USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 723 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 463 HIS HD1 : A 463 HIS ND1 : A 500 ZNZN :(H bumps) USER MOD NoAdj-H: A 465 HIS HE2 : A 465 HIS NE2 : A 500 ZNZN :(H bumps) USER MOD Set 1.1: B 5 DT C7 :methyl -30:sc= -3.83! (180deg=-3.95!) USER MOD Set 1.2: B 6 DT C7 :methyl 150:sc= -3.02 (180deg=-2.94) USER MOD Set 1.3: B 7 DT C7 :methyl 150:sc= -4.84! (180deg=-4.84!) USER MOD Set 2.1: A 443 LYS NZ :NH3+ -165:sc= 0.756 (180deg=0.614) USER MOD Set 2.2: A 459 TYR OH : rot -22:sc= 0.778 USER MOD Single : A 412 TYR OH : rot 180:sc= -4.9! USER MOD Single : A 416 LYS NZ :NH3+ -167:sc= 1.83 (180deg=1.65) USER MOD Single : A 417 TYR OH : rot -174:sc= 0.00345 USER MOD Single : A 419 GLN : amide:sc= -1.67 K(o=-1.7,f=-3.3!) USER MOD Single : A 420 LYS NZ :NH3+ -174:sc= 0.195 (180deg=0.183) USER MOD Single : A 423 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 ASN : amide:sc= -3.06 K(o=-3.1,f=-11!) USER MOD Single : A 427 TYR OH : rot 27:sc= -1.14 USER MOD Single : A 430 SER OG : rot -170:sc= 0.138 USER MOD Single : A 431 TYR OH : rot 135:sc= 1.16 USER MOD Single : A 432 TYR OH : rot 180:sc= -0.123 USER MOD Single : A 433 LYS NZ :NH3+ 135:sc= 0.173 (180deg=-2.16!) USER MOD Single : A 435 THR OG1 : rot 180:sc= -0.196 USER MOD Single : A 436 THR OG1 : rot 155:sc= -0.457! USER MOD Single : A 444 HIS : no HD1:sc= -0.323 K(o=-0.32,f=-1.7) USER MOD Single : A 450 THR OG1 : rot 180:sc= 0.0878 USER MOD Single : A 453 LYS NZ :NH3+ 178:sc= 1.1 (180deg=1.05) USER MOD Single : A 457 THR OG1 : rot 180:sc= 0 USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 462 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -0.112 K(o=-0.11,f=-0.9) USER MOD Single : B 3 DC O5' : rot -22:sc= 0.118 USER MOD Single : B 12 DA O3' : rot 180:sc= 0 USER MOD Single : C 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 21 DT O5' : rot 180:sc= -0.904 USER MOD Single : C 24 DT C7 :methyl 150:sc= -1.81 (180deg=-1.81) USER MOD Single : C 30 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 407 6.793 7.015 -0.639 1.00 0.00 N ATOM 2 CA LEU A 407 5.907 7.810 0.252 1.00 0.00 C ATOM 3 C LEU A 407 6.382 9.258 0.349 1.00 0.00 C ATOM 4 O LEU A 407 6.359 9.860 1.421 1.00 0.00 O ATOM 5 CB LEU A 407 5.896 7.153 1.637 1.00 0.00 C ATOM 6 CG LEU A 407 4.542 6.596 2.080 1.00 0.00 C ATOM 7 CD1 LEU A 407 4.721 5.592 3.209 1.00 0.00 C ATOM 8 CD2 LEU A 407 3.615 7.724 2.507 1.00 0.00 C ATOM 0 HA LEU A 407 4.898 7.827 -0.160 1.00 0.00 H new ATOM 0 HB2 LEU A 407 6.625 6.342 1.643 1.00 0.00 H new ATOM 0 HB3 LEU A 407 6.228 7.886 2.372 1.00 0.00 H new ATOM 0 HG LEU A 407 4.088 6.081 1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 407 3.747 5.207 3.511 1.00 0.00 H new ATOM 0 HD12 LEU A 407 5.347 4.768 2.867 1.00 0.00 H new ATOM 0 HD13 LEU A 407 5.197 6.081 4.059 1.00 0.00 H new ATOM 0 HD21 LEU A 407 2.657 7.309 2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 407 4.063 8.268 3.339 1.00 0.00 H new ATOM 0 HD23 LEU A 407 3.460 8.405 1.670 1.00 0.00 H new ATOM 20 N LEU A 408 6.814 9.808 -0.781 1.00 0.00 N ATOM 21 CA LEU A 408 7.297 11.184 -0.825 1.00 0.00 C ATOM 22 C LEU A 408 7.676 11.584 -2.247 1.00 0.00 C ATOM 23 O LEU A 408 8.756 12.128 -2.485 1.00 0.00 O ATOM 24 CB LEU A 408 8.499 11.350 0.102 1.00 0.00 C ATOM 25 CG LEU A 408 8.565 12.687 0.840 1.00 0.00 C ATOM 26 CD1 LEU A 408 7.781 12.619 2.142 1.00 0.00 C ATOM 27 CD2 LEU A 408 10.012 13.075 1.105 1.00 0.00 C ATOM 0 H LEU A 408 6.840 9.323 -1.678 1.00 0.00 H new ATOM 0 HA LEU A 408 6.492 11.837 -0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 408 8.485 10.546 0.838 1.00 0.00 H new ATOM 0 HB3 LEU A 408 9.410 11.230 -0.484 1.00 0.00 H new ATOM 0 HG LEU A 408 8.113 13.452 0.209 1.00 0.00 H new ATOM 0 HD11 LEU A 408 7.840 13.580 2.653 1.00 0.00 H new ATOM 0 HD12 LEU A 408 6.738 12.386 1.927 1.00 0.00 H new ATOM 0 HD13 LEU A 408 8.202 11.842 2.780 1.00 0.00 H new ATOM 0 HD21 LEU A 408 10.042 14.029 1.631 1.00 0.00 H new ATOM 0 HD22 LEU A 408 10.488 12.308 1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 408 10.544 13.166 0.158 1.00 0.00 H new ATOM 39 N ASP A 409 6.776 11.319 -3.185 1.00 0.00 N ATOM 40 CA ASP A 409 6.994 11.653 -4.591 1.00 0.00 C ATOM 41 C ASP A 409 8.407 11.287 -5.047 1.00 0.00 C ATOM 42 O ASP A 409 9.189 12.154 -5.438 1.00 0.00 O ATOM 43 CB ASP A 409 6.740 13.143 -4.822 1.00 0.00 C ATOM 44 CG ASP A 409 5.274 13.448 -5.072 1.00 0.00 C ATOM 45 OD1 ASP A 409 4.428 12.577 -4.776 1.00 0.00 O ATOM 46 OD2 ASP A 409 4.973 14.556 -5.564 1.00 0.00 O ATOM 0 H ASP A 409 5.880 10.870 -2.997 1.00 0.00 H new ATOM 0 HA ASP A 409 6.291 11.068 -5.183 1.00 0.00 H new ATOM 0 HB2 ASP A 409 7.083 13.706 -3.954 1.00 0.00 H new ATOM 0 HB3 ASP A 409 7.329 13.481 -5.674 1.00 0.00 H new ATOM 51 N ASP A 410 8.723 9.999 -4.998 1.00 0.00 N ATOM 52 CA ASP A 410 10.038 9.518 -5.413 1.00 0.00 C ATOM 53 C ASP A 410 10.188 9.585 -6.934 1.00 0.00 C ATOM 54 O ASP A 410 11.296 9.496 -7.463 1.00 0.00 O ATOM 55 CB ASP A 410 10.255 8.082 -4.929 1.00 0.00 C ATOM 56 CG ASP A 410 9.162 7.140 -5.397 1.00 0.00 C ATOM 57 OD1 ASP A 410 8.439 7.496 -6.352 1.00 0.00 O ATOM 58 OD2 ASP A 410 9.030 6.046 -4.808 1.00 0.00 O ATOM 0 H ASP A 410 8.089 9.268 -4.676 1.00 0.00 H new ATOM 0 HA ASP A 410 10.793 10.163 -4.963 1.00 0.00 H new ATOM 0 HB2 ASP A 410 11.219 7.722 -5.289 1.00 0.00 H new ATOM 0 HB3 ASP A 410 10.297 8.072 -3.840 1.00 0.00 H new ATOM 63 N GLY A 411 9.064 9.741 -7.628 1.00 0.00 N ATOM 64 CA GLY A 411 9.085 9.815 -9.077 1.00 0.00 C ATOM 65 C GLY A 411 7.827 9.240 -9.698 1.00 0.00 C ATOM 66 O GLY A 411 7.409 9.661 -10.777 1.00 0.00 O ATOM 0 H GLY A 411 8.137 9.818 -7.210 1.00 0.00 H new ATOM 0 HA2 GLY A 411 9.197 10.855 -9.384 1.00 0.00 H new ATOM 0 HA3 GLY A 411 9.954 9.275 -9.454 1.00 0.00 H new ATOM 70 N TYR A 412 7.228 8.272 -9.013 1.00 0.00 N ATOM 71 CA TYR A 412 6.009 7.629 -9.496 1.00 0.00 C ATOM 72 C TYR A 412 4.833 7.942 -8.575 1.00 0.00 C ATOM 73 O TYR A 412 4.958 8.731 -7.637 1.00 0.00 O ATOM 74 CB TYR A 412 6.210 6.114 -9.575 1.00 0.00 C ATOM 75 CG TYR A 412 7.372 5.686 -10.443 1.00 0.00 C ATOM 76 CD1 TYR A 412 8.668 5.674 -9.944 1.00 0.00 C ATOM 77 CD2 TYR A 412 7.173 5.280 -11.755 1.00 0.00 C ATOM 78 CE1 TYR A 412 9.730 5.268 -10.728 1.00 0.00 C ATOM 79 CE2 TYR A 412 8.229 4.876 -12.548 1.00 0.00 C ATOM 80 CZ TYR A 412 9.504 4.871 -12.030 1.00 0.00 C ATOM 81 OH TYR A 412 10.559 4.465 -12.815 1.00 0.00 O ATOM 0 H TYR A 412 7.567 7.914 -8.120 1.00 0.00 H new ATOM 0 HA TYR A 412 5.789 8.017 -10.490 1.00 0.00 H new ATOM 0 HB2 TYR A 412 6.362 5.726 -8.568 1.00 0.00 H new ATOM 0 HB3 TYR A 412 5.297 5.657 -9.958 1.00 0.00 H new ATOM 0 HD1 TYR A 412 8.848 5.987 -8.926 1.00 0.00 H new ATOM 0 HD2 TYR A 412 6.173 5.280 -12.164 1.00 0.00 H new ATOM 0 HE1 TYR A 412 10.732 5.261 -10.324 1.00 0.00 H new ATOM 0 HE2 TYR A 412 8.055 4.566 -13.568 1.00 0.00 H new ATOM 0 HH TYR A 412 10.229 4.217 -13.704 1.00 0.00 H new ATOM 91 N ARG A 413 3.695 7.310 -8.841 1.00 0.00 N ATOM 92 CA ARG A 413 2.500 7.510 -8.029 1.00 0.00 C ATOM 93 C ARG A 413 2.099 6.206 -7.349 1.00 0.00 C ATOM 94 O ARG A 413 1.831 5.208 -8.017 1.00 0.00 O ATOM 95 CB ARG A 413 1.348 8.029 -8.894 1.00 0.00 C ATOM 96 CG ARG A 413 1.242 9.546 -8.914 1.00 0.00 C ATOM 97 CD ARG A 413 1.060 10.110 -7.513 1.00 0.00 