686 1.00 1.00 H new ATOM 0 H3' DC B 3 7.092 23.474 14.843 1.00 1.00 H new ATOM 0 H2' DC B 3 6.168 21.959 13.333 1.00 1.00 H new ATOM 0 H2'' DC B 3 6.197 20.808 14.654 1.00 1.00 H new ATOM 0 H1' DC B 3 3.952 21.033 15.086 1.00 1.00 H new ATOM 0 H41 DC B 3 1.785 21.615 8.893 1.00 1.00 H new ATOM 0 H42 DC B 3 1.102 20.150 9.608 1.00 1.00 H new ATOM 0 H5 DC B 3 3.341 23.037 10.094 1.00 1.00 H new ATOM 0 H6 DC B 3 4.489 23.358 12.247 1.00 1.00 H new ATOM 854 P DA B 4 8.318 21.654 16.570 1.00 1.00 P ATOM 855 OP1 DA B 4 8.772 21.673 17.990 1.00 1.00 O ATOM 856 OP2 DA B 4 9.210 22.260 15.542 1.00 1.00 O ATOM 857 O5' DA B 4 8.021 20.116 16.148 1.00 1.00 O ATOM 858 C5' DA B 4 7.191 19.281 16.957 1.00 1.00 C ATOM 859 C4' DA B 4 6.876 17.913 16.330 1.00 1.00 C ATOM 860 O4' DA B 4 5.917 18.020 15.281 1.00 1.00 O ATOM 861 C3' DA B 4 8.120 17.183 15.784 1.00 1.00 C ATOM 862 O3' DA B 4 8.249 15.906 16.400 1.00 1.00 O ATOM 863 C2' DA B 4 7.822 17.143 14.283 1.00 1.00 C ATOM 864 C1' DA B 4 6.297 17.132 14.246 1.00 1.00 C ATOM 865 N9 DA B 4 5.775 17.625 12.962 1.00 1.00 N ATOM 866 C8 DA B 4 6.114 18.798 12.350 1.00 1.00 C ATOM 867 N7 DA B 4 5.443 19.059 11.259 1.00 1.00 N ATOM 868 C5 DA B 4 4.630 17.921 11.126 1.00 1.00 C ATOM 869 C6 DA B 4 3.674 17.484 10.179 1.00 1.00 C ATOM 870 N6 DA B 4 3.291 18.202 9.146 1.00 1.00 N ATOM 871 N1 DA B 4 3.083 16.289 10.269 1.00 1.00 N ATOM 872 C2 DA B 4 3.412 15.526 11.304 1.00 1.00 C ATOM 873 N3 DA B 4 4.274 15.794 12.281 1.00 1.00 N ATOM 874 C4 DA B 4 4.852 17.022 12.137 1.00 1.00 C ATOM 0 H5' DA B 4 6.254 19.802 17.156 1.00 1.00 H new ATOM 0 H5'' DA B 4 7.679 19.124 17.919 1.00 1.00 H new ATOM 0 H4' DA B 4 6.469 17.322 17.150 1.00 1.00 H new ATOM 0 H3' DA B 4 9.080 17.657 15.988 1.00 1.00 H new ATOM 0 H2' DA B 4 8.234 18.009 13.765 1.00 1.00 H new ATOM 0 H2'' DA B 4 8.245 16.257 13.809 1.00 1.00 H new ATOM 0 H1' DA B 4 5.905 16.122 14.368 1.00 1.00 H new ATOM 0 H8 DA B 4 6.876 19.458 12.737 1.00 1.00 H new ATOM 0 H61 DA B 4 2.597 17.832 8.497 1.00 1.00 H new ATOM 0 H62 DA B 4 3.688 19.129 8.994 1.00 1.00 H new ATOM 0 H2 DA B 4 2.918 14.567 11.360 1.00 1.00 H new ATOM 886 P DT B 5 9.553 14.959 16.184 1.00 1.00 P ATOM 887 OP1 DT B 5 9.683 14.078 17.382 1.00 1.00 O ATOM 888 OP2 DT B 5 10.719 15.806 15.799 1.00 1.00 O ATOM 889 O5' DT B 5 9.147 14.039 14.914 1.00 1.00 O ATOM 890 C5' DT B 5 8.088 13.090 15.013 1.00 1.00 C ATOM 891 C4' DT B 5 7.782 12.370 13.691 1.00 1.00 C ATOM 892 O4' DT B 5 7.153 13.259 12.768 1.00 1.00 O ATOM 893 C3' DT B 5 9.030 11.762 13.020 1.00 1.00 C ATOM 894 O3' DT B 5 8.807 10.376 12.777 1.00 1.00 O ATOM 895 C2' DT B 5 9.158 12.624 11.764 1.00 1.00 C ATOM 896 C1' DT B 5 7.712 13.028 11.489 1.00 1.00 C ATOM 897 N1 DT B 5 7.530 14.245 10.645 1.00 1.00 N ATOM 898 C2 DT B 5 6.572 14.196 9.624 1.00 1.00 C ATOM 899 O2 DT B 5 5.963 13.176 9.313 1.00 1.00 O ATOM 900 N3 DT B 5 6.321 15.358 8.932 1.00 1.00 N ATOM 901 C4 DT B 5 6.991 16.546 9.119 1.00 1.00 C ATOM 902 O4 DT B 5 6.664 17.517 8.442 1.00 1.00 O ATOM 903 C5 DT B 5 8.043 16.513 10.136 1.00 1.00 C ATOM 904 C7 DT B 5 8.912 17.732 10.381 1.00 1.00 C ATOM 905 C6 DT B 5 8.262 15.392 10.869 1.00 1.00 C ATOM 0 H5' DT B 5 7.187 13.598 15.357 1.00 1.00 H new ATOM 0 H5'' DT B 5 8.345 12.349 15.770 1.00 1.00 H new ATOM 0 H4' DT B 5 7.113 11.549 13.951 1.00 1.00 H new ATOM 0 H3' DT B 5 9.952 11.777 13.602 1.00 1.00 H new ATOM 0 H2' DT B 5 9.797 13.491 11.931 1.00 1.00 H new ATOM 0 H2'' DT B 5 9.588 12.067 10.932 1.00 1.00 H new ATOM 0 H1' DT B 5 7.234 12.235 10.913 1.00 1.00 H new ATOM 0 H3 DT B 5 5.583 15.338 8.228 1.00 1.00 H new ATOM 0 H71 DT B 5 9.228 17.750 11.424 1.00 1.00 H new ATOM 0 H72 DT B 5 9.790 17.689 9.736 1.00 1.00 H new ATOM 0 H73 DT B 5 8.343 18.635 10.159 1.00 1.00 H new ATOM 0 H6 DT B 5 9.020 15.398 11.638 1.00 1.00 H new ATOM 918 P DA B 6 9.889 9.408 12.048 1.00 1.00 P ATOM 919 OP1 DA B 6 9.845 8.080 12.723 1.00 1.00 O ATOM 920 OP2 DA B 6 11.201 10.108 11.933 1.00 1.00 O ATOM 921 O5' DA B 6 9.241 9.262 10.567 1.00 1.00 O ATOM 922 C5' DA B 6 7.974 8.634 10.407 1.00 1.00 C ATOM 923 C4' DA B 6 7.469 8.555 8.959 1.00 1.00 C ATOM 924 O4' DA B 6 7.115 9.853 8.479 1.00 1.00 O ATOM 925 C3' DA B 6 8.469 7.925 7.979 1.00 1.00 C ATOM 926 O3' DA B 6 7.742 7.058 7.116 1.00 1.00 O ATOM 927 C2' DA B 6 9.065 9.169 7.331 1.00 1.00 C ATOM 928 C1' DA B 6 7.901 10.156 7.337 1.00 1.00 C ATOM 929 N9 DA B 6 8.347 11.562 7.402 1.00 1.00 N ATOM 930 C8 DA B 6 9.364 12.091 8.150 1.00 1.00 C ATOM 931 N7 DA B 6 9.572 13.369 7.968 1.00 1.00 N ATOM 932 C5 DA B 6 8.616 13.695 6.997 1.00 1.00 C ATOM 933 C6 DA B 6 8.260 14.875 6.301 1.00 1.00 C ATOM 934 N6 DA B 6 8.840 16.052 6.454 1.00 1.00 N ATOM 935 N1 DA B 6 7.283 14.876 5.397 1.00 1.00 N ATOM 936 C2 DA B 6 6.642 13.738 5.167 1.00 1.00 C ATOM 937 N3 DA B 6 6.842 12.563 5.750 1.00 1.00 N ATOM 938 C4 DA B 6 7.855 12.606 6.659 1.00 1.00 C ATOM 0 H5' DA B 6 7.239 9.175 11.004 1.00 1.00 H new ATOM 0 H5'' DA B 6 8.032 7.624 10.812 1.00 1.00 H new ATOM 0 H4' DA B 6 6.598 7.901 8.996 1.00 1.00 H new ATOM 0 H3' DA B 6 9.260 7.292 8.382 1.00 1.00 H new ATOM 0 H2' DA B 6 9.917 9.548 7.895 1.00 1.00 H new ATOM 0 H2'' DA B 6 9.417 8.967 6.319 1.00 1.00 H new ATOM 0 H1' DA B 6 7.339 10.055 6.408 1.00 1.00 H new ATOM 0 H8 DA B 6 9.949 11.499 8.837 1.00 1.00 H new ATOM 0 H61 DA B 6 8.519 16.853 5.910 1.00 1.00 H new ATOM 0 H62 DA B 6 9.608 16.160 7.116 1.00 1.00 H new ATOM 0 H2 DA B 6 5.866 13.772 4.417 1.00 1.00 H new ATOM 950 P DT B 7 8.420 6.214 5.915 1.00 1.00 P ATOM 951 OP1 DT B 7 7.515 5.072 5.596 1.00 1.00 O ATOM 952 OP2 DT B 7 9.853 5.941 6.227 1.00 1.00 O ATOM 953 O5' DT B 7 8.331 7.273 4.703 1.00 1.00 O ATOM 954 C5' DT B 7 7.065 7.754 4.290 1.00 1.00 C ATOM 955 C4' DT B 7 7.144 8.886 3.267 1.00 1.00 C ATOM 956 O4' DT B 7 7.668 10.056 3.872 1.00 1.00 O ATOM 957 C3' DT B 7 7.988 8.563 2.021 1.00 1.00 C ATOM 958 O3' DT B 7 7.192 8.768 0.860 1.00 1.00 O ATOM 959 C2' DT B 7 9.111 9.586 2.132 1.00 1.00 C ATOM 960 C1' DT B 7 8.389 10.719 2.858 1.00 1.00 C ATOM 961 N1 DT B 7 9.304 11.720 3.447 1.00 1.00 N ATOM 962 C2 DT B 7 9.184 13.049 3.028 1.00 1.00 C ATOM 963 O2 DT B 7 8.405 13.436 2.161 1.00 1.00 O ATOM 964 N3 DT B 7 10.015 13.957 3.636 1.00 1.00 N ATOM 965 C4 DT B 7 10.996 13.668 4.549 1.00 1.00 C ATOM 966 O4 DT B 7 11.678 14.602 4.969 1.00 1.00 O ATOM 967 C5 DT B 7 11.104 12.252 4.912 1.00 1.00 C ATOM 968 C7 DT B 7 12.156 11.793 5.902 1.00 1.00 C ATOM 969 C6 DT B 7 10.261 11.336 4.362 1.00 1.00 C ATOM 0 H5' DT B 7 6.516 8.103 5.164 1.00 1.00 H new ATOM 0 H5'' DT B 7 6.494 6.929 3.863 1.00 1.00 H new ATOM 0 H4' DT B 7 6.119 9.034 2.928 1.00 1.00 H new ATOM 0 H3' DT B 7 8.358 7.540 1.955 1.00 1.00 H new ATOM 0 H2' DT B 7 9.962 9.207 2.698 1.00 1.00 H new ATOM 0 H2'' DT B 7 9.489 9.894 1.157 1.00 1.00 H new ATOM 0 H1' DT B 7 7.767 11.292 2.170 1.00 1.00 H new ATOM 0 H3 DT B 7 9.891 14.938 3.385 1.00 1.00 H new ATOM 0 H71 DT B 7 11.792 10.918 6.441 1.00 1.00 H new ATOM 0 H72 DT B 7 13.071 11.536 5.368 1.00 1.00 H new ATOM 0 H73 DT B 7 12.363 12.595 6.611 1.00 1.00 H new ATOM 0 H6 DT B 7 10.343 10.297 4.645 1.00 1.00 H new ATOM 982 P DA B 8 7.486 8.045 -0.550 1.00 1.00 P ATOM 983 OP1 DA B 8 6.202 8.026 -1.299 1.00 1.00 O ATOM 984 OP2 DA B 8 8.144 6.739 -0.287 1.00 1.00 O ATOM 985 O5' DA B 8 8.511 9.032 -1.296 1.00 1.00 O ATOM 986 C5' DA B 8 8.020 10.146 -2.029 1.00 1.00 C ATOM 987 C4' DA B 8 9.104 11.121 -2.514 1.00 1.00 C ATOM 988 O4' DA B 8 9.517 11.967 -1.450 1.00 1.00 O ATOM 989 C3' DA B 8 10.362 10.467 -3.121 1.00 1.00 C ATOM 990 O3' DA B 8 10.402 10.681 -4.531 1.00 1.00 O ATOM 991 C2' DA B 8 11.497 11.154 -2.359 1.00 1.00 C ATOM 992 C1' DA B 8 10.839 12.370 -1.725 1.00 1.00 C ATOM 993 N9 DA B 8 11.477 12.795 -0.462 1.00 1.00 N ATOM 994 C8 DA B 8 11.740 12.066 0.676 1.00 1.00 C ATOM 995 N7 DA B 8 12.296 12.752 1.644 1.00 1.00 N ATOM 996 C5 DA B 8 12.407 14.038 1.090 1.00 1.00 C ATOM 997 C6 DA B 8 12.885 15.301 1.531 1.00 1.00 C ATOM 998 N6 DA B 8 13.333 15.589 2.743 1.00 1.00 N ATOM 999 N1 DA B 8 12.849 16.368 0.735 1.00 1.00 N ATOM 1000 C2 DA B 8 12.347 16.223 -0.476 1.00 1.00 C ATOM 1001 N3 DA B 8 11.857 15.131 -1.034 1.00 1.00 N ATOM 1002 C4 DA B 8 11.920 14.062 -0.192 1.00 1.00 C ATOM 0 H5' DA B 8 7.312 10.692 -1.405 1.00 1.00 H new ATOM 0 H5'' DA B 8 7.466 9.780 -2.893 1.00 1.00 H new ATOM 0 H4' DA B 8 8.623 11.677 -3.319 1.00 1.00 H new ATOM 0 H3' DA B 8 10.411 9.383 -3.019 1.00 1.00 H new ATOM 0 H2' DA B 8 11.926 10.495 -1.604 1.00 1.00 H new ATOM 0 H2'' DA B 8 12.308 11.443 -3.028 1.00 1.00 H new ATOM 0 H1' DA B 8 10.918 13.222 -2.401 1.00 1.00 H new ATOM 0 H8 DA B 8 11.507 11.015 0.764 1.00 1.00 H new ATOM 0 H61 DA B 8 13.655 16.533 2.957 1.00 1.00 H new ATOM 0 H62 DA B 8 13.356 14.867 3.463 1.00 1.00 H new ATOM 0 H2 DA B 8 12.335 17.111 -1.090 1.00 1.00 H new ATOM 1014 P DT B 9 11.654 10.189 -5.461 1.00 1.00 P ATOM 1015 OP1 DT B 9 11.091 9.681 -6.739 1.00 1.00 O ATOM 1016 OP2 DT B 9 12.575 9.314 -4.684 1.00 1.00 O ATOM 1017 O5' DT B 9 12.373 11.606 -5.744 1.00 1.00 O ATOM 1018 C5' DT B 9 11.640 12.658 -6.362 1.00 1.00 C ATOM 1019 C4' DT B 9 12.441 13.945 -6.593 1.00 1.00 C ATOM 1020 O4' DT B 9 12.702 14.586 -5.354 1.00 1.00 O ATOM 1021 C3' DT B 9 13.763 13.697 -7.329 1.00 1.00 C ATOM 1022 O3' DT B 9 13.895 14.631 -8.399 1.00 1.00 O ATOM 1023 C2' DT B 9 14.780 13.847 -6.201 1.00 1.00 C ATOM 1024 C1' DT B 9 14.091 14.806 -5.230 1.00 1.00 C ATOM 1025 N1 DT B 9 14.480 14.613 -3.809 1.00 1.00 N ATOM 1026 C2 DT B 9 14.827 15.746 -3.061 1.00 1.00 C ATOM 1027 O2 DT B 9 14.813 16.897 -3.502 1.00 1.00 O ATOM 1028 N3 DT B 9 15.203 15.535 -1.754 1.00 1.00 N ATOM 1029 C4 DT B 9 15.235 14.319 -1.118 1.00 1.00 C ATOM 1030 O4 DT B 9 15.535 14.285 0.075 1.00 1.00 O ATOM 1031 C5 DT B 9 14.863 13.175 -1.949 1.00 1.00 C ATOM 1032 C7 DT B 9 14.901 11.774 -1.366 1.00 1.00 C ATOM 1033 C6 DT B 9 14.483 13.354 -3.241 1.00 1.00 C ATOM 0 H5' DT B 9 10.773 12.891 -5.743 1.00 1.00 H new ATOM 0 H5'' DT B 9 11.261 12.304 -7.321 1.00 1.00 H new ATOM 0 H4' DT B 9 11.830 14.586 -7.228 1.00 1.00 H new ATOM 0 H3' DT B 9 13.872 12.732 -7.824 1.00 1.00 H new ATOM 0 H2' DT B 9 15.003 12.889 -5.730 1.00 1.00 H new ATOM 0 H2'' DT B 9 15.725 14.252 -6.563 1.00 1.00 H new ATOM 0 H1' DT B 9 14.393 15.821 -5.489 1.00 1.00 H new ATOM 0 H3 DT B 9 15.482 16.352 -1.211 1.00 1.00 H new ATOM 0 H71 DT B 9 15.672 11.720 -0.598 1.00 1.00 H new ATOM 0 H72 DT B 9 13.933 11.537 -0.925 1.00 1.00 H new ATOM 0 H73 DT B 9 15.125 11.057 -2.156 1.00 1.00 H new ATOM 0 H6 DT B 9 14.180 12.502 -3.831 1.00 1.00 H new ATOM 1046 P DG B 10 15.191 14.685 -9.378 1.00 1.00 P ATOM 1047 OP1 DG B 10 14.739 15.177 -10.711 1.00 1.00 O ATOM 1048 OP2 DG B 10 15.921 13.388 -9.312 1.00 1.00 O ATOM 1049 O5' DG B 10 16.112 15.832 -8.691 1.00 1.00 O ATOM 1050 C5' DG B 10 15.671 17.189 -8.649 1.00 1.00 C ATOM 1051 C4' DG B 10 16.656 18.153 -7.962 1.00 1.00 C ATOM 1052 O4' DG B 10 16.672 17.935 -6.551 1.00 1.00 O ATOM 1053 C3' DG B 10 18.094 18.034 -8.503 1.00 1.00 C ATOM 1054 O3' DG B 10 18.624 19.334 -8.756 1.00 1.00 O ATOM 1055 C2' DG B 10 18.771 17.279 -7.359 1.00 1.00 C ATOM 1056 C1' DG B 10 18.020 17.793 -6.135 1.00 1.00 C ATOM 1057 N9 DG B 10 18.106 16.878 -4.978 1.00 1.00 N ATOM 1058 C8 DG B 10 17.918 15.524 -4.977 1.00 1.00 C ATOM 1059 N7 DG B 10 17.990 14.964 -3.800 1.00 1.00 N ATOM 1060 C5 DG B 10 18.306 16.041 -2.954 1.00 1.00 C ATOM 1061 C6 DG B 10 18.554 16.097 -1.534 1.00 1.00 C ATOM 1062 O6 DG B 10 18.465 15.205 -0.692 1.00 1.00 O ATOM 1063 N1 DG B 10 18.946 17.341 -1.092 1.00 1.00 N ATOM 1064 C2 DG B 10 19.049 18.421 -1.897 1.00 1.00 C ATOM 1065 N2 DG B 10 19.467 19.518 -1.330 1.00 1.00 N ATOM 1066 N3 DG B 10 18.779 18.442 -3.203 1.00 1.00 N ATOM 1067 C4 DG B 10 18.417 17.212 -3.679 1.00 1.00 C ATOM 0 H5' DG B 10 14.715 17.232 -8.128 1.00 1.00 H new ATOM 0 H5'' DG B 10 15.494 17.533 -9.668 1.00 1.00 H new ATOM 0 H4' DG B 10 16.298 19.158 -8.186 1.00 1.00 H new ATOM 0 H3' DG B 10 18.217 17.522 -9.457 1.00 1.00 H new ATOM 0 H2' DG B 10 18.673 16.199 -7.471 1.00 1.00 H new ATOM 0 H2'' DG B 10 19.837 17.498 -7.303 1.00 1.00 H new ATOM 0 H1' DG B 10 18.458 18.730 -5.792 1.00 1.00 H new ATOM 0 H8 DG B 10 17.725 14.962 -5.879 1.00 1.00 H new ATOM 0 H1 DG B 10 19.171 17.453 -0.103 1.00 1.00 H new ATOM 0 H21 DG B 10 19.567 20.371 -1.881 1.00 1.00 H new ATOM 0 H22 DG B 10 19.694 19.524 -0.335 1.00 1.00 H new ATOM 1079 P DC B 11 20.094 19.591 -9.401 1.00 1.00 P ATOM 1080 OP1 DC B 11 19.972 20.698 -10.395 1.00 1.00 O ATOM 1081 OP2 DC B 11 20.675 18.297 -9.858 1.00 1.00 O ATOM 1082 O5' DC B 11 20.962 20.126 -8.134 1.00 1.00 O ATOM 1083 C5' DC B 11 20.642 21.369 -7.508 1.00 1.00 C ATOM 1084 C4' DC B 11 21.578 21.760 -6.349 1.00 1.00 C ATOM 1085 O4' DC B 11 21.379 20.894 -5.233 1.00 1.00 O ATOM 1086 C3' DC B 11 23.067 21.743 -6.737 1.00 1.00 C ATOM 1087 O3' DC B 11 23.724 22.914 -6.241 1.00 1.00 O ATOM 1088 C2' DC B 11 23.543 20.435 -6.101 1.00 1.00 C ATOM 1089 C1' DC B 11 22.609 20.277 -4.896 1.00 1.00 C ATOM 1090 N1 DC B 11 22.356 18.877 -4.466 1.00 1.00 N ATOM 1091 C2 DC B 11 22.454 18.529 -3.111 1.00 1.00 C ATOM 1092 O2 DC B 11 22.836 19.327 -2.252 1.00 1.00 O ATOM 1093 N3 DC B 11 22.140 17.280 -2.690 1.00 1.00 N ATOM 1094 C4 DC B 11 21.743 16.405 -3.590 1.00 1.00 C ATOM 1095 N4 DC B 11 21.395 15.239 -3.127 1.00 1.00 N ATOM 1096 C5 DC B 11 21.652 16.680 -4.981 1.00 1.00 C ATOM 1097 C6 DC B 11 21.964 17.940 -5.378 1.00 1.00 C ATOM 0 H5' DC B 11 19.620 21.320 -7.132 1.00 1.00 H new ATOM 0 H5'' DC B 11 20.667 22.157 -8.260 1.00 1.00 H new ATOM 0 H4' DC B 11 21.319 22.786 -6.087 1.00 1.00 H new ATOM 0 H3' DC B 11 23.275 21.770 -7.807 1.00 1.00 H new ATOM 0 H2' DC B 11 23.457 19.596 -6.791 1.00 1.00 H new ATOM 0 H2'' DC B 11 24.588 20.491 -5.797 1.00 