C ATOM 98 NE ARG A 413 1.977 11.215 -7.241 1.00 0.00 N ATOM 99 CZ ARG A 413 1.685 12.496 -7.459 1.00 0.00 C ATOM 100 NH1 ARG A 413 0.518 12.840 -7.992 1.00 0.00 N ATOM 101 NH2 ARG A 413 2.567 13.439 -7.151 1.00 0.00 N ATOM 0 H ARG A 413 3.575 6.654 -9.613 1.00 0.00 H new ATOM 0 HA ARG A 413 2.723 8.252 -7.262 1.00 0.00 H new ATOM 0 HB2 ARG A 413 1.479 7.668 -9.914 1.00 0.00 H new ATOM 0 HB3 ARG A 413 0.411 7.612 -8.526 1.00 0.00 H new ATOM 0 HG2 ARG A 413 2.140 9.969 -9.364 1.00 0.00 H new ATOM 0 HG3 ARG A 413 0.401 9.845 -9.540 1.00 0.00 H new ATOM 0 HD2 ARG A 413 0.033 10.454 -7.392 1.00 0.00 H new ATOM 0 HD3 ARG A 413 1.220 9.319 -6.781 1.00 0.00 H new ATOM 0 HE ARG A 413 2.897 10.991 -6.861 1.00 0.00 H new ATOM 0 HH11 ARG A 413 -0.162 12.121 -8.238 1.00 0.00 H new ATOM 0 HH12 ARG A 413 0.302 13.823 -8.156 1.00 0.00 H new ATOM 0 HH21 ARG A 413 3.468 13.182 -6.748 1.00 0.00 H new ATOM 0 HH22 ARG A 413 2.344 14.420 -7.318 1.00 0.00 H new ATOM 115 N TRP A 414 2.073 6.214 -6.019 1.00 0.00 N ATOM 116 CA TRP A 414 1.722 5.019 -5.261 1.00 0.00 C ATOM 117 C TRP A 414 0.426 5.204 -4.480 1.00 0.00 C ATOM 118 O TRP A 414 0.192 6.250 -3.877 1.00 0.00 O ATOM 119 CB TRP A 414 2.861 4.658 -4.310 1.00 0.00 C ATOM 120 CG TRP A 414 4.185 4.591 -5.000 1.00 0.00 C ATOM 121 CD1 TRP A 414 5.033 5.629 -5.253 1.00 0.00 C ATOM 122 CD2 TRP A 414 4.806 3.423 -5.539 1.00 0.00 C ATOM 123 NE1 TRP A 414 6.147 5.177 -5.917 1.00 0.00 N ATOM 124 CE2 TRP A 414 6.032 3.823 -6.103 1.00 0.00 C ATOM 125 CE3 TRP A 414 4.445 2.074 -5.597 1.00 0.00 C ATOM 126 CZ2 TRP A 414 6.896 2.923 -6.720 1.00 0.00 C ATOM 127 CZ3 TRP A 414 5.304 1.181 -6.210 1.00 0.00 C ATOM 128 CH2 TRP A 414 6.517 1.610 -6.765 1.00 0.00 C ATOM 0 H TRP A 414 2.290 7.030 -5.447 1.00 0.00 H new ATOM 0 HA TRP A 414 1.565 4.207 -5.970 1.00 0.00 H new ATOM 0 HB2 TRP A 414 2.909 5.396 -3.510 1.00 0.00 H new ATOM 0 HB3 TRP A 414 2.649 3.696 -3.844 1.00 0.00 H new ATOM 0 HD1 TRP A 414 4.854 6.656 -4.972 1.00 0.00 H new ATOM 0 HE1 TRP A 414 6.931 5.754 -6.222 1.00 0.00 H new ATOM 0 HE3 TRP A 414 3.512 1.735 -5.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 414 7.832 3.250 -7.148 1.00 0.00 H new ATOM 0 HZ3 TRP A 414 5.036 0.136 -6.262 1.00 0.00 H new ATOM 0 HH2 TRP A 414 7.166 0.888 -7.238 1.00 0.00 H new ATOM 139 N ARG A 415 -0.411 4.173 -4.505 1.00 0.00 N ATOM 140 CA ARG A 415 -1.691 4.202 -3.809 1.00 0.00 C ATOM 141 C ARG A 415 -1.680 3.251 -2.615 1.00 0.00 C ATOM 142 O ARG A 415 -1.393 2.063 -2.757 1.00 0.00 O ATOM 143 CB ARG A 415 -2.822 3.834 -4.771 1.00 0.00 C ATOM 144 CG ARG A 415 -4.209 4.012 -4.176 1.00 0.00 C ATOM 145 CD ARG A 415 -5.291 3.505 -5.115 1.00 0.00 C ATOM 146 NE ARG A 415 -5.750 2.168 -4.750 1.00 0.00 N ATOM 147 CZ ARG A 415 -6.911 1.649 -5.144 1.00 0.00 C ATOM 148 NH1 ARG A 415 -7.732 2.352 -5.915 1.00 0.00 N ATOM 149 NH2 ARG A 415 -7.249 0.424 -4.766 1.00 0.00 N ATOM 0 H ARG A 415 -0.224 3.303 -5.003 1.00 0.00 H new ATOM 0 HA ARG A 415 -1.858 5.213 -3.438 1.00 0.00 H new ATOM 0 HB2 ARG A 415 -2.739 4.448 -5.668 1.00 0.00 H new ATOM 0 HB3 ARG A 415 -2.700 2.797 -5.082 1.00 0.00 H new ATOM 0 HG2 ARG A 415 -4.270 3.478 -3.228 1.00 0.00 H new ATOM 0 HG3 ARG A 415 -4.380 5.066 -3.959 1.00 0.00 H new ATOM 0 HD2 ARG A 415 -6.135 4.194 -5.101 1.00 0.00 H new ATOM 0 HD3 ARG A 415 -4.908 3.491 -6.135 1.00 0.00 H new ATOM 0 HE ARG A 415 -5.146 1.598 -4.158 1.00 0.00 H new ATOM 0 HH11 ARG A 415 -7.474 3.294 -6.208 1.00 0.00 H new ATOM 0 HH12 ARG A 415 -8.620 1.950 -6.214 1.00 0.00 H new ATOM 0 HH21 ARG A 415 -6.620 -0.119 -4.174 1.00 0.00 H new ATOM 0 HH22 ARG A 415 -8.138 0.025 -5.067 1.00 0.00 H new ATOM 163 N LYS A 416 -1.993 3.786 -1.440 1.00 0.00 N ATOM 164 CA LYS A 416 -2.021 2.997 -0.213 1.00 0.00 C ATOM 165 C LYS A 416 -3.241 2.075 -0.189 1.00 0.00 C ATOM 166 O LYS A 416 -4.325 2.458 -0.630 1.00 0.00 O ATOM 167 CB LYS A 416 -2.011 3.945 1.002 1.00 0.00 C ATOM 168 CG LYS A 416 -2.890 3.519 2.171 1.00 0.00 C ATOM 169 CD LYS A 416 -2.352 4.049 3.491 1.00 0.00 C ATOM 170 CE LYS A 416 -2.526 5.555 3.600 1.00 0.00 C ATOM 171 NZ LYS A 416 -2.653 6.000 5.015 1.00 0.00 N ATOM 0 H LYS A 416 -2.232 4.769 -1.311 1.00 0.00 H new ATOM 0 HA LYS A 416 -1.136 2.363 -0.171 1.00 0.00 H new ATOM 0 HB2 LYS A 416 -0.985 4.042 1.357 1.00 0.00 H new ATOM 0 HB3 LYS A 416 -2.329 4.934 0.672 1.00 0.00 H new ATOM 0 HG2 LYS A 416 -3.905 3.885 2.017 1.00 0.00 H new ATOM 0 HG3 LYS A 416 -2.945 2.431 2.209 1.00 0.00 H new ATOM 0 HD2 LYS A 416 -2.869 3.561 4.318 1.00 0.00 H new ATOM 0 HD3 LYS A 416 -1.296 3.796 3.582 1.00 0.00 H new ATOM 0 HE2 LYS A 416 -1.673 6.053 3.138 1.00 0.00 H new ATOM 0 HE3 LYS A 416 -3.412 5.859 3.043 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 -2.987 6.985 5.041 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -3.334 5.391 5.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 -1.727 5.936 5.484 1.00 0.00 H new ATOM 185 N TYR A 417 -3.064 0.865 0.350 1.00 0.00 N ATOM 186 CA TYR A 417 -4.184 -0.072 0.435 1.00 0.00 C ATOM 187 C TYR A 417 -3.859 -1.372 1.171 1.00 0.00 C ATOM 188 O TYR A 417 -2.789 -1.957 1.008 1.00 0.00 O ATOM 189 CB TYR A 417 -4.703 -0.399 -0.970 1.00 0.00 C ATOM 190 CG TYR A 417 -3.808 -1.340 -1.746 1.00 0.00 C ATOM 191 CD1 TYR A 417 -2.742 -0.858 -2.492 1.00 0.00 C ATOM 192 CD2 TYR A 417 -4.032 -2.711 -1.728 1.00 0.00 C ATOM 193 CE1 TYR A 417 -1.921 -1.716 -3.199 1.00 0.00 C ATOM 194 CE2 TYR A 417 -3.216 -3.574 -2.433 1.00 0.00 C ATOM 195 CZ TYR A 417 -2.161 -3.073 -3.165 1.00 0.00 C ATOM 196 OH TYR A 417 -1.344 -3.929 -3.867 1.00 0.00 O ATOM 0 H TYR A 417 -2.180 0.519 0.724 1.00 0.00 H new ATOM 0 HA TYR A 417 -4.949 0.434 1.025 1.00 0.00 H new ATOM 0 HB2 TYR A 417 -5.696 -0.842 -0.887 1.00 0.00 H new ATOM 0 HB3 TYR A 417 -4.814 0.529 -1.532 1.00 0.00 H new ATOM 0 HD1 TYR A 417 -2.551 0.205 -2.521 1.00 0.00 H new ATOM 0 HD2 TYR A 417 -4.856 -3.108 -1.154 1.00 0.00 H new ATOM 0 HE1 TYR A 417 -1.095 -1.325 -3.775 1.00 0.00 H new ATOM 0 HE2 TYR A 417 -3.404 -4.637 -2.411 1.00 0.00 H new ATOM 0 HH TYR A 417 -1.705 -4.839 -3.819 1.00 0.00 H new ATOM 206 N GLY A 418 -4.840 -1.825 1.952 1.00 0.00 N ATOM 207 CA GLY A 418 -4.722 -3.073 2.682 1.00 0.00 C ATOM 208 C GLY A 418 -3.951 -2.973 3.984 1.00 0.00 C ATOM 209 O GLY A 418 -2.832 -3.477 4.081 1.00 0.00 O ATOM 0 H GLY A 418 -5.726 -1.339 2.091 1.00 0.00 H new ATOM 0 HA2 GLY A 418 -5.722 -3.450 2.896 1.00 0.00 H new ATOM 0 HA3 GLY A 418 -4.234 -3.808 2.042 1.00 0.00 H new ATOM 213 N GLN A 419 -4.546 -2.353 4.998 1.00 0.00 N ATOM 214 CA GLN A 419 -3.888 -2.239 6.290 1.00 0.00 C ATOM 215 C GLN A 419 -3.958 -3.569 7.034 1.00 0.00 C ATOM 216 O GLN A 419 -5.038 -4.038 7.397 1.00 0.00 O ATOM 217 CB GLN A 419 -4.525 -1.136 7.134 1.00 0.00 C ATOM 218 CG GLN A 419 -3.850 -0.955 8.484 1.00 0.00 C ATOM 219 CD GLN A 419 -2.996 0.296 8.548 1.00 0.00 C ATOM 220 OE1 GLN A 419 -1.773 0.221 8.678 1.00 0.00 O ATOM 221 NE2 GLN A 419 -3.634 1.455 8.458 1.00 0.00 N ATOM 0 H GLN A 419 -5.472 -1.927 4.950 1.00 0.00 H new ATOM 0 HA GLN A 419 -2.844 -1.979 6.117 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -4.483 -0.196 6.584 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -5.579 -1.368 7.289 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -4.611 -0.911 9.263 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -3.229 -1.825 8.695 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -4.648 1.472 8.351 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -3.110 2.330 8.496 1.00 0.00 H new ATOM 230 N LYS A 420 -2.799 -4.179 7.243 1.00 0.00 N ATOM 231 CA LYS A 420 -2.717 -5.466 7.930 1.00 0.00 C ATOM 232 C LYS A 420 -1.631 -5.434 8.997 1.00 0.00 C ATOM 233 O LYS A 420 -0.690 -4.649 8.905 1.00 0.00 O ATOM 234 CB LYS A 420 -2.426 -6.575 6.917 1.00 0.00 C ATOM 235 CG LYS A 420 -2.658 -7.977 7.455 1.00 0.00 C ATOM 236 CD LYS A 420 -2.974 -8.958 6.337 1.00 0.00 C ATOM 237 CE LYS A 420 -1.706 -9.530 5.723 1.00 0.00 C ATOM 238 NZ LYS A 420 -1.925 -10.890 5.160 1.00 0.00 N ATOM 0 H LYS A 420 -1.898 -3.804 6.946 1.00 0.00 H new ATOM 0 HA LYS A 420 -3.672 -5.665 8.416 1.00 0.00 H new ATOM 0 HB2 LYS A 420 -3.054 -6.425 6.039 1.00 0.00 H new ATOM 0 HB3 LYS A 420 -1.391 -6.490 6.587 1.00 0.00 H new ATOM 0 HG2 LYS A 420 -1.772 -8.312 7.995 1.00 0.00 H new ATOM 0 HG3 LYS A 420 -3.480 -7.962 8.170 1.00 0.00 H new ATOM 0 HD2 LYS A 420 -3.589 -9.769 6.726 1.00 0.00 H new ATOM 0 HD3 LYS A 420 -3.559 -8.457 5.566 1.00 0.00 H new ATOM 0 HE2 LYS A 420 -1.352 -8.864 4.936 1.00 0.00 H new ATOM 0 HE3 LYS A 420 -0.923 -9.573 6.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 -1.017 -11.285 4.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 -2.335 -11.506 5.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 -2.577 -10.830 4.352 1.00 0.00 H new ATOM 252 N VAL A 421 -1.752 -6.291 10.008 1.00 0.00 N ATOM 253 CA VAL A 421 -0.762 -6.347 11.076 1.00 0.00 C ATOM 254 C VAL A 421 -0.043 -7.693 11.082 1.00 0.00 C ATOM 255 O VAL A 421 -0.652 -8.732 10.825 1.00 0.00 O ATOM 256 CB VAL A 421 -1.405 -6.114 12.458 1.00 0.00 C ATOM 257 CG1 VAL A 421 -2.434 -7.194 12.762 1.00 0.00 C ATOM 258 CG2 VAL A 421 -0.340 -6.064 13.542 1.00 0.00 C ATOM 0 H VAL A 421 -2.522 -6.952 10.109 1.00 0.00 H new ATOM 0 HA VAL A 421 -0.043 -5.551 10.884 1.00 0.00 H new ATOM 0 HB VAL A 421 -1.918 -5.152 12.439 1.00 0.00 H new ATOM 0 HG11 VAL A 421 -2.875 -7.011 13.742 1.00 0.00 H new ATOM 0 HG12 VAL A 421 -3.216 -7.176 12.003 1.00 0.00 H new ATOM 0 HG13 VAL A 421 -1.949 -8.170 12.760 1.00 0.00 H new ATOM 0 HG21 VAL A 421 -0.813 -5.899 14.510 1.00 0.00 H new ATOM 0 HG22 VAL A 421 0.205 -7.008 13.561 1.00 0.00 H new ATOM 0 HG23 VAL A 421 0.353 -5.249 13.334 1.00 0.00 H new ATOM 268 N VAL A 422 1.253 -7.668 11.370 1.00 0.00 N ATOM 269 CA VAL A 422 2.048 -8.889 11.402 1.00 0.00 C ATOM 270 C VAL A 422 2.741 -9.069 12.748 1.00 0.00 C ATOM 271 O VAL A 422 3.154 -8.088 13.387 1.00 0.00 O ATOM 272 CB VAL A 422 3.111 -8.899 10.289 1.00 0.00 C ATOM 273 CG1 VAL A 422 2.467 -9.179 8.940 1.00 0.00 C ATOM 274 CG2 VAL A 422 3.870 -7.582 10.263 1.00 0.00 C ATOM 0 H VAL A 422 1.774 -6.818 11.584 1.00 0.00 H new ATOM 0 HA VAL A 422 1.354 -9.714 11.243 1.00 0.00 H new ATOM 0 HB VAL A 422 3.823 -9.697 10.499 1.00 0.00 H new ATOM 0 HG11 VAL A 422 3.233 -9.182 8.165 1.00 0.00 H new ATOM 0 HG12 VAL A 422 1.974 -10.151 8.967 1.00 0.00 H new ATOM 0 HG13 VAL A 422 1.732 -8.405 8.720 1.00 0.00 H new ATOM 0 HG21 VAL A 422 4.617 -7.608 9.470 1.00 0.00 H new ATOM 0 HG22 VAL A 422 3.173 -6.764 10.079 1.00 0.00 H new ATOM 0 HG23 VAL A 422 4.365 -7.428 11.222 1.00 0.00 H new ATOM 284 N LYS A 423 2.866 -10.334 13.168 1.00 0.00 N ATOM 285 CA LYS A 423 3.509 -10.677 14.431 1.00 0.00 C ATOM 286 C LYS A 423 5.024 -10.687 14.274 1.00 0.00 C ATOM 287 O LYS A 423 5.544 -10.378 13.202 1.00 0.00 O ATOM 288 CB LYS A 423 3.023 -12.042 14.923 1.00 0.00 C ATOM 289 CG LYS A 423 1.858 -11.957 15.896 1.00 0.00 C ATOM 290 CD LYS A 423 0.554 -11.659 15.175 1.00 0.00 C ATOM 291 CE LYS A 423 -0.643 -11.835 16.097 1.00 0.00 C ATOM 292 NZ LYS A 423 -1.845 -11.116 15.589 1.00 0.00 N ATOM 0 H LYS A 423 2.525 -11.139 12.643 1.00 0.00 H new ATOM 0 HA LYS A 423 3.240 -9.921 15.169 1.00 0.00 H new ATOM 0 HB2 LYS A 423 2.726 -12.644 14.064 1.00 0.00 H new ATOM 0 HB3 LYS A 423 3.851 -12.562 15.405 1.00 0.00 H new ATOM 0 HG2 LYS A 423 1.768 -12.897 16.441 1.00 0.00 H new ATOM 0 HG3 LYS A 423 2.054 -11.179 16.633 1.00 0.00 H new ATOM 0 HD2 LYS A 423 0.573 -10.639 14.792 1.00 0.00 H new ATOM 0 HD3 LYS A 423 0.453 -12.321 14.315 1.00 0.00 H new ATOM 0 HE2 LYS A 423 -0.870 -12.896 16.198 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -0.393 -11.466 17.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -2.639 -11.260 16.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -1.637 -10.100 15.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 -2.100 -11.485 14.651 1.00 0.00 H new ATOM 306 N GLY A 424 5.739 -11.012 15.352 1.00 0.00 N ATOM 307 CA GLY A 424 7.194 -11.013 15.296 1.00 0.00 C ATOM 308 C GLY A 424 7.747 -9.612 15.082 1.00 0.00 C ATOM 309 O GLY A 424 8.948 -9.375 15.203 1.00 0.00 O ATOM 0 H GLY A 424 5.341 -11.272 16.255 1.00 0.00 H new ATOM 0 HA2 GLY A 424 7.594 -11.425 16.222 1.00 0.00 H new ATOM 0 HA3 GLY A 424 7.527 -11.664 14.488 1.00 0.00 H new ATOM 313 N ASN A 425 6.843 -8.685 14.777 1.00 0.00 N ATOM 314 CA ASN A 425 7.165 -7.292 14.551 1.00 0.00 C ATOM 315 C ASN A 425 5.886 -6.476 14.699 1.00 0.00 C ATOM 316 O ASN A 425 5.503 -5.746 13.787 1.00 0.00 O ATOM 317 CB ASN A 425 7.764 -7.100 13.154 1.00 0.00 C ATOM 318 CG ASN A 425 8.085 -5.649 12.858 1.00 0.00 C ATOM 319 OD1 ASN A 425 8.151 -4.819 13.764 1.00 0.00 O ATOM 320 ND2 ASN A 425 8.281 -5.335 11.584 1.00 0.00 N ATOM 0 H ASN A 425 5.849 -8.892 14.680 1.00 0.00 H new ATOM 0 HA ASN A 425 7.905 -6.959 15.278 1.00 0.00 H new ATOM 0 HB2 ASN A 425 8.673 -7.696 13.066 1.00 0.00 H new ATOM 0 HB3 ASN A 425 7.064 -7.474 12.407 1.00 0.00 H new ATOM 0 HD21 ASN A 425 8.496 -4.373 11.323 1.00 0.00 H new ATOM 0 HD22 ASN A 425 8.216 -6.056 10.865 1.00 0.00 H new ATOM 327 N PRO A 426 5.197 -6.623 15.855 1.00 0.00 N ATOM 328 CA PRO A 426 3.936 -5.946 16.165 1.00 0.00 C ATOM 329 C PRO A 426 3.757 -4.605 15.467 1.00 0.00 C ATOM 330 O PRO A 426 3.828 -3.554 16.101 1.00 0.00 O ATOM 331 CB PRO A 426 4.058 -5.749 17.669 1.00 0.00 C ATOM 332 CG PRO A 426 4.818 -6.945 18.154 1.00 0.00 C ATOM 333 CD PRO A 426 5.594 -7.495 16.974 1.00 0.00 C ATOM 0 HA PRO A 426 3.072 -6.521 15.831 1.00 0.00 H new ATOM 0 HB2 PRO A 426 4.584 -4.824 17.905 1.00 0.00 H new ATOM 0 HB3 PRO A 426 3.077 -5.687 18.140 1.00 0.00 H new ATOM 0 HG2 PRO A 426 5.494 -6.669 18.963 1.00 0.00 H new ATOM 0 HG3 PRO A 426 4.137 -7.698 18.551 1.00 0.00 H new ATOM 0 HD2 PRO A 426 6.669 -7.456 17.149 1.00 0.00 H new ATOM 0 HD3 PRO A 426 5.340 -8.537 16.779 1.00 0.00 H new ATOM 341 N TYR A 427 3.528 -4.645 14.160 1.00 0.00 N ATOM 342 CA TYR A 427 3.352 -3.411 13.396 1.00 0.00 C ATOM 343 C TYR A 427 2.453 -3.621 12.179 1.00 0.00 C ATOM 344 O TYR A 427 2.453 -4.693 11.576 1.00 0.00 O ATOM 345 CB TYR A 427 4.712 -2.865 12.949 1.00 0.00 C ATOM 346 CG TYR A 427 5.494 -2.178 14.051 1.00 0.00 C ATOM 347 CD1 TYR A 427 6.128 -2.914 15.048 1.00 0.00 C ATOM 348 CD2 TYR A 427 5.603 -0.793 14.092 1.00 0.00 C ATOM 349 CE1 TYR A 427 6.845 -2.290 16.050 1.00 0.00 C ATOM 350 CE2 TYR A 427 6.318 -0.162 15.093 1.00 0.00 C ATOM 351 CZ TYR A 427 6.936 -0.915 16.070 1.00 0.00 C ATOM 352 OH TYR A 427 7.649 -0.293 17.068 1.00 0.00 O ATOM 0 H TYR A 427 3.460 -5.503 13.612 1.00 0.00 H new ATOM 0 HA TYR A 427 2.867 -2.687 14.051 1.00 0.00 H new ATOM 0 HB2 TYR A 427 5.309 -3.686 12.552 