1.00 H new ATOM 0 H1' DC B 11 23.106 20.744 -4.045 1.00 1.00 H new ATOM 0 H41 DC B 11 21.077 14.511 -3.766 1.00 1.00 H new ATOM 0 H42 DC B 11 21.441 15.054 -2.125 1.00 1.00 H new ATOM 0 H5 DC B 11 21.349 15.923 -5.689 1.00 1.00 H new ATOM 0 H6 DC B 11 21.902 18.203 -6.424 1.00 1.00 H new ATOM 1109 P DG B 12 25.239 23.320 -6.680 1.00 1.00 P ATOM 1110 OP1 DG B 12 25.425 24.768 -6.385 1.00 1.00 O ATOM 1111 OP2 DG B 12 25.487 22.850 -8.071 1.00 1.00 O ATOM 1112 O5' DG B 12 26.188 22.467 -5.682 1.00 1.00 O ATOM 1113 C5' DG B 12 26.270 22.786 -4.295 1.00 1.00 C ATOM 1114 C4' DG B 12 26.868 21.653 -3.447 1.00 1.00 C ATOM 1115 O4' DG B 12 25.987 20.547 -3.369 1.00 1.00 O ATOM 1116 C3' DG B 12 28.208 21.099 -3.953 1.00 1.00 C ATOM 1117 O3' DG B 12 29.324 21.744 -3.338 1.00 1.00 O ATOM 1118 C2' DG B 12 28.150 19.621 -3.563 1.00 1.00 C ATOM 1119 C1' DG B 12 26.755 19.438 -2.954 1.00 1.00 C ATOM 1120 N9 DG B 12 26.114 18.184 -3.386 1.00 1.00 N ATOM 1121 C8 DG B 12 25.801 17.803 -4.661 1.00 1.00 C ATOM 1122 N7 DG B 12 25.266 16.612 -4.754 1.00 1.00 N ATOM 1123 C5 DG B 12 25.243 16.162 -3.423 1.00 1.00 C ATOM 1124 C6 DG B 12 24.795 14.926 -2.828 1.00 1.00 C ATOM 1125 O6 DG B 12 24.295 13.927 -3.349 1.00 1.00 O ATOM 1126 N1 DG B 12 24.969 14.883 -1.463 1.00 1.00 N ATOM 1127 C2 DG B 12 25.524 15.877 -0.735 1.00 1.00 C ATOM 1128 N2 DG B 12 25.674 15.663 0.543 1.00 1.00 N ATOM 1129 N3 DG B 12 25.950 17.034 -1.227 1.00 1.00 N ATOM 1130 C4 DG B 12 25.771 17.122 -2.582 1.00 1.00 C ATOM 0 H5' DG B 12 25.273 23.021 -3.924 1.00 1.00 H new ATOM 0 H5'' DG B 12 26.876 23.683 -4.170 1.00 1.00 H new ATOM 0 H4' DG B 12 27.031 22.127 -2.479 1.00 1.00 H new ATOM 0 H3' DG B 12 28.344 21.261 -5.022 1.00 1.00 H new ATOM 0 H2' DG B 12 28.292 18.976 -4.430 1.00 1.00 H new ATOM 0 H2'' DG B 12 28.932 19.369 -2.847 1.00 1.00 H new ATOM 0 HO3' DG B 12 30.156 21.361 -3.686 1.00 1.00 H new ATOM 0 H1' DG B 12 26.832 19.379 -1.868 1.00 1.00 H new ATOM 0 H8 DG B 12 25.980 18.432 -5.520 1.00 1.00 H new ATOM 0 H1 DG B 12 24.659 14.046 -0.969 1.00 1.00 H new ATOM 0 H21 DG B 12 26.088 16.383 1.135 1.00 1.00 H new ATOM 0 H22 DG B 12 25.377 14.776 0.950 1.00 1.00 H new TER 1143 DG B 12 ATOM 1144 O5' DC C 13 22.979 7.743 4.133 1.00 1.00 O ATOM 1145 C5' DC C 13 24.331 7.842 4.593 1.00 1.00 C ATOM 1146 C4' DC C 13 24.860 9.285 4.700 1.00 1.00 C ATOM 1147 O4' DC C 13 24.959 9.884 3.412 1.00 1.00 O ATOM 1148 C3' DC C 13 23.957 10.163 5.578 1.00 1.00 C ATOM 1149 O3' DC C 13 24.735 10.950 6.481 1.00 1.00 O ATOM 1150 C2' DC C 13 23.206 10.992 4.536 1.00 1.00 C ATOM 1151 C1' DC C 13 24.257 11.116 3.430 1.00 1.00 C ATOM 1152 N1 DC C 13 23.734 11.420 2.072 1.00 1.00 N ATOM 1153 C2 DC C 13 24.328 12.429 1.300 1.00 1.00 C ATOM 1154 O2 DC C 13 25.213 13.163 1.742 1.00 1.00 O ATOM 1155 N3 DC C 13 23.952 12.630 0.011 1.00 1.00 N ATOM 1156 C4 DC C 13 22.983 11.885 -0.481 1.00 1.00 C ATOM 1157 N4 DC C 13 22.697 12.085 -1.739 1.00 1.00 N ATOM 1158 C5 DC C 13 22.320 10.867 0.262 1.00 1.00 C ATOM 1159 C6 DC C 13 22.730 10.666 1.536 1.00 1.00 C ATOM 0 H5' DC C 13 24.975 7.281 3.916 1.00 1.00 H new ATOM 0 H5'' DC C 13 24.405 7.367 5.571 1.00 1.00 H new ATOM 0 H4' DC C 13 25.846 9.221 5.160 1.00 1.00 H new ATOM 0 H3' DC C 13 23.281 9.613 6.233 1.00 1.00 H new ATOM 0 H2' DC C 13 22.302 10.492 4.188 1.00 1.00 H new ATOM 0 H2'' DC C 13 22.904 11.964 4.925 1.00 1.00 H new ATOM 0 HO5' DC C 13 22.716 6.800 4.090 1.00 1.00 H new ATOM 0 H1' DC C 13 24.884 11.976 3.665 1.00 1.00 H new ATOM 0 H41 DC C 13 21.957 11.543 -2.186 1.00 1.00 H new ATOM 0 H42 DC C 13 23.213 12.783 -2.275 1.00 1.00 H new ATOM 0 H5 DC C 13 21.524 10.280 -0.173 1.00 1.00 H new ATOM 0 H6 DC C 13 22.258 9.901 2.135 1.00 1.00 H new ATOM 1172 P DG C 14 24.068 11.855 7.657 1.00 1.00 P ATOM 1173 OP1 DG C 14 24.949 11.757 8.856 1.00 1.00 O ATOM 1174 OP2 DG C 14 22.634 11.479 7.808 1.00 1.00 O ATOM 1175 O5' DG C 14 24.128 13.378 7.092 1.00 1.00 O ATOM 1176 C5' DG C 14 25.355 14.111 7.058 1.00 1.00 C ATOM 1177 C4' DG C 14 25.205 15.613 6.724 1.00 1.00 C ATOM 1178 O4' DG C 14 25.001 15.810 5.324 1.00 1.00 O ATOM 1179 C3' DG C 14 24.055 16.297 7.486 1.00 1.00 C ATOM 1180 O3' DG C 14 24.481 17.587 7.937 1.00 1.00 O ATOM 1181 C2' DG C 14 22.966 16.320 6.415 1.00 1.00 C ATOM 1182 C1' DG C 14 23.755 16.460 5.116 1.00 1.00 C ATOM 1183 N9 DG C 14 23.083 15.843 3.954 1.00 1.00 N ATOM 1184 C8 DG C 14 22.448 14.635 3.904 1.00 1.00 C ATOM 1185 N7 DG C 14 22.005 14.297 2.723 1.00 1.00 N ATOM 1186 C5 DG C 14 22.343 15.403 1.931 1.00 1.00 C ATOM 1187 C6 DG C 14 22.114 15.684 0.536 1.00 1.00 C ATOM 1188 