1.00 0.00 H new ATOM 0 HB3 TYR A 427 4.558 -2.159 12.133 1.00 0.00 H new ATOM 0 HD1 TYR A 427 6.058 -3.992 15.038 1.00 0.00 H new ATOM 0 HD2 TYR A 427 5.121 -0.200 13.329 1.00 0.00 H new ATOM 0 HE1 TYR A 427 7.332 -2.877 16.815 1.00 0.00 H new ATOM 0 HE2 TYR A 427 6.392 0.915 15.110 1.00 0.00 H new ATOM 0 HH TYR A 427 8.346 -0.898 17.398 1.00 0.00 H new ATOM 362 N PRO A 428 1.674 -2.590 11.802 1.00 0.00 N ATOM 363 CA PRO A 428 0.771 -2.659 10.656 1.00 0.00 C ATOM 364 C PRO A 428 1.481 -2.376 9.333 1.00 0.00 C ATOM 365 O PRO A 428 2.138 -1.348 9.177 1.00 0.00 O ATOM 366 CB PRO A 428 -0.242 -1.561 10.960 1.00 0.00 C ATOM 367 CG PRO A 428 0.535 -0.532 11.707 1.00 0.00 C ATOM 368 CD PRO A 428 1.609 -1.272 12.468 1.00 0.00 C ATOM 0 HA PRO A 428 0.335 -3.651 10.533 1.00 0.00 H new ATOM 0 HB2 PRO A 428 -0.668 -1.150 10.045 1.00 0.00 H new ATOM 0 HB3 PRO A 428 -1.072 -1.941 11.555 1.00 0.00 H new ATOM 0 HG2 PRO A 428 0.975 0.194 11.023 1.00 0.00 H new ATOM 0 HG3 PRO A 428 -0.111 0.022 12.388 1.00 0.00 H new ATOM 0 HD2 PRO A 428 2.565 -0.751 12.417 1.00 0.00 H new ATOM 0 HD3 PRO A 428 1.355 -1.370 13.523 1.00 0.00 H new ATOM 376 N ARG A 429 1.343 -3.298 8.386 1.00 0.00 N ATOM 377 CA ARG A 429 1.969 -3.157 7.077 1.00 0.00 C ATOM 378 C ARG A 429 1.056 -2.393 6.117 1.00 0.00 C ATOM 379 O ARG A 429 -0.167 -2.403 6.263 1.00 0.00 O ATOM 380 CB ARG A 429 2.297 -4.541 6.504 1.00 0.00 C ATOM 381 CG ARG A 429 2.879 -4.507 5.097 1.00 0.00 C ATOM 382 CD ARG A 429 2.834 -5.881 4.444 1.00 0.00 C ATOM 383 NE ARG A 429 4.165 -6.360 4.084 1.00 0.00 N ATOM 384 CZ ARG A 429 4.449 -7.634 3.822 1.00 0.00 C ATOM 385 NH1 ARG A 429 3.498 -8.560 3.883 1.00 0.00 N ATOM 386 NH2 ARG A 429 5.686 -7.985 3.500 1.00 0.00 N ATOM 0 H ARG A 429 0.801 -4.154 8.502 1.00 0.00 H new ATOM 0 HA ARG A 429 2.892 -2.589 7.195 1.00 0.00 H new ATOM 0 HB2 ARG A 429 3.005 -5.039 7.167 1.00 0.00 H new ATOM 0 HB3 ARG A 429 1.389 -5.144 6.496 1.00 0.00 H new ATOM 0 HG2 ARG A 429 2.322 -3.795 4.488 1.00 0.00 H new ATOM 0 HG3 ARG A 429 3.910 -4.155 5.136 1.00 0.00 H new ATOM 0 HD2 ARG A 429 2.365 -6.591 5.126 1.00 0.00 H new ATOM 0 HD3 ARG A 429 2.211 -5.838 3.551 1.00 0.00 H new ATOM 0 HE ARG A 429 4.922 -5.679 4.030 1.00 0.00 H new ATOM 0 HH11 ARG A 429 2.545 -8.296 4.132 1.00 0.00 H new ATOM 0 HH12 ARG A 429 3.721 -9.535 3.681 1.00 0.00 H new ATOM 0 HH21 ARG A 429 6.421 -7.279 3.453 1.00 0.00 H new ATOM 0 HH22 ARG A 429 5.903 -8.961 3.299 1.00 0.00 H new ATOM 400 N SER A 430 1.663 -1.750 5.127 1.00 0.00 N ATOM 401 CA SER A 430 0.920 -0.996 4.126 1.00 0.00 C ATOM 402 C SER A 430 1.352 -1.428 2.730 1.00 0.00 C ATOM 403 O SER A 430 2.543 -1.616 2.477 1.00 0.00 O ATOM 404 CB SER A 430 1.149 0.506 4.308 1.00 0.00 C ATOM 405 OG SER A 430 1.492 0.808 5.649 1.00 0.00 O ATOM 0 H SER A 430 2.674 -1.736 4.996 1.00 0.00 H new ATOM 0 HA SER A 430 -0.144 -1.200 4.250 1.00 0.00 H new ATOM 0 HB2 SER A 430 1.944 0.840 3.641 1.00 0.00 H new ATOM 0 HB3 SER A 430 0.248 1.052 4.028 1.00 0.00 H new ATOM 0 HG SER A 430 1.479 1.779 5.779 1.00 0.00 H new ATOM 411 N TYR A 431 0.393 -1.599 1.827 1.00 0.00 N ATOM 412 CA TYR A 431 0.714 -2.021 0.470 1.00 0.00 C ATOM 413 C TYR A 431 0.572 -0.874 -0.524 1.00 0.00 C ATOM 414 O TYR A 431 -0.539 -0.524 -0.931 1.00 0.00 O ATOM 415 CB TYR A 431 -0.179 -3.188 0.038 1.00 0.00 C ATOM 416 CG TYR A 431 -0.048 -4.424 0.904 1.00 0.00 C ATOM 417 CD1 TYR A 431 -0.682 -4.506 2.139 1.00 0.00 C ATOM 418 CD2 TYR A 431 0.704 -5.511 0.481 1.00 0.00 C ATOM 419 CE1 TYR A 431 -0.568 -5.637 2.926 1.00 0.00 C ATOM 420 CE2 TYR A 431 0.825 -6.644 1.261 1.00 0.00 C ATOM 421 CZ TYR A 431 0.187 -6.703 2.484 1.00 0.00 C ATOM 422 OH TYR A 431 0.302 -7.830 3.263 1.00 0.00 O ATOM 0 H TYR A 431 -0.600 -1.454 2.007 1.00 0.00 H new ATOM 0 HA TYR A 431 1.754 -2.346 0.473 1.00 0.00 H new ATOM 0 HB2 TYR A 431 -1.218 -2.859 0.049 1.00 0.00 H new ATOM 0 HB3 TYR A 431 0.061 -3.453 -0.992 1.00 0.00 H new ATOM 0 HD1 TYR A 431 -1.273 -3.673 2.489 1.00 0.00 H new ATOM 0 HD2 TYR A 431 1.204 -5.470 -0.476 1.00 0.00 H new ATOM 0 HE1 TYR A 431 -1.068 -5.685 3.882 1.00 0.00 H new ATOM 0 HE2 TYR A 431 1.416 -7.480 0.916 1.00 0.00 H new ATOM 0 HH TYR A 431 0.179 -8.627 2.706 1.00 0.00 H new ATOM 432 N TYR A 432 1.707 -0.293 -0.912 1.00 0.00 N ATOM 433 CA TYR A 432 1.731 0.808 -1.870 1.00 0.00 C ATOM 434 C TYR A 432 2.091 0.275 -3.253 1.00 0.00 C ATOM 435 O TYR A 432 3.207 -0.195 -3.464 1.00 0.00 O ATOM 436 CB TYR A 432 2.768 1.853 -1.452 1.00 0.00 C ATOM 437 CG TYR A 432 2.270 2.857 -0.441 1.00 0.00 C ATOM 438 CD1 TYR A 432 1.502 3.944 -0.835 1.00 0.00 C ATOM 439 CD2 TYR A 432 2.576 2.721 0.907 1.00 0.00 C ATOM 440 CE1 TYR A 432 1.054 4.870 0.089 1.00 0.00 C ATOM 441 CE2 TYR A 432 2.132 3.642 1.835 1.00 0.00 C ATOM 442 CZ TYR A 432 1.370 4.715 1.421 1.00 0.00 C ATOM 443 OH TYR A 432 0.926 5.633 2.343 1.00 0.00 O ATOM 0 H TYR A 432 2.628 -0.571 -0.573 1.00 0.00 H new ATOM 0 HA TYR A 432 0.744 1.271 -1.895 1.00 0.00 H new ATOM 0 HB2 TYR A 432 3.636 1.340 -1.039 1.00 0.00 H new ATOM 0 HB3 TYR A 432 3.106 2.387 -2.340 1.00 0.00 H new ATOM 0 HD1 TYR A 432 1.251 4.068 -1.878 1.00 0.00 H new ATOM 0 HD2 TYR A 432 3.171 1.881 1.235 1.00 0.00 H new ATOM 0 HE1 TYR A 432 0.459 5.712 -0.232 1.00 0.00 H new ATOM 0 HE2 TYR A 432 2.380 3.523 2.879 1.00 0.00 H new ATOM 0 HH TYR A 432 1.236 5.376 3.236 1.00 0.00 H new ATOM 453 N LYS A 433 1.158 0.344 -4.195 1.00 0.00 N ATOM 454 CA LYS A 433 1.419 -0.145 -5.546 1.00 0.00 C ATOM 455 C LYS A 433 1.390 0.992 -6.559 1.00 0.00 C ATOM 456 O LYS A 433 0.438 1.769 -6.610 1.00 0.00 O ATOM 457 CB LYS A 433 0.407 -1.231 -5.934 1.00 0.00 C ATOM 458 CG LYS A 433 -0.968 -0.697 -6.304 1.00 0.00 C ATOM 459 CD LYS A 433 -1.878 -1.810 -6.791 1.00 0.00 C ATOM 460 CE LYS A 433 -3.341 -1.484 -6.533 1.00 0.00 C ATOM 461 NZ LYS A 433 -4.144 -2.711 -6.273 1.00 0.00 N ATOM 0 H LYS A 433 0.224 0.729 -4.053 1.00 0.00 H new ATOM 0 HA LYS A 433 2.418 -0.580 -5.554 1.00 0.00 H new ATOM 0 HB2 LYS A 433 0.804 -1.797 -6.777 1.00 0.00 H new ATOM 0 HB3 LYS A 433 0.302 -1.928 -5.103 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -1.417 -0.210 -5.438 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -0.869 0.061 -7.081 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -1.722 -1.969 -7.858 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -1.617 -2.741 -6.288 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -3.418 -0.811 -5.679 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -3.753 -0.956 -7.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -4.768 -2.551 -5.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 -4.720 -2.933 -7.