O6 DG C 14 21.601 14.977 -0.330 1.00 1.00 O ATOM 1189 N1 DG C 14 22.541 16.933 0.146 1.00 1.00 N ATOM 1190 C2 DG C 14 23.166 17.802 0.969 1.00 1.00 C ATOM 1191 N2 DG C 14 23.528 18.942 0.443 1.00 1.00 N ATOM 1192 N3 DG C 14 23.436 17.583 2.254 1.00 1.00 N ATOM 1193 C4 DG C 14 22.986 16.363 2.684 1.00 1.00 C ATOM 0 H5' DG C 14 26.015 13.654 6.321 1.00 1.00 H new ATOM 0 H5'' DG C 14 25.845 14.016 8.027 1.00 1.00 H new ATOM 0 H4' DG C 14 26.141 16.073 7.042 1.00 1.00 H new ATOM 0 H3' DG C 14 23.712 15.808 8.398 1.00 1.00 H new ATOM 0 H2' DG C 14 22.370 15.407 6.427 1.00 1.00 H new ATOM 0 H2'' DG C 14 22.277 17.152 6.559 1.00 1.00 H new ATOM 0 H1' DG C 14 23.859 17.520 4.885 1.00 1.00 H new ATOM 0 H8 DG C 14 22.322 14.008 4.774 1.00 1.00 H new ATOM 0 H1 DG C 14 22.376 17.218 -0.819 1.00 1.00 H new ATOM 0 H21 DG C 14 24.004 19.639 1.015 1.00 1.00 H new ATOM 0 H22 DG C 14 23.334 19.135 -0.540 1.00 1.00 H new ATOM 1205 P DC C 15 23.531 18.582 8.804 1.00 1.00 P ATOM 1206 OP1 DC C 15 24.414 19.546 9.521 1.00 1.00 O ATOM 1207 OP2 DC C 15 22.579 17.764 9.608 1.00 1.00 O ATOM 1208 O5' DC C 15 22.689 19.392 7.681 1.00 1.00 O ATOM 1209 C5' DC C 15 23.344 20.270 6.769 1.00 1.00 C ATOM 1210 C4' DC C 15 22.492 20.626 5.541 1.00 1.00 C ATOM 1211 O4' DC C 15 22.227 19.479 4.749 1.00 1.00 O ATOM 1212 C3' DC C 15 21.143 21.288 5.862 1.00 1.00 C ATOM 1213 O3' DC C 15 21.275 22.709 5.777 1.00 1.00 O ATOM 1214 C2' DC C 15 20.208 20.674 4.813 1.00 1.00 C ATOM 1215 C1' DC C 15 21.099 19.783 3.956 1.00 1.00 C ATOM 1216 N1 DC C 15 20.405 18.547 3.528 1.00 1.00 N ATOM 1217 C2 DC C 15 20.021 18.389 2.190 1.00 1.00 C ATOM 1218 O2 DC C 15 20.192 19.271 1.347 1.00 1.00 O ATOM 1219 N3 DC C 15 19.455 17.236 1.768 1.00 1.00 N ATOM 1220 C4 DC C 15 19.241 16.287 2.653 1.00 1.00 C ATOM 1221 N4 DC C 15 18.717 15.193 2.176 1.00 1.00 N ATOM 1222 C5 DC C 15 19.559 16.406 4.038 1.00 1.00 C ATOM 1223 C6 DC C 15 20.139 17.565 4.439 1.00 1.00 C ATOM 0 H5' DC C 15 24.273 19.807 6.435 1.00 1.00 H new ATOM 0 H5'' DC C 15 23.615 21.187 7.292 1.00 1.00 H new ATOM 0 H4' DC C 15 23.101 21.353 5.004 1.00 1.00 H new ATOM 0 H3' DC C 15 20.762 21.116 6.869 1.00 1.00 H new ATOM 0 H2' DC C 15 19.412 20.098 5.284 1.00 1.00 H new ATOM 0 H2'' DC C 15 19.729 21.447 4.212 1.00 1.00 H new ATOM 0 H1' DC C 15 21.379 20.296 3.036 1.00 1.00 H new ATOM 0 H41 DC C 15 18.520 14.409 2.798 1.00 1.00 H new ATOM 0 H42 DC C 15 18.504 15.121 1.181 1.00 1.00 H new ATOM 0 H5 DC C 15 19.348 15.610 4.736 1.00 1.00 H new ATOM 0 H6 DC C 15 20.390 17.711 5.479 1.00 1.00 H new ATOM 1235 P DA C 16 20.038 23.734 6.037 1.00 1.00 P ATOM 1236 OP1 DA C 16 20.618 25.082 6.303 1.00 1.00 O ATOM 1237 OP2 DA C 16 19.122 23.147 7.056 1.00 1.00 O ATOM 1238 O5' DA C 16 19.253 23.787 4.617 1.00 1.00 O ATOM 1239 C5' DA C 16 19.927 24.179 3.423 1.00 1.00 C ATOM 1240 C4' DA C 16 19.064 24.097 2.149 1.00 1.00 C ATOM 1241 O4' DA C 16 18.851 22.747 1.731 1.00 1.00 O ATOM 1242 C3' DA C 16 17.690 24.774 2.322 1.00 1.00 C ATOM 1243 O3' DA C 16 17.426 25.652 1.226 1.00 1.00 O ATOM 1244 C2' DA C 16 16.775 23.555 2.409 1.00 1.00 C ATOM 1245 C1' DA C 16 17.466 22.567 1.477 1.00 1.00 C ATOM 1246 N9 DA C 16 17.100 21.175 1.784 1.00 1.00 N ATOM 1247 C8 DA C 16 17.176 20.575 3.007 1.00 1.00 C ATOM 1248 N7 DA C 16 16.921 19.295 3.003 1.00 1.00 N ATOM 1249 C5 DA C 16 16.580 19.058 1.661 1.00 1.00 C ATOM 1250 C6 DA C 16 16.155 17.928 0.919 1.00 1.00 C ATOM 1251 N6 DA C 16 16.049 16.714 1.422 1.00 1.00 N ATOM 1252 N1 DA C 16 15.789 18.021 -0.358 1.00 1.00 N ATOM 1253 C2 DA C 16 15.863 19.214 -0.933 1.00 1.00 C ATOM 1254 N3 DA C 16 16.294 20.353 -0.395 1.00 1.00 N ATOM 1255 C4 DA C 16 16.640 20.208 0.917 1.00 1.00 C ATOM 0 H5' DA C 16 20.806 23.548 3.293 1.00 1.00 H new ATOM 0 H5'' DA C 16 20.283 25.202 3.541 1.00 1.00 H new ATOM 0 H4' DA C 16 19.631 24.631 1.386 1.00 1.00 H new ATOM 0 H3' DA C 16 17.577 25.429 3.186 1.00 1.00 H new ATOM 0 H2' DA C 16 16.703 23.172 3.427 1.00 1.00 H new ATOM 0 H2'' DA C 16 15.761 23.783 2.081 1.00 1.00 H new ATOM 0 H1' DA C 16 17.182 22.744 0.440 1.00 1.00 H new ATOM 0 H8 DA C 16 17.427 21.116 3.907 1.00 1.00 H new ATOM 0 H61 DA C 16 15.736 15.943 0.832 1.00 1.00 H new ATOM 0 H62 DA C 16 16.280 16.546 2.401 1.00 1.00 H new ATOM 0 H2 DA C 16 15.534 19.268 -1.960 1.00 1.00 H new ATOM 1267 P DT C 17 16.120 26.618 1.165 1.00 1.00 P ATOM 1268 OP1 DT C 17 16.436 27.750 0.247 1.00 1.00 O ATOM 1269 OP2 DT C 17 15.683 26.942 2.553 1.00 1.00 O ATOM 1270 O5' DT C 17 14.986 25.691 0.473 1.00 1.00 O ATOM 1271 C5' DT C 17 15.115 25.276 -0.884 1.00 1.00 C ATOM 1272 C4' DT