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -3.506 -3.507 -6.071 1.00 0.00 H new ATOM 475 N CYS A 434 2.440 1.082 -7.365 1.00 0.00 N ATOM 476 CA CYS A 434 2.534 2.120 -8.378 1.00 0.00 C ATOM 477 C CYS A 434 1.640 1.799 -9.567 1.00 0.00 C ATOM 478 O CYS A 434 1.859 0.816 -10.274 1.00 0.00 O ATOM 479 CB CYS A 434 3.987 2.286 -8.844 1.00 0.00 C ATOM 480 SG CYS A 434 4.184 3.224 -10.384 1.00 0.00 S ATOM 0 H CYS A 434 3.238 0.447 -7.335 1.00 0.00 H new ATOM 0 HA CYS A 434 2.196 3.056 -7.933 1.00 0.00 H new ATOM 0 HB2 CYS A 434 4.553 2.783 -8.056 1.00 0.00 H new ATOM 0 HB3 CYS A 434 4.427 1.298 -8.977 1.00 0.00 H new ATOM 485 N THR A 435 0.657 2.653 -9.802 1.00 0.00 N ATOM 486 CA THR A 435 -0.240 2.480 -10.927 1.00 0.00 C ATOM 487 C THR A 435 0.213 3.396 -12.052 1.00 0.00 C ATOM 488 O THR A 435 0.931 4.366 -11.809 1.00 0.00 O ATOM 489 CB THR A 435 -1.713 2.782 -10.557 1.00 0.00 C ATOM 490 OG1 THR A 435 -2.454 3.131 -11.732 1.00 0.00 O ATOM 491 CG2 THR A 435 -1.813 3.908 -9.536 1.00 0.00 C ATOM 0 H THR A 435 0.462 3.473 -9.227 1.00 0.00 H new ATOM 0 HA THR A 435 -0.201 1.437 -11.240 1.00 0.00 H new ATOM 0 HB THR A 435 -2.134 1.881 -10.112 1.00 0.00 H new ATOM 0 HG1 THR A 435 -3.385 3.319 -11.488 1.00 0.00 H new ATOM 0 HG21 THR A 435 -2.861 4.093 -9.300 1.00 0.00 H new ATOM 0 HG22 THR A 435 -1.281 3.624 -8.628 1.00 0.00 H new ATOM 0 HG23 THR A 435 -1.369 4.814 -9.949 1.00 0.00 H new ATOM 499 N THR A 436 -0.202 3.110 -13.276 1.00 0.00 N ATOM 500 CA THR A 436 0.172 3.931 -14.418 1.00 0.00 C ATOM 501 C THR A 436 -0.515 3.405 -15.673 1.00 0.00 C ATOM 502 O THR A 436 -0.619 2.192 -15.857 1.00 0.00 O ATOM 503 CB THR A 436 1.696 3.930 -14.660 1.00 0.00 C ATOM 504 OG1 THR A 436 2.387 3.383 -13.531 1.00 0.00 O ATOM 505 CG2 THR A 436 2.210 5.333 -14.942 1.00 0.00 C ATOM 0 H THR A 436 -0.799 2.315 -13.505 1.00 0.00 H new ATOM 0 HA THR A 436 -0.142 4.952 -14.199 1.00 0.00 H new ATOM 0 HB THR A 436 1.888 3.307 -15.534 1.00 0.00 H new ATOM 0 HG1 THR A 436 3.253 3.026 -13.819 1.00 0.00 H new ATOM 0 HG21 THR A 436 3.287 5.299 -15.108 1.00 0.00 H new ATOM 0 HG22 THR A 436 1.718 5.729 -15.830 1.00 0.00 H new ATOM 0 HG23 THR A 436 1.994 5.978 -14.090 1.00 0.00 H new ATOM 513 N PRO A 437 -0.989 4.294 -16.561 1.00 0.00 N ATOM 514 CA PRO A 437 -1.655 3.876 -17.798 1.00 0.00 C ATOM 515 C PRO A 437 -0.792 2.910 -18.605 1.00 0.00 C ATOM 516 O PRO A 437 -0.068 3.319 -19.511 1.00 0.00 O ATOM 517 CB PRO A 437 -1.849 5.190 -18.562 1.00 0.00 C ATOM 518 CG PRO A 437 -1.850 6.246 -17.510 1.00 0.00 C ATOM 519 CD PRO A 437 -0.914 5.761 -16.439 1.00 0.00 C ATOM 0 HA PRO A 437 -2.587 3.344 -17.607 1.00 0.00 H new ATOM 0 HB2 PRO A 437 -1.047 5.351 -19.283 1.00 0.00 H new ATOM 0 HB3 PRO A 437 -2.785 5.188 -19.121 1.00 0.00 H new ATOM 0 HG2 PRO A 437 -1.518 7.202 -17.916 1.00 0.00 H new ATOM 0 HG3 PRO A 437 -2.853 6.400 -17.112 1.00 0.00 H new ATOM 0 HD2 PRO A 437 0.101 6.126 -16.596 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -1.225 6.099 -15.450 1.00 0.00 H new ATOM 527 N GLY A 438 -0.865 1.623 -18.265 1.00 0.00 N ATOM 528 CA GLY A 438 -0.077 0.625 -18.963 1.00 0.00 C ATOM 529 C GLY A 438 1.021 0.023 -18.098 1.00 0.00 C ATOM 530 O GLY A 438 1.811 -0.793 -18.575 1.00 0.00 O ATOM 0 H GLY A 438 -1.456 1.257 -17.519 1.00 0.00 H new ATOM 0 HA2 GLY A 438 -0.735 -0.171 -19.311 1.00 0.00 H new ATOM 0 HA3 GLY A 438 0.372 1.078 -19.847 1.00 0.00 H new ATOM 534 N CYS A 439 1.081 0.424 -16.827 1.00 0.00 N ATOM 535 CA CYS A 439 2.105 -0.090 -15.920 1.00 0.00 C ATOM 536 C CYS A 439 1.546 -0.358 -14.523 1.00 0.00 C ATOM 537 O CYS A 439 0.557 0.251 -14.098 1.00 0.00 O ATOM 538 CB CYS A 439 3.289 0.889 -15.849 1.00 0.00 C ATOM 539 SG CYS A 439 4.031 1.103 -14.204 1.00 0.00 S ATOM 0 H CYS A 439 0.439 1.096 -16.407 1.00 0.00 H new ATOM 0 HA CYS A 439 2.453 -1.043 -16.318 1.00 0.00 H new ATOM 0 HB2 CYS A 439 4.063 0.546 -16.535 1.00 0.00 H new ATOM 0 HB3 CYS A 439 2.954 1.863 -16.207 1.00 0.00 H new ATOM 544 N GLY A 440 2.214 -1.268 -13.817 1.00 0.00 N ATOM 545 CA GLY A 440 1.817 -1.624 -12.469 1.00 0.00 C ATOM 546 C GLY A 440 2.953 -2.244 -11.674 1.00 0.00 C ATOM 547 O GLY A 440 3.408 -3.345 -11.984 1.00 0.00 O ATOM 0 H GLY A 440 3.033 -1.769 -14.162 1.00 0.00 H new ATOM 0 HA2 GLY A 440 1.459 -0.734 -11.952 1.00 0.00 H new ATOM 0 HA3 GLY A 440 0.983 -2.325 -12.512 1.00 0.00 H new ATOM 551 N VAL A 441 3.403 -1.540 -10.642 1.00 0.00 N ATOM 552 CA VAL A 441 4.484 -2.020 -9.786 1.00 0.00 C ATOM 553 C VAL A 441 4.034 -2.022 -8.329 1.00 0.00 C ATOM 554 O VAL A 441 3.113 -1.293 -7.963 1.00 0.00 O ATOM 555 CB VAL A 441 5.752 -1.148 -9.936 1.00 0.00 C ATOM 556 CG1 VAL A 441 6.693 -1.324 -8.750 1.00 0.00 C ATOM 557 CG2 VAL A 441 6.467 -1.477 -11.236 1.00 0.00 C ATOM 0 H VAL A 441 3.033 -0.628 -10.375 1.00 0.00 H new ATOM 0 HA VAL A 441 4.729 -3.036 -10.096 1.00 0.00 H new ATOM 0 HB VAL A 441 5.440 -0.104 -9.959 1.00 0.00 H new ATOM 0 HG11 VAL A 441 7.574 -0.697 -8.888 1.00 0.00 H new ATOM 0 HG12 VAL A 441 6.181 -1.033 -7.833 1.00 0.00 H new ATOM 0 HG13 VAL A 441 6.998 -2.368 -8.680 1.00 0.00 H new ATOM 0 HG21 VAL A 441 7.358 -0.856 -11.329 1.00 0.00 H new ATOM 0 HG22 VAL A 441 6.756 -2.528 -11.236 1.00 0.00 H new ATOM 0 HG23 VAL A 441 5.801 -1.284 -12.077 1.00 0.00 H new ATOM 567 N ARG A 442 4.665 -2.847 -7.502 1.00 0.00 N ATOM 568 CA ARG A 442 4.293 -2.927 -6.095 1.00 0.00 C ATOM 569 C ARG A 442 5.431 -2.471 -5.183 1.00 0.00 C ATOM 570 O ARG A 442 6.603 -2.746 -5.439 1.00 0.00 O ATOM 571 CB ARG A 442 3.885 -4.359 -5.743 1.00 0.00 C ATOM 572 CG ARG A 442 2.381 -4.575 -5.710 1.00 0.00 C ATOM 573 CD ARG A 442 1.978 -5.514 -4.582 1.00 0.00 C ATOM 574 NE ARG A 442 1.054 -6.552 -5.038 1.00 0.00 N ATOM 575 CZ ARG A 442 1.333 -7.856 -5.042 1.00 0.00 C ATOM 576 NH1 ARG A 442 2.517 -8.298 -4.634 1.00 0.00 N ATOM 577 NH2 ARG A 442 0.423 -8.724 -5.464 1.00 0.00 N ATOM 0 H ARG A 442 5.429 -3.464 -7.777 1.00 0.00 H new ATOM 0 HA ARG A 442 3.449 -2.256 -5.936 1.00 0.00 H new ATOM 0 HB2 ARG A 442 4.325 -5.042 -6.470 1.00 0.00 H new ATOM 0 HB3 ARG A 442 4.302 -4.617 -4.769 1.00 0.00 H new ATOM 0 HG2 ARG A 442 1.877 -3.617 -5.585 1.00 0.00 H new ATOM 0 HG3 ARG A 442 2.050 -4.987 -6.664 1.00 0.00 H new ATOM 0 HD2 ARG A 442 2.869 -5.981 -4.163 1.00 0.00 H new ATOM 0 HD3 ARG A 442 1.512 -4.940 -3.781 1.00 0.00 H new ATOM 0 HE ARG A 442 0.137 -6.260 -5.375 1.00 0.00 H new ATOM 0 HH11 ARG A 442 3.225 -7.638 -4.313 1.00 0.00 H new ATOM 0 HH12 ARG A 442 2.718 -9.298 -4.642 1.00 0.00 H new ATOM 0 HH21 ARG A 442 -0.487 -8.393 -5.784 1.00 0.00 H new ATOM 0 HH22 ARG A 442 0.634 -9.722 -5.468 1.00 0.00 H new ATOM 591 N LYS A 443 5.060 -1.784 -4.108 1.00 0.00 N ATOM 592 CA LYS A 443 6.018 -1.288 -3.125 1.00 0.00 C ATOM 593 C LYS A 443 5.508 -1.601 -1.721 1.00 0.00 C ATOM 594 O LYS A 443 4.320 -1.448 -1.439 1.00 0.00 O ATOM 595 CB LYS A 443 6.232 0.221 -3.301 1.00 0.00 C ATOM 596 CG LYS A 443 6.968 0.884 -2.143 1.00 0.00 C ATOM 597 CD LYS A 443 7.667 2.163 -2.582 1.00 0.00 C ATOM 598 CE LYS A 443 7.046 3.393 -1.942 1.00 0.00 C ATOM 599 NZ LYS A 443 7.586 4.654 -2.524 1.00 0.00 N ATOM 0 H LYS A 443 4.089 -1.555 -3.893 1.00 0.00 H new ATOM 0 HA LYS A 443 6.978 -1.783 -3.274 1.00 0.00 H new ATOM 0 HB2 LYS A 443 6.793 0.393 -4.220 1.00 0.00 H new ATOM 0 HB3 LYS A 443 5.262 0.703 -3.425 1.00 0.00 H new ATOM 0 HG2 LYS A 443 6.262 1.110 -1.344 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.702 0.190 -1.733 1.00 0.00 H new ATOM 0 HD2 LYS A 443 8.723 2.109 -2.317 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.614 2.252 -3.667 1.00 0.00 H new ATOM 0 HE2 LYS A 443 5.965 3.365 -2.076 1.00 0.00 H new ATOM 0 HE3 LYS A 443 7.235 3.378 -0.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 7.341 5.454 -1.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 8.620 4.584 -2.