C 17 14.041 24.273 -1.331 1.00 1.00 C ATOM 1273 O4' DT C 17 14.242 23.013 -0.702 1.00 1.00 O ATOM 1274 C3' DT C 17 12.595 24.730 -1.053 1.00 1.00 C ATOM 1275 O3' DT C 17 11.868 24.778 -2.277 1.00 1.00 O ATOM 1276 C2' DT C 17 12.105 23.669 -0.060 1.00 1.00 C ATOM 1277 C1' DT C 17 12.971 22.462 -0.428 1.00 1.00 C ATOM 1278 N1 DT C 17 13.081 21.430 0.635 1.00 1.00 N ATOM 1279 C2 DT C 17 12.880 20.086 0.283 1.00 1.00 C ATOM 1280 O2 DT C 17 12.581 19.688 -0.846 1.00 1.00 O ATOM 1281 N3 DT C 17 13.042 19.164 1.288 1.00 1.00 N ATOM 1282 C4 DT C 17 13.380 19.425 2.591 1.00 1.00 C ATOM 1283 O4 DT C 17 13.534 18.472 3.356 1.00 1.00 O ATOM 1284 C5 DT C 17 13.539 20.843 2.903 1.00 1.00 C ATOM 1285 C7 DT C 17 13.869 21.284 4.315 1.00 1.00 C ATOM 1286 C6 DT C 17 13.403 21.784 1.932 1.00 1.00 C ATOM 0 H5' DT C 17 16.098 24.828 -1.025 1.00 1.00 H new ATOM 0 H5'' DT C 17 15.070 26.154 -1.528 1.00 1.00 H new ATOM 0 H4' DT C 17 14.156 24.198 -2.412 1.00 1.00 H new ATOM 0 H3' DT C 17 12.482 25.733 -0.641 1.00 1.00 H new ATOM 0 H2' DT C 17 12.255 23.978 0.974 1.00 1.00 H new ATOM 0 H2'' DT C 17 11.042 23.459 -0.179 1.00 1.00 H new ATOM 0 H1' DT C 17 12.522 21.929 -1.266 1.00 1.00 H new ATOM 0 H3 DT C 17 12.896 18.185 1.040 1.00 1.00 H new ATOM 0 H71 DT C 17 14.448 22.207 4.282 1.00 1.00 H new ATOM 0 H72 DT C 17 12.945 21.455 4.868 1.00 1.00 H new ATOM 0 H73 DT C 17 14.451 20.508 4.812 1.00 1.00 H new ATOM 0 H6 DT C 17 13.549 22.826 2.178 1.00 1.00 H new ATOM 1299 P DA C 18 10.335 25.307 -2.369 1.00 1.00 P ATOM 1300 OP1 DA C 18 10.066 25.686 -3.786 1.00 1.00 O ATOM 1301 OP2 DA C 18 10.097 26.325 -1.307 1.00 1.00 O ATOM 1302 O5' DA C 18 9.466 23.984 -2.018 1.00 1.00 O ATOM 1303 C5' DA C 18 9.541 22.831 -2.849 1.00 1.00 C ATOM 1304 C4' DA C 18 8.662 21.666 -2.374 1.00 1.00 C ATOM 1305 O4' DA C 18 9.291 20.906 -1.353 1.00 1.00 O ATOM 1306 C3' DA C 18 7.264 22.065 -1.877 1.00 1.00 C ATOM 1307 O3' DA C 18 6.352 21.483 -2.804 1.00 1.00 O ATOM 1308 C2' DA C 18 7.261 21.523 -0.445 1.00 1.00 C ATOM 1309 C1' DA C 18 8.287 20.399 -0.496 1.00 1.00 C ATOM 1310 N9 DA C 18 8.936 20.026 0.779 1.00 1.00 N ATOM 1311 C8 DA C 18 9.338 20.833 1.811 1.00 1.00 C ATOM 1312 N7 DA C 18 9.899 20.197 2.812 1.00 1.00 N ATOM 1313 C5 DA C 18 9.843 18.856 2.401 1.00 1.00 C ATOM 1314 C6 DA C 18 10.208 17.604 2.966 1.00 1.00 C ATOM 1315 N6 DA C 18 10.733 17.401 4.160 1.00 1.00 N ATOM 1316 N1 DA C 18 10.046 16.470 2.290 1.00 1.00 N ATOM 1317 C2 DA C 18 9.548 16.540 1.069 1.00 1.00 C ATOM 1318 N3 DA C 18 9.129 17.615 0.419 1.00 1.00 N ATOM 1319 C4 DA C 18 9.296 18.752 1.150 1.00 1.00 C ATOM 0 H5' DA C 18 10.577 22.496 -2.897 1.00 1.00 H new ATOM 0 H5'' DA C 18 9.248 23.105 -3.862 1.00 1.00 H new ATOM 0 H4' DA C 18 8.532 21.070 -3.277 1.00 1.00 H new ATOM 0 H3' DA C 18 6.988 23.119 -1.837 1.00 1.00 H new ATOM 0 H2' DA C 18 7.540 22.291 0.277 1.00 1.00 H new ATOM 0 H2'' DA C 18 6.276 21.156 -0.155 1.00 1.00 H new ATOM 0 H1' DA C 18 7.775 19.489 -0.808 1.00 1.00 H new ATOM 0 H8 DA C 18 9.204 21.905 1.801 1.00 1.00 H new ATOM 0 H61 DA C 18 10.957 16.454 4.464 1.00 1.00 H new ATOM 0 H62 DA C 18 10.915 18.192 4.778 1.00 1.00 H new ATOM 0 H2 DA C 18 9.473 15.605 0.534 1.00 1.00 H new ATOM 1331 P DT C 19 4.767 21.582 -2.672 1.00 1.00 P ATOM 1332 OP1 DT C 19 4.198 21.282 -4.004 1.00 1.00 O ATOM 1333 OP2 DT C 19 4.374 22.818 -1.965 1.00 1.00 O ATOM 1334 O5' DT C 19 4.497 20.318 -1.782 1.00 1.00 O ATOM 1335 C5' DT C 19 4.771 19.009 -2.257 1.00 1.00 C ATOM 1336 C4' DT C 19 4.212 17.999 -1.259 1.00 1.00 C ATOM 1337 O4' DT C 19 5.186 17.819 -0.246 1.00 1.00 O ATOM 1338 C3' DT C 19 2.919 18.502 -0.574 1.00 1.00 C ATOM 1339 O3' DT C 19 1.950 17.500 -0.429 1.00 1.00 O ATOM 1340 C2' DT C 19 3.415 18.902 0.799 1.00 1.00 C ATOM 1341 C1' DT C 19 4.506 17.844 0.980 1.00 1.00 C ATOM 1342 N1 DT C 19 5.474 18.083 2.074 1.00 1.00 N ATOM 1343 C2 DT C 19 5.907 16.972 2.805 1.00 1.00 C ATOM 1344 O2 DT C 19 5.564 15.815 2.567 1.00 1.00 O ATOM 1345 N3 DT C 19 6.740 17.224 3.865 1.00 1.00 N ATOM 1346 C4 DT C 19 7.087 18.463 4.341 1.00 1.00 C ATOM 1347 O4 DT C 19 7.788 18.516 5.349 1.00 1.00 O ATOM 1348 C5 DT C 19 6.568 19.588 3.558 1.00 1.00 C ATOM 1349 C7 DT C 19 6.830 21.022 3.984 1.00 1.00 C ATOM 1350 C6 DT C 19 5.836 19.361 2.435 1.00 1.00 C ATOM 0 H5' DT C 19 5.845 18.867 -2.376 1.00 1.00 H new ATOM 0 H5'' DT C 19 4.319 18.861 -3.238 1.00 1.00 H new ATOM 0 H4' DT C 19 3.979 17.080 -1.797 1.00 1.00 H new ATOM 0 H3' DT C 19 2.439 19.292 -1.152 1.00 1.00 H new ATOM 0 H2' DT C 19 3.807 19.919 0.825 1.00 1.00 H new ATOM 0 H2'' DT C 19 2.638 18.840 1.561 