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 7.174 4.806 -3.467 1.00 0.00 H new ATOM 613 N HIS A 444 6.397 -2.063 -0.850 1.00 0.00 N ATOM 614 CA HIS A 444 6.008 -2.417 0.510 1.00 0.00 C ATOM 615 C HIS A 444 6.610 -1.460 1.531 1.00 0.00 C ATOM 616 O HIS A 444 7.739 -0.996 1.378 1.00 0.00 O ATOM 617 CB HIS A 444 6.447 -3.848 0.827 1.00 0.00 C ATOM 618 CG HIS A 444 5.428 -4.886 0.466 1.00 0.00 C ATOM 619 ND1 HIS A 444 5.569 -6.218 0.790 1.00 0.00 N ATOM 620 CD2 HIS A 444 4.252 -4.785 -0.198 1.00 0.00 C ATOM 621 CE1 HIS A 444 4.525 -6.891 0.342 1.00 0.00 C ATOM 622 NE2 HIS A 444 3.711 -6.046 -0.262 1.00 0.00 N ATOM 0 H HIS A 444 7.386 -2.201 -1.059 1.00 0.00 H new ATOM 0 HA HIS A 444 4.922 -2.343 0.573 1.00 0.00 H new ATOM 0 HB2 HIS A 444 7.374 -4.061 0.294 1.00 0.00 H new ATOM 0 HB3 HIS A 444 6.668 -3.923 1.892 1.00 0.00 H new ATOM 0 HD2 HIS A 444 3.820 -3.881 -0.602 1.00 0.00 H new ATOM 0 HE1 HIS A 444 4.364 -7.953 0.451 1.00 0.00 H new ATOM 0 HE2 HIS A 444 2.825 -6.289 -0.704 1.00 0.00 H new ATOM 631 N VAL A 445 5.843 -1.180 2.581 1.00 0.00 N ATOM 632 CA VAL A 445 6.287 -0.290 3.646 1.00 0.00 C ATOM 633 C VAL A 445 6.008 -0.916 5.009 1.00 0.00 C ATOM 634 O VAL A 445 4.866 -1.244 5.326 1.00 0.00 O ATOM 635 CB VAL A 445 5.584 1.078 3.563 1.00 0.00 C ATOM 636 CG1 VAL A 445 6.182 2.050 4.568 1.00 0.00 C ATOM 637 CG2 VAL A 445 5.670 1.638 2.152 1.00 0.00 C ATOM 0 H VAL A 445 4.906 -1.560 2.716 1.00 0.00 H new ATOM 0 HA VAL A 445 7.359 -0.139 3.523 1.00 0.00 H new ATOM 0 HB VAL A 445 4.532 0.939 3.811 1.00 0.00 H new ATOM 0 HG11 VAL A 445 5.672 3.010 4.493 1.00 0.00 H new ATOM 0 HG12 VAL A 445 6.061 1.652 5.575 1.00 0.00 H new ATOM 0 HG13 VAL A 445 7.243 2.185 4.356 1.00 0.00 H new ATOM 0 HG21 VAL A 445 5.168 2.605 2.113 1.00 0.00 H new ATOM 0 HG22 VAL A 445 6.716 1.761 1.873 1.00 0.00 H new ATOM 0 HG23 VAL A 445 5.187 0.950 1.458 1.00 0.00 H new ATOM 647 N GLU A 446 7.056 -1.096 5.806 1.00 0.00 N ATOM 648 CA GLU A 446 6.911 -1.702 7.125 1.00 0.00 C ATOM 649 C GLU A 446 7.748 -0.981 8.171 1.00 0.00 C ATOM 650 O GLU A 446 8.722 -0.300 7.846 1.00 0.00 O ATOM 651 CB GLU A 446 7.321 -3.175 7.077 1.00 0.00 C ATOM 652 CG GLU A 446 6.299 -4.069 6.399 1.00 0.00 C ATOM 653 CD GLU A 446 6.864 -4.790 5.190 1.00 0.00 C ATOM 654 OE1 GLU A 446 7.638 -5.751 5.381 1.00 0.00 O ATOM 655 OE2 GLU A 446 6.533 -4.391 4.053 1.00 0.00 O ATOM 0 H GLU A 446 8.011 -0.832 5.563 1.00 0.00 H new ATOM 0 HA GLU A 446 5.862 -1.618 7.409 1.00 0.00 H new ATOM 0 HB2 GLU A 446 8.272 -3.262 6.552 1.00 0.00 H new ATOM 0 HB3 GLU A 446 7.485 -3.531 8.094 1.00 0.00 H new ATOM 0 HG2 GLU A 446 5.932 -4.803 7.116 1.00 0.00 H new ATOM 0 HG3 GLU A 446 5.443 -3.468 6.092 1.00 0.00 H new ATOM 662 N ARG A 447 7.368 -1.152 9.431 1.00 0.00 N ATOM 663 CA ARG A 447 8.081 -0.537 10.543 1.00 0.00 C ATOM 664 C ARG A 447 8.976 -1.566 11.223 1.00 0.00 C ATOM 665 O ARG A 447 8.762 -2.770 11.086 1.00 0.00 O ATOM 666 CB ARG A 447 7.091 0.043 11.553 1.00 0.00 C ATOM 667 CG ARG A 447 6.448 1.344 11.101 1.00 0.00 C ATOM 668 CD ARG A 447 5.357 1.097 10.072 1.00 0.00 C ATOM 669 NE ARG A 447 4.760 2.345 9.598 1.00 0.00 N ATOM 670 CZ ARG A 447 3.994 2.435 8.512 1.00 0.00 C ATOM 671 NH1 ARG A 447 3.721 1.353 7.793 1.00 0.00 N ATOM 672 NH2 ARG A 447 3.500 3.608 8.145 1.00 0.00 N ATOM 0 H ARG A 447 6.565 -1.715 9.709 1.00 0.00 H new ATOM 0 HA ARG A 447 8.700 0.272 10.156 1.00 0.00 H new ATOM 0 HB2 ARG A 447 6.309 -0.691 11.744 1.00 0.00 H new ATOM 0 HB3 ARG A 447 7.607 0.212 12.498 1.00 0.00 H new ATOM 0 HG2 ARG A 447 6.027 1.862 11.963 1.00 0.00 H new ATOM 0 HG3 ARG A 447 7.209 1.999 10.676 1.00 0.00 H new ATOM 0 HD2 ARG A 447 5.773 0.550 9.226 1.00 0.00 H new ATOM 0 HD3 ARG A 447 4.582 0.467 10.509 1.00 0.00 H new ATOM 0 HE ARG A 447 4.941 3.196 10.130 1.00 0.00 H new ATOM 0 HH11 ARG A 447 4.098 0.447 8.071 1.00 0.00 H new ATOM 0 HH12 ARG A 447 3.134 1.427 6.962 1.00 0.00 H new ATOM 0 HH21 ARG A 447 3.706 4.443 8.694 1.00 0.00 H new ATOM 0 HH22 ARG A 447 2.913 3.677 7.313 1.00 0.00 H new ATOM 686 N ALA A 448 9.978 -1.094 11.954 1.00 0.00 N ATOM 687 CA ALA A 448 10.895 -1.988 12.646 1.00 0.00 C ATOM 688 C ALA A 448 10.418 -2.270 14.068 1.00 0.00 C ATOM 689 O ALA A 448 10.159 -1.349 14.844 1.00 0.00 O ATOM 690 CB ALA A 448 12.297 -1.406 12.654 1.00 0.00 C ATOM 0 H ALA A 448 10.175 -0.101 12.082 1.00 0.00 H new ATOM 0 HA ALA A 448 10.917 -2.936 12.108 1.00 0.00 H new ATOM 0 HB1 ALA A 448 12.970 -2.086 13.175 1.00 0.00 H new ATOM 0 HB2 ALA A 448 12.640 -1.270 11.628 1.00 0.00 H new ATOM 0 HB3 ALA A 448 12.288 -0.443 13.164 1.00 0.00 H new ATOM 696 N ALA A 449 10.295 -3.554 14.393 1.00 0.00 N ATOM 697 CA ALA A 449 9.838 -3.983 15.715 1.00 0.00 C ATOM 698 C ALA A 449 10.486 -3.172 16.832 1.00 0.00 C ATOM 699 O ALA A 449 9.804 -2.676 17.728 1.00 0.00 O ATOM 700 CB ALA A 449 10.119 -5.465 15.912 1.00 0.00 C ATOM 0 H ALA A 449 10.507 -4.321 13.755 1.00 0.00 H new ATOM 0 HA ALA A 449 8.763 -3.809 15.763 1.00 0.00 H new ATOM 0 HB1 ALA A 449 9.775 -5.773 16.899 1.00 0.00 H new ATOM 0 HB2 ALA A 449 9.594 -6.040 15.149 1.00 0.00 H new ATOM 0 HB3 ALA A 449 11.191 -5.646 15.829 1.00 0.00 H new ATOM 706 N THR A 450 11.805 -3.039 16.772 1.00 0.00 N ATOM 707 CA THR A 450 12.540 -2.286 17.779 1.00 0.00 C ATOM 708 C THR A 450 12.599 -0.804 17.422 1.00 0.00 C ATOM 709 O THR A 450 12.703 0.053 18.301 1.00 0.00 O ATOM 710 CB THR A 450 13.975 -2.822 17.944 1.00 0.00 C ATOM 711 OG1 THR A 450 14.434 -3.384 16.708 1.00 0.00 O ATOM 712 CG2 THR A 450 14.032 -3.877 19.038 1.00 0.00 C ATOM 0 H THR A 450 12.387 -3.442 16.038 1.00 0.00 H new ATOM 0 HA THR A 450 12.005 -2.409 18.720 1.00 0.00 H new ATOM 0 HB THR A 450 14.621 -1.991 18.226 1.00 0.00 H new ATOM 0 HG1 THR A 450 15.347 -3.721 16.821 1.00 0.00 H new ATOM 0 HG21 THR A 450 15.054 -4.242 19.138 1.00 0.00 H new ATOM 0 HG22 THR A 450 13.709 -3.439 19.983 1.00 0.00 H new ATOM 0 HG23 THR A 450 13.374 -4.706 18.778 1.00 0.00 H new ATOM 720 N ASP A 451 12.536 -0.511 16.128 1.00 0.00 N ATOM 721 CA ASP A 451 12.586 0.867 15.652 1.00 0.00 C ATOM 722 C ASP A 451 11.254 1.286 15.033 1.00 0.00 C ATOM 723 O ASP A 451 11.042 1.120 13.832 1.00 0.00 O ATOM 724 CB ASP A 451 13.714 1.036 14.633 1.00 0.00 C ATOM 725 CG ASP A 451 14.530 2.293 14.872 1.00 0.00 C ATOM 726 OD1 ASP A 451 14.110 3.124 15.705 1.00 0.00 O ATOM 727 OD2 ASP A 451 15.588 2.443 14.229 1.00 0.00 O ATOM 0 H ASP A 451 12.450 -1.209 15.389 1.00 0.00 H new ATOM 0 HA ASP A 451 12.780 1.511 16.510 1.00 0.00 H new ATOM 0 HB2 ASP A 451 14.371 0.167 14.675 1.00 0.00 H new ATOM 0 HB3 ASP A 451 13.291 1.067 13.629 1.00 0.00 H new ATOM 732 N PRO A 452 10.341 1.844 15.846 1.00 0.00 N ATOM 733 CA PRO A 452 9.028 2.295 15.365 1.00 0.00 C ATOM 734 C PRO A 452 9.134 3.479 14.407 1.00 0.00 C ATOM 735 O PRO A 452 8.175 3.818 13.715 1.00 0.00 O ATOM 736 CB PRO A 452 8.296 2.709 16.644 1.00 0.00 C ATOM 737 CG PRO A 452 9.376 3.010 17.626 1.00 0.00 C ATOM 738 CD PRO A 452 10.513 2.086 17.290 1.00 0.00 C ATOM 0 HA PRO A 452 8.517 1.516 14.800 1.00 0.00 H new ATOM 0 HB2 PRO A 452 7.664 3.581 16.473 1.00 0.00 H new ATOM 0 HB3 PRO A 452 7.647 1.910 17.003 1.00 0.00 H new ATOM 0 HG2 PRO A 452 9.687 4.052 17.556 1.00 0.00 H new ATOM 0 HG3 PRO A 452 9.031 2.848 18.647 1.00 0.00 H new ATOM 0 HD2 PRO A 452 11.479 2.541 17.509 1.00 0.00 H new ATOM 0 HD3 PRO A 452 10.460 1.160 17.862 1.00 0.00 H new ATOM 746 N LYS A 453 10.308 4.106 14.374 1.00 0.00 N ATOM 747 CA LYS A 453 10.538 5.253 13.504 1.00 0.00 C ATOM 748 C LYS A 453 11.222 4.832 12.203 1.00 0.00 C ATOM 749 O LYS A 453 11.208 5.571 11.219 1.00 0.00 O ATOM 750 CB LYS A 453 11.385 6.302 14.225 1.00 0.00 C ATOM 751 CG LYS A 453 12.798 5.835 14.537 1.00 0.00 C ATOM 752 CD LYS A 453 13.636 6.958 15.123 1.00 0.00 C ATOM 753 CE LYS A 453 15.104 6.569 15.218 1.00 0.00 C ATOM 754 NZ LYS A 453 15.312 5.383 16.092 1.00 0.00 N ATOM 0 H LYS A 453 11.113 3.838 14.940 1.00 0.00 H new ATOM 0 HA LYS A 453 9.569 5.685 13.254 1.00 0.00 H new ATOM 0 HB2 LYS A 453 11.436 7.201 13.610 1.00 0.00 H new ATOM 0 HB3 LYS A 453 10.890 6.580 15.155 1.00 0.00 H new ATOM 0 HG2 LYS A 453 12.761 5.002 15.239 1.00 0.00 H new ATOM 0 HG3 LYS A 453 13.269 5.464 13.627 1.00 0.00 H new ATOM 0 HD2 LYS A 453 13.534 7.850 14.504 1.00 0.00 H new ATOM 0 HD3 LYS A 453 13.262 7.213 16.114 1.00 0.00 H new ATOM 0 HE2 LYS A 453 15.488 6.356 14.220 1.00 0.00 H new ATOM 0 HE3 LYS A 453 15.677 7.411 15.