1.00 1.00 H new ATOM 0 H1' DT C 19 4.028 16.907 1.265 1.00 1.00 H new ATOM 0 H3 DT C 19 7.138 16.416 4.343 1.00 1.00 H new ATOM 0 H71 DT C 19 6.865 21.663 3.103 1.00 1.00 H new ATOM 0 H72 DT C 19 6.031 21.357 4.645 1.00 1.00 H new ATOM 0 H73 DT C 19 7.783 21.077 4.510 1.00 1.00 H new ATOM 0 H6 DT C 19 5.535 20.195 1.818 1.00 1.00 H new ATOM 1363 P DA C 20 0.936 17.171 -1.630 1.00 1.00 P ATOM 1364 OP1 DA C 20 1.721 17.124 -2.891 1.00 1.00 O ATOM 1365 OP2 DA C 20 -0.208 18.119 -1.545 1.00 1.00 O ATOM 1366 O5' DA C 20 0.506 15.697 -1.169 1.00 1.00 O ATOM 1367 C5' DA C 20 -0.238 15.537 0.025 1.00 1.00 C ATOM 1368 C4' DA C 20 0.055 14.204 0.710 1.00 1.00 C ATOM 1369 O4' DA C 20 1.323 14.278 1.366 1.00 1.00 O ATOM 1370 C3' DA C 20 -1.022 14.013 1.776 1.00 1.00 C ATOM 1371 O3' DA C 20 -1.460 12.665 1.839 1.00 1.00 O ATOM 1372 C2' DA C 20 -0.297 14.538 3.010 1.00 1.00 C ATOM 1373 C1' DA C 20 1.166 14.204 2.771 1.00 1.00 C ATOM 1374 N9 DA C 20 2.022 15.211 3.446 1.00 1.00 N ATOM 1375 C8 DA C 20 2.164 16.534 3.101 1.00 1.00 C ATOM 1376 N7 DA C 20 2.883 17.248 3.923 1.00 1.00 N ATOM 1377 C5 DA C 20 3.258 16.307 4.888 1.00 1.00 C ATOM 1378 C6 DA C 20 4.056 16.362 6.054 1.00 1.00 C ATOM 1379 N6 DA C 20 4.660 17.461 6.461 1.00 1.00 N ATOM 1380 N1 DA C 20 4.261 15.288 6.820 1.00 1.00 N ATOM 1381 C2 DA C 20 3.684 14.159 6.430 1.00 1.00 C ATOM 1382 N3 DA C 20 2.905 13.944 5.374 1.00 1.00 N ATOM 1383 C4 DA C 20 2.739 15.069 4.619 1.00 1.00 C ATOM 0 H5' DA C 20 -1.302 15.602 -0.200 1.00 1.00 H new ATOM 0 H5'' DA C 20 -0.006 16.354 0.708 1.00 1.00 H new ATOM 0 H4' DA C 20 0.065 13.388 -0.013 1.00 1.00 H new ATOM 0 H3' DA C 20 -1.965 14.533 1.607 1.00 1.00 H new ATOM 0 H2' DA C 20 -0.444 15.612 3.128 1.00 1.00 H new ATOM 0 H2'' DA C 20 -0.668 14.064 3.919 1.00 1.00 H new ATOM 0 H1' DA C 20 1.449 13.227 3.162 1.00 1.00 H new ATOM 0 H8 DA C 20 1.713 16.952 2.213 1.00 1.00 H new ATOM 0 H61 DA C 20 5.225 17.448 7.310 1.00 1.00 H new ATOM 0 H62 DA C 20 4.562 18.324 5.927 1.00 1.00 H new ATOM 0 H2 DA C 20 3.872 13.298 7.054 1.00 1.00 H new ATOM 1395 P DT C 21 -2.808 12.266 2.628 1.00 1.00 P ATOM 1396 OP1 DT C 21 -3.301 10.965 2.106 1.00 1.00 O ATOM 1397 OP2 DT C 21 -3.729 13.434 2.574 1.00 1.00 O ATOM 1398 O5' DT C 21 -2.286 12.072 4.138 1.00 1.00 O ATOM 1399 C5' DT C 21 -1.371 11.027 4.440 1.00 1.00 C ATOM 1400 C4' DT C 21 -1.148 10.830 5.943 1.00 1.00 C ATOM 1401 O4' DT C 21 -0.256 11.807 6.454 1.00 1.00 O ATOM 1402 C3' DT C 21 -2.438 10.906 6.758 1.00 1.00 C ATOM 1403 O3' DT C 21 -2.375 9.873 7.727 1.00 1.00 O ATOM 1404 C2' DT C 21 -2.394 12.310 7.340 1.00 1.00 C ATOM 1405 C1' DT C 21 -0.892 12.531 7.492 1.00 1.00 C ATOM 1406 N1 DT C 21 -0.400 13.937 7.428 1.00 1.00 N ATOM 1407 C2 DT C 21 0.651 14.290 8.289 1.00 1.00 C ATOM 1408 O2 DT C 21 1.148 13.518 9.114 1.00 1.00 O ATOM 1409 N3 DT C 21 1.156 15.562 8.179 1.00 1.00 N ATOM 1410 C4 DT C 21 0.727 16.512 7.280 1.00 1.00 C ATOM 1411 O4 DT C 21 1.305 17.594 7.246 1.00 1.00 O ATOM 1412 C5 DT C 21 -0.381 16.098 6.423 1.00 1.00 C ATOM 1413 C7 DT C 21 -0.953 17.082 5.420 1.00 1.00 C ATOM 1414 C6 DT C 21 -0.895 14.844 6.504 1.00 1.00 C ATOM 0 H5' DT C 21 -0.415 11.242 3.963 1.00 1.00 H new ATOM 0 H5'' DT C 21 -1.739 10.096 4.010 1.00 1.00 H new ATOM 0 H4' DT C 21 -0.731 9.828 6.044 1.00 1.00 H new ATOM 0 H3' DT C 21 -3.372 10.758 6.216 1.00 1.00 H new ATOM 0 H2' DT C 21 -2.851 13.044 6.676 1.00 1.00 H new ATOM 0 H2'' DT C 21 -2.917 12.375 8.294 1.00 1.00 H new ATOM 0 H1' DT C 21 -0.655 12.200 8.503 1.00 1.00 H new ATOM 0 H3 DT C 21 1.910 15.824 8.814 1.00 1.00 H new ATOM 0 H71 DT C 21 -1.341 16.539 4.558 1.00 1.00 H new ATOM 0 H72 DT C 21 -1.760 17.648 5.885 1.00 1.00 H new ATOM 0 H73 DT C 21 -0.170 17.767 5.095 1.00 1.00 H new ATOM 0 H6 DT C 21 -1.697 14.551 5.843 1.00 1.00 H new ATOM 1427 P DG C 22 -3.603 9.476 8.667 1.00 1.00 P ATOM 1428 OP1 DG C 22 -3.434 8.036 8.984 1.00 1.00 O ATOM 1429 OP2 DG C 22 -4.883 9.915 8.060 1.00 1.00 O ATOM 1430 O5' DG C 22 -3.291 10.341 9.975 1.00 1.00 O ATOM 1431 C5' DG C 22 -2.179 10.021 10.794 1.00 1.00 C ATOM 1432 C4' DG C 22 -1.875 11.092 11.844 1.00 1.00 C ATOM 1433 O4' DG C 22 -1.281 12.231 11.230 1.00 1.00 O ATOM 1434 C3' DG C 22 -3.106 11.553 12.651 1.00 1.00 C ATOM 1435 O3' DG C 22 -2.838 11.361 14.037 1.00 1.00 O ATOM 1436 C2' DG C 22 -3.217 13.014 12.217 1.00 1.00 C ATOM 1437 C1' DG C 22 -1.760 13.354 11.939 1.00 1.00 C ATOM 1438 N9 DG C 22 -1.588 14.594 11.167 1.00 1.00 N ATOM 1439 C8 DG C 22 -2.239 14.970 10.026 1.00 1.00 C ATOM 1440 N7 DG C 22 -1.881 16.138 9.560 1.00 1.00 N ATOM 1441 C5 DG C 22 -0.934 16.584 10.497 1.00 1.00 C ATOM 1442 C6 DG C 22 -0.161 17.801 10.580 1.00 1.00 C ATOM 1443 O6 DG C 22 -0.100 18.741 9.788 1.00 1.00 O ATOM 1444 N1 DG C 22 0.601 17.891 11.726 1.00 1.00 N ATOM 1445 C2 DG C 22 0.664 16.917 12.661 1.00 1.00 C ATOM 1446 N2 DG C 22 1.421 17.145 13.699 1.00 1.00 N ATOM 1447 N3 DG C 22 0.014 15.758 12.609 1.00 1.00 N ATOM 1448 C4 DG C 22 -0.778 15.651 11.500 1.00 1.00 C ATOM 0 H5' DG C 22 -1.301 9.880 10.164 1.00 1.00 H new ATOM 0 H5'' DG C 22 -2.367 9.072 11.296 1.00 1.00 H new ATOM 0 H4' DG C 22 -1.189 10.620 12.547 1.00 1.00 H new ATOM 0 H3' DG C 22 -4.041 11.018 12.482 1.00 1.00 H new ATOM 0 H2' DG C 22 -3.843 13.134 11.333 1.00 1.00 H new ATOM 0 H2'' DG C 22 -3.644 13.643 12.998 1.00 1.00 H new ATOM 0 H1' DG C 22 -1.212 13.546 12.862 1.00 1.00 H new ATOM 0 H8 DG C 22 -2.987 14.354 9.549 1.00 1.00 H new ATOM 0 H1 DG C 22 1.147 18.739 11.876 1.00 1.00 H new ATOM 0 H21 DG C 22 1.504 16.443 14.434 1.00 1.00 H new ATOM 0 H22 DG C 22 1.930 18.026 13.775 1.00 1.00 H new ATOM 1460 P DC C 23 -3.912 11.673 15.213 1.00 1.00 P ATOM 1461 OP1 DC C 23 -3.891 10.528 16.169 1.00 1.00 O ATOM 1462 OP2 DC C 23 -5.219 12.080 14.625 1.00 1.00 O ATOM 1463 O5' DC C 23 -3.255 12.967 15.939 1.00 1.00 O ATOM 1464 C5' DC C 23 -1.987 12.871 16.589 1.00 1.00 C ATOM 1465 C4' DC C 23 -1.529 14.159 17.297 1.00 1.00 C ATOM 1466 O4' DC C 23 -1.165 15.154 16.342 1.00 1.00 O ATOM 1467 C3' DC C 23 -2.601 14.731 18.240 1.00 1.00 C ATOM 1468 O3' DC C 23 -2.024 15.096 19.493 1.00 1.00 O ATOM 1469 C2' DC C 23 -3.141 15.905 17.417 1.00 1.00 C ATOM 1470 C1' DC C 23 -1.944 16.319 16.554 1.00 1.00 C ATOM 1471 N1 DC C 23 -2.326 16.913 15.248 1.00 1.00 N ATOM 1472 C2 DC C 23 -1.805 18.152 14.848 1.00 1.00 C ATOM 1473 O2 DC C 23 -1.056 18.818 15.565 1.00 1.00 O ATOM 1474 N3 DC C 23 -2.118 18.679 13.639 1.00 1.00 N ATOM 1475 C4 DC C 23 -2.934 17.999 12.859 1.00 1.00 C ATOM 1476 N4 DC C 23 -3.169 18.532 11.695 1.00 1.00 N ATOM 1477 C5 DC C 23 -3.505 16.743 13.209 1.00 1.00 C ATOM 1478 C6 DC C 23 -3.168 16.231 14.418 1.00 1.00 C ATOM 0 H5' DC C 23 -1.236 12.591 15.851 1.00 1.00 H new ATOM 0 H5'' DC C 23 -2.029 12.065 17.322 1.00 1.00 H new ATOM 0 H4' DC C 23 -0.664 13.887 17.901 1.00 1.00 H new ATOM 0 H3' DC C 23 -3.395 14.042 18.528 1.00 1.00 H new ATOM 0 H2' DC C 23 -3.993 15.608 16.805 1.00 1.00 H new ATOM 0 H2'' DC C 23 -3.477 16.722 18.056 1.00 1.00 H new ATOM 0 H1' DC C 23 -1.393 17.099 17.079 1.00 1.00 H new ATOM 0 H41 DC C 23 -3.791 18.064 11.036 1.00 1.00 H new ATOM 0 H42 DC C 23 -2.731 19.418 11.442 1.00 1.00 H new ATOM 0 H5 DC C 23 -4.176 16.222 12.542 1.00 1.00 H new ATOM 0 H6 DC C 23 -3.569 15.277 14.727 1.00 1.00 H new ATOM 1490 P DG C 24 -2.928 15.448 20.799 1.00 1.00 P ATOM 1491 OP1 DG C 24 -2.052 15.334 22.001 1.00 1.00 O ATOM 1492 OP2 DG C 24 -4.184 14.646 20.763 1.00 1.00 O ATOM 1493 O5' DG C 24 -3.317 17.006 20.596 1.00 1.00 O ATOM 1494 C5' DG C 24 -2.341 18.031 20.746 1.00 1.00 C ATOM 1495 C4' DG C 24 -2.768 19.371 20.128 1.00 1.00 C ATOM 1496 O4' DG C 24 -2.762 19.324 18.710 1.00 1.00 O ATOM 1497 C3' DG C 24 -4.166 19.870 20.530 1.00 1.00 C ATOM 1498 O3' DG C 24 -4.133 20.699 21.693 1.00 1.00 O ATOM 1499 C2' DG C 24 -4.623 20.657 19.301 1.00 1.00 C ATOM 1500 C1' DG C 24 -3.512 20.436 18.270 1.00 1.00 C ATOM 1501 N9 DG C 24 -4.042 20.213 16.913 1.00 1.00 N ATOM 1502 C8 DG C 24 -4.863 19.208 16.489 1.00 1.00 C ATOM 1503 N7 DG C 24 -5.247 19.316 15.241 1.00 1.00 N ATOM 1504 C5 DG C 24 -4.632 20.504 14.812 1.00 1.00 C ATOM 1505 C6 DG C 24 -4.666 21.216 13.555 1.00 1.00 C ATOM 1506 O6 DG C 24 -5.254 20.941 12.507 1.00 1.00 O ATOM 1507 N1 DG C 24 -3.937 22.389 13.568 1.00 1.00 N ATOM 1508 C2 DG C 24 -3.253 22.841 14.644 1.00 1.00 C ATOM 1509 N2 DG C 24 -2.617 23.973 14.515 1.00 1.00 N ATOM 1510 N3 DG C 24 -3.186 22.227 15.818 1.00 1.00 N ATOM 1511 C4 DG C 24 -3.895 21.059 15.839 1.00 1.00 C ATOM 0 H5' DG C 24 -1.409 17.706 20.284 1.00 1.00 H new ATOM 0 H5'' DG C 24 -2.137 18.177 21.807 1.00 1.00 H new ATOM 0 H4' DG C 24 -2.024 20.061 20.527 1.00 1.00 H new ATOM 0 H3' DG C 24 -4.837 19.053 20.796 1.00 1.00 H new ATOM 0 H2' DG C 24 -5.584 20.296 18.933 1.00 1.00 H new ATOM 0 H2'' DG C 24 -4.747 21.715 19.531 1.00 1.00 H new ATOM 0 HO3' DG C 24 -5.042 20.994 21.910 1.00 1.00 H new ATOM 0 H1' DG C 24 -2.890 21.328 18.198 1.00 1.00 H new ATOM 0 H8 DG C 24 -5.170 18.393 17.128 1.00 1.00 H new ATOM 0 H1 DG C 24 -3.913 22.948 12.715 1.00 1.00 H new ATOM 0 H21 DG C 24 -2.088 24.353 15.300 1.00 1.00 H new ATOM 0 H22 DG C 24 -2.649 24.478 13.629 1.00 1.00 H new TER 1524 DG C 24