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 453 16.321 5.132 16.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 453 15.001 5.606 17.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 453 14.759 4.581 15.727 1.00 0.00 H new ATOM 768 N ALA A 454 11.816 3.642 12.202 1.00 0.00 N ATOM 769 CA ALA A 454 12.497 3.130 11.020 1.00 0.00 C ATOM 770 C ALA A 454 11.519 2.393 10.112 1.00 0.00 C ATOM 771 O ALA A 454 10.796 1.501 10.557 1.00 0.00 O ATOM 772 CB ALA A 454 13.642 2.212 11.425 1.00 0.00 C ATOM 0 H ALA A 454 11.839 3.016 13.007 1.00 0.00 H new ATOM 0 HA ALA A 454 12.907 3.975 10.466 1.00 0.00 H new ATOM 0 HB1 ALA A 454 14.141 1.837 10.532 1.00 0.00 H new ATOM 0 HB2 ALA A 454 14.356 2.767 12.034 1.00 0.00 H new ATOM 0 HB3 ALA A 454 13.250 1.373 12.000 1.00 0.00 H new ATOM 778 N VAL A 455 11.495 2.775 8.840 1.00 0.00 N ATOM 779 CA VAL A 455 10.595 2.152 7.876 1.00 0.00 C ATOM 780 C VAL A 455 11.366 1.432 6.774 1.00 0.00 C ATOM 781 O VAL A 455 12.419 1.894 6.333 1.00 0.00 O ATOM 782 CB VAL A 455 9.659 3.189 7.230 1.00 0.00 C ATOM 783 CG1 VAL A 455 8.613 2.499 6.368 1.00 0.00 C ATOM 784 CG2 VAL A 455 9.001 4.054 8.295 1.00 0.00 C ATOM 0 H VAL A 455 12.086 3.511 8.453 1.00 0.00 H new ATOM 0 HA VAL A 455 10.001 1.426 8.431 1.00 0.00 H new ATOM 0 HB VAL A 455 10.254 3.838 6.588 1.00 0.00 H new ATOM 0 HG11 VAL A 455 7.960 3.248 5.919 1.00 0.00 H new ATOM 0 HG12 VAL A 455 9.108 1.930 5.581 1.00 0.00 H new ATOM 0 HG13 VAL A 455 8.020 1.824 6.985 1.00 0.00 H new ATOM 0 HG21 VAL A 455 8.343 4.781 7.818 1.00 0.00 H new ATOM 0 HG22 VAL A 455 8.419 3.424 8.967 1.00 0.00 H new ATOM 0 HG23 VAL A 455 9.769 4.578 8.864 1.00 0.00 H new ATOM 794 N VAL A 456 10.827 0.301 6.332 1.00 0.00 N ATOM 795 CA VAL A 456 11.454 -0.485 5.275 1.00 0.00 C ATOM 796 C VAL A 456 10.714 -0.285 3.954 1.00 0.00 C ATOM 797 O VAL A 456 9.490 -0.161 3.938 1.00 0.00 O ATOM 798 CB VAL A 456 11.496 -1.994 5.635 1.00 0.00 C ATOM 799 CG1 VAL A 456 11.653 -2.186 7.138 1.00 0.00 C ATOM 800 CG2 VAL A 456 10.252 -2.722 5.135 1.00 0.00 C ATOM 0 H VAL A 456 9.957 -0.093 6.689 1.00 0.00 H new ATOM 0 HA VAL A 456 12.481 -0.135 5.169 1.00 0.00 H new ATOM 0 HB VAL A 456 12.362 -2.427 5.135 1.00 0.00 H new ATOM 0 HG11 VAL A 456 11.680 -3.251 7.368 1.00 0.00 H new ATOM 0 HG12 VAL A 456 12.581 -1.720 7.469 1.00 0.00 H new ATOM 0 HG13 VAL A 456 10.811 -1.725 7.654 1.00 0.00 H new ATOM 0 HG21 VAL A 456 10.315 -3.776 5.404 1.00 0.00 H new ATOM 0 HG22 VAL A 456 9.365 -2.283 5.592 1.00 0.00 H new ATOM 0 HG23 VAL A 456 10.186 -2.628 4.051 1.00 0.00 H new ATOM 810 N THR A 457 11.454 -0.244 2.851 1.00 0.00 N ATOM 811 CA THR A 457 10.842 -0.051 1.541 1.00 0.00 C ATOM 812 C THR A 457 11.367 -1.051 0.517 1.00 0.00 C ATOM 813 O THR A 457 12.559 -1.075 0.210 1.00 0.00 O ATOM 814 CB THR A 457 11.076 1.376 1.014 1.00 0.00 C ATOM 815 OG1 THR A 457 11.342 2.266 2.105 1.00 0.00 O ATOM 816 CG2 THR A 457 9.862 1.868 0.239 1.00 0.00 C ATOM 0 H THR A 457 12.469 -0.341 2.837 1.00 0.00 H new ATOM 0 HA THR A 457 9.773 -0.213 1.676 1.00 0.00 H new ATOM 0 HB THR A 457 11.936 1.357 0.345 1.00 0.00 H new ATOM 0 HG1 THR A 457 11.491 3.171 1.760 1.00 0.00 H new ATOM 0 HG21 THR A 457 10.048 2.879 -0.125 1.00 0.00 H new ATOM 0 HG22 THR A 457 9.677 1.206 -0.607 1.00 0.00 H new ATOM 0 HG23 THR A 457 8.990 1.873 0.893 1.00 0.00 H new ATOM 824 N THR A 458 10.465 -1.871 -0.014 1.00 0.00 N ATOM 825 CA THR A 458 10.829 -2.869 -1.011 1.00 0.00 C ATOM 826 C THR A 458 10.102 -2.610 -2.326 1.00 0.00 C ATOM 827 O THR A 458 8.888 -2.410 -2.343 1.00 0.00 O ATOM 828 CB THR A 458 10.498 -4.291 -0.527 1.00 0.00 C ATOM 829 OG1 THR A 458 10.755 -4.406 0.878 1.00 0.00 O ATOM 830 CG2 THR A 458 11.320 -5.324 -1.282 1.00 0.00 C ATOM 0 H THR A 458 9.475 -1.863 0.231 1.00 0.00 H new ATOM 0 HA THR A 458 11.905 -2.789 -1.167 1.00 0.00 H new ATOM 0 HB THR A 458 9.441 -4.477 -0.718 1.00 0.00 H new ATOM 0 HG1 THR A 458 10.540 -5.314 1.177 1.00 0.00 H new ATOM 0 HG21 THR A 458 11.069 -6.322 -0.923 1.00 0.00 H new ATOM 0 HG22 THR A 458 11.100 -5.256 -2.347 1.00 0.00 H new ATOM 0 HG23 THR A 458 12.381 -5.136 -1.118 1.00 0.00 H new ATOM 838 N TYR A 459 10.849 -2.612 -3.426 1.00 0.00 N ATOM 839 CA TYR A 459 10.266 -2.372 -4.744 1.00 0.00 C ATOM 840 C TYR A 459 10.117 -3.674 -5.524 1.00 0.00 C ATOM 841 O TYR A 459 11.104 -4.339 -5.837 1.00 0.00 O ATOM 842 CB TYR A 459 11.130 -1.390 -5.535 1.00 0.00 C ATOM 843 CG TYR A 459 11.000 0.043 -5.073 1.00 0.00 C ATOM 844 CD1 TYR A 459 9.857 0.783 -5.350 1.00 0.00 C ATOM 845 CD2 TYR A 459 12.023 0.657 -4.360 1.00 0.00 C ATOM 846 CE1 TYR A 459 9.739 2.094 -4.930 1.00 0.00 C ATOM 847 CE2 TYR A 459 11.912 1.967 -3.937 1.00 0.00 C ATOM 848 CZ TYR A 459 10.767 2.681 -4.224 1.00 0.00 C ATOM 849 OH TYR A 459 10.652 3.987 -3.805 1.00 0.00 O ATOM 0 H TYR A 459 11.856 -2.776 -3.432 1.00 0.00 H new ATOM 0 HA TYR A 459 9.275 -1.942 -4.599 1.00 0.00 H new ATOM 0 HB2 TYR A 459 12.174 -1.694 -5.457 1.00 0.00 H new ATOM 0 HB3 TYR A 459 10.859 -1.449 -6.589 1.00 0.00 H new ATOM 0 HD1 TYR A 459 9.049 0.327 -5.902 1.00 0.00 H new ATOM 0 HD2 TYR A 459 12.920 0.100 -4.133 1.00 0.00 H new ATOM 0 HE1 TYR A 459 8.845 2.657 -5.154 1.00 0.00 H new ATOM 0 HE2 TYR A 459 12.717 2.430 -3.385 1.00 0.00 H new ATOM 0 HH TYR A 459 9.986 4.450 -4.355 1.00 0.00 H new ATOM 859 N GLU A 460 8.875 -4.031 -5.837 1.00 0.00 N ATOM 860 CA GLU A 460 8.594 -5.253 -6.584 1.00 0.00 C ATOM 861 C GLU A 460 8.019 -4.933 -7.962 1.00 0.00 C ATOM 862 O GLU A 460 6.869 -4.510 -8.080 1.00 0.00 O ATOM 863 CB GLU A 460 7.615 -6.136 -5.807 1.00 0.00 C ATOM 864 CG GLU A 460 8.034 -6.390 -4.367 1.00 0.00 C ATOM 865 CD GLU A 460 6.852 -6.606 -3.443 1.00 0.00 C ATOM 866 OE1 GLU A 460 5.728 -6.807 -3.950 1.00 0.00 O ATOM 867 OE2 GLU A 460 7.048 -6.573 -2.209 1.00 0.00 O ATOM 0 H GLU A 460 8.047 -3.491 -5.585 1.00 0.00 H new ATOM 0 HA GLU A 460 9.534 -5.789 -6.718 1.00 0.00 H new ATOM 0 HB2 GLU A 460 6.632 -5.666 -5.813 1.00 0.00 H new ATOM 0 HB3 GLU A 460 7.514 -7.092 -6.321 1.00 0.00 H new ATOM 0 HG2 GLU A 460 8.683 -7.265 -4.331 1.00 0.00 H new ATOM 0 HG3 GLU A 460 8.620 -5.544 -4.009 1.00 0.00 H new ATOM 874 N GLY A 461 8.824 -5.142 -9.000 1.00 0.00 N ATOM 875 CA GLY A 461 8.374 -4.877 -10.355 1.00 0.00 C ATOM 876 C GLY A 461 8.898 -3.563 -10.904 1.00 0.00 C ATOM 877 O GLY A 461 9.168 -2.628 -10.150 1.00 0.00 O ATOM 0 H GLY A 461 9.780 -5.490 -8.927 1.00 0.00 H new ATOM 0 HA2 GLY A 461 8.695 -5.691 -11.005 1.00 0.00 H new ATOM 0 HA3 GLY A 461 7.284 -4.865 -10.375 1.00 0.00 H new ATOM 881 N LYS A 462 9.043 -3.499 -12.223 1.00 0.00 N ATOM 882 CA LYS A 462 9.536 -2.297 -12.885 1.00 0.00 C ATOM 883 C LYS A 462 8.402 -1.566 -13.599 1.00 0.00 C ATOM 884 O LYS A 462 7.319 -2.118 -13.791 1.00 0.00 O ATOM 885 CB LYS A 462 10.644 -2.658 -13.879 1.00 0.00 C ATOM 886 CG LYS A 462 12.013 -2.137 -13.473 1.00 0.00 C ATOM 887 CD LYS A 462 12.640 -3.000 -12.389 1.00 0.00 C ATOM 888 CE LYS A 462 13.324 -2.152 -11.328 1.00 0.00 C ATOM 889 NZ LYS A 462 13.944 -2.987 -10.262 1.00 0.00 N ATOM 0 H LYS A 462 8.825 -4.268 -12.857 1.00 0.00 H new ATOM 0 HA LYS A 462 9.946 -1.631 -12.126 1.00 0.00 H new ATOM 0 HB2 LYS A 462 10.692 -3.742 -13.981 1.00 0.00 H new ATOM 0 HB3 LYS A 462 10.387 -2.257 -14.859 1.00 0.00 H new ATOM 0 HG2 LYS A 462 12.667 -2.113 -14.344 1.00 0.00 H new ATOM 0 HG3 LYS A 462 11.922 -1.111 -13.115 1.00 0.00 H new ATOM 0 HD2 LYS A 462 11.871 -3.617 -11.923 1.00 0.00 H new ATOM 0 HD3 LYS A 462 13.365 -3.679 -12.837 1.00 0.00 H new ATOM 0 HE2 LYS A 462 14.090 -1.534 -11.796 1.00 0.00 H new ATOM 0 HE3 LYS A 462 12.597 -1.474 -10.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 14.399 -2.371 -9.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 13.210 -3.558 -9.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 14.657 -3.616 -10.684 1.00 0.00 H new ATOM 903 N HIS A 463 8.655 -0.318 -13.983 1.00 0.00 N ATOM 904 CA HIS A 463 7.651 0.492 -14.668 1.00 0.00 C ATOM 905 C HIS A 463 7.953 0.599 -16.158 1.00 0.00 C ATOM 906 O HIS A 463 9.104 0.776 -16.559 1.00 0.00 O ATOM 907 CB HIS A 463 7.587 1.894 -14.056 1.00 0.00 C ATOM 908 CG HIS A 463 7.741 1.906 -12.567 1.00 0.00 C ATOM 909 ND1 HIS A 463 6.712 2.230 -11.705 1.00 0.00 N ATOM 910 CD2 HIS A 463 8.810 1.627 -11.785 1.00 0.00 C ATOM 911 CE1 HIS A 463 7.144 2.148 -10.458 1.00 0.00 C ATOM 912 NE2 HIS A 463 8.412 1.785 -10.481 1.00 0.00 N ATOM 0 H HIS A 463 9.546 0.155 -13.832 1.00 0.00 H new ATOM 0 HA HIS A 463 6.687 -0.001 -14.543 1.00 0.00 H new ATOM 0 HB2 HIS A 463 8.369 2.511 -14.499 1.00 0.00 H new ATOM 0 HB3 HIS A 463 6.633 2.352 -14.318 1.00 0.00 H new ATOM 0 HD2 HIS A 463 9.793 1.335 -12.124 1.00 0.00 H new ATOM 0 HE1 HIS A 463 6.559 2.345 -9.572 1.00 0.00 H new ATOM 0 HE2 HIS A 463 9.002 1.644 -9.661 1.00 0.00 H new ATOM 920 N ASN A 464 6.909 0.493 -16.975 1.00 0.00 N ATOM 921 CA ASN A 464 7.058 0.580 -18.422 1.00 0.00 C ATOM 922 C ASN A 464 6.837 2.009 -18.914 1.00 0.00 C ATOM 923 O ASN A 464 6.479 2.225 -20.073 1.00 0.00 O ATOM 924 CB ASN A 464 6.075 -0.369 -19.114 1.00 0.00 C ATOM 925 CG ASN A 464 6.773 -1.523 -19.808 1.00 0.00 C ATOM 926 OD1 ASN A 464 7.878 -1.373 -20.329 1.00 0.00 O ATOM 927 ND2 ASN A 464 6.127 -2.684 -19.819 1.00 0.00 N ATOM 0 H ASN A 464 5.951 0.347 -16.658 1.00 0.00 H new ATOM 0 HA ASN A 464 8.077 0.286 -18.673 1.00 0.00 H new ATOM 0 HB2 ASN A 464 5.375 -0.762 -18.377 1.00 0.00 H new ATOM 0 HB3 ASN A 464 5.489 0.189 -19.844 1.00 0.00 H new ATOM 0 HD21 ASN A 464 6.546 -3.496 -20.272 1.00 0.00 H new ATOM 0 HD22 ASN A 464 5.212 -2.763 -19.374 1.00 0.00 H new ATOM 934 N HIS A 465 7.055 2.984 -18.034 1.00 0.00 N ATOM 935 CA HIS A 465 6.885 4.390 -18.386 1.00 0.00 C ATOM 936 C HIS A 465 7.972 5.226 -17.726 1.00 0.00 C ATOM 937 O HIS A 465 7.688 6.194 -17.023 1.00 0.00 O ATOM 938 CB HIS A 465 5.507 4.884 -17.950 1.00 0.00 C ATOM 939 CG HIS A 465 5.300 4.865 -16.467 1.00 0.00 C ATOM 940 ND1 HIS A 465 5.497 5.968 -15.662 1.00 0.00 N ATOM 941 CD2 HIS A 465 4.906 3.868 -15.643 1.00 0.00 C ATOM 942 CE1 HIS A 465 5.235 5.647 -14.407 1.00 0.00 C ATOM 943 NE2 HIS A 465 4.874 4.377 -14.367 1.00 0.00 N ATOM 0 H HIS A 465 7.350 2.825 -17.071 1.00 0.00 H new ATOM 0 HA HIS A 465 6.965 4.492 -19.468 1.00 0.00 H new ATOM 0 HB2 HIS A 465 5.364 5.901 -18.315 1.00 0.00 H new ATOM 0 HB3 HIS A 465 4.743 4.266 -18.422 1.00 0.00 H new ATOM 0 HD1 HIS A 465 5.798 6.888 -15.985 1.00 0.00 H new ATOM 0 HD2 HIS A 465 4.661 2.857 -15.934 1.00 0.00 H new ATOM 0 HE1 HIS A 465 5.304 6.311 -13.558 1.00 0.00 H new ATOM 951 N ASP A 466 9.218 4.841 -17.996 1.00 0.00 N ATOM 952 CA ASP A 466 10.407 5.525 -17.470 1.00 0.00 C ATOM 953 C ASP A 466 10.136 6.240 -16.138 1.00 0.00 C ATOM 954 O ASP A 466 9.196 5.908 -15.418 1.00 0.00 O ATOM 955 CB ASP A 466 10.925 6.526 -18.506 1.00 0.00 C ATOM 956 CG ASP A 466 12.435 6.505 -18.631 1.00 0.00 C ATOM 957 OD1 ASP A 466 12.957 5.643 -19.369 1.00 0.00 O ATOM 958 OD2 ASP A 466 13.097 7.347 -17.988 1.00 0.00 O ATOM 0 H ASP A 466 9.437 4.041 -18.589 1.00 0.00 H new ATOM 0 HA ASP A 466 11.162 4.763 -17.275 1.00 0.00 H new ATOM 0 HB2 ASP A 466 10.481 6.303 -19.476 1.00 0.00 H new ATOM 0 HB3 ASP A 466 10.601 7.529 -18.230 1.00 0.00 H new ATOM 963 N LEU A 467 10.980 7.215 -15.813 1.00 0.00 N ATOM 964 CA LEU A 467 10.834 7.975 -14.574 1.00 0.00 C ATOM 965 C LEU A 467 10.061 9.268 -14.830 1.00 0.00 C ATOM 966 O LEU A 467 10.576 10.192 -15.461 1.00 0.00 O ATOM 967 CB LEU A 467 12.208 8.297 -13.980 1.00 0.00 C ATOM 968 CG LEU A 467 12.439 7.776 -12.560 1.00 0.00 C ATOM 969 CD1 LEU A 467 11.313 8.219 -11.638 1.00 0.00 C ATOM 970 CD2 LEU A 467 12.567 6.261 -12.565 1.00 0.00 C ATOM 0 H LEU A 467 11.772 7.498 -16.390 1.00 0.00 H new ATOM 0 HA LEU A 467 10.276 7.367 -13.862 1.00 0.00 H new ATOM 0 HB2 LEU A 467 12.975 7.881 -14.633 1.00 0.00 H new ATOM 0 HB3 LEU A 467 12.342 9.379 -13.980 1.00 0.00 H new ATOM 0 HG LEU A 467 13.371 8.197 -12.184 1.00 0.00 H new ATOM 0 HD11 LEU A 467 11.495 7.839 -10.633 1.00 0.00 H new ATOM 0 HD12 LEU A 467 11.271 9.308 -11.612 1.00 0.00 H new ATOM 0 HD13 LEU A 467 10.365 7.828 -12.008 1.00 0.00 H new ATOM 0 HD21 LEU A 467 12.731 5.906 -11.547 1.00 0.00 H new ATOM 0 HD22 LEU A 467 11.652 5.820 -12.960 1.00 0.00 H new ATOM 0 HD23 LEU A 467 13.410 5.969 -13.191 1.00 0.00 H new ATOM 982 N PRO A 468 8.807 9.356 -14.348 1.00 0.00 N ATOM 983 CA PRO A 468 7.970 10.545 -14.538 1.00 0.00 C ATOM 984 C PRO A 468 8.576 11.790 -13.898 1.00 0.00 C ATOM 985 O PRO A 468 8.239 12.147 -12.769 1.00 0.00 O ATOM 986 CB PRO A 468 6.647 10.180 -13.848 1.00 0.00 C ATOM 987 CG PRO A 468 6.665 8.694 -13.723 1.00 0.00 C ATOM 988 CD PRO A 468 8.110 8.307 -13.588 1.00 0.00 C ATOM 0 HA PRO A 468 7.857 10.791 -15.594 1.00 0.00 H new ATOM 0 HB2 PRO A 468 6.569 10.656 -12.871 1.00 0.00 H new ATOM 0 HB3 PRO A 468 5.792 10.515 -14.435 1.00 0.00 H new ATOM 0 HG2 PRO A 468 6.091 8.369 -12.855 1.00 0.00 H new ATOM 0 HG3 PRO A 468 6.215 8.223 -14.597 1.00 0.00 H new ATOM 0 HD2 PRO A 468 8.426 8.287 -12.545 1.00 0.00 H new ATOM 0 HD3 PRO A 468 8.302 7.316 -13.999 1.00 0.00 H new ATOM 996 N ALA A 469 9.474 12.446 -14.625 1.00 0.00 N ATOM 997 CA ALA A 469 10.126 13.650 -14.124 1.00 0.00 C ATOM 998 C ALA A 469 9.247 14.878 -14.330 1.00 0.00 C ATOM 999 O ALA A 469 8.854 15.138 -15.488 1.00 0.00 O ATOM 1000 CB ALA A 469 11.473 13.844 -14.804 1.00 0.00 C ATOM 1001 OXT ALA A 469 8.956 15.571 -13.333 1.00 0.00 O ATOM 0 H ALA A 469 9.766 12.165 -15.561 1.00 0.00 H new ATOM 0 HA ALA A 469 10.286 13.526 -13.053 1.00 0.00 H new ATOM 0 HB1 ALA A 469 11.948 14.747 -14.420 1.00 0.00 H new ATOM 0 HB2 ALA A 469 12.111 12.984 -14.600 1.00 0.00 H new ATOM 0 HB3 ALA A 469 11.327 13.941 -15.880 1.00 0.00 H new TER 1007 ALA A 469 ATOM 1008 O5' DC B 3 -6.889 14.938 -10.592 1.00 0.00 O ATOM 1009 C5' DC B 3 -6.410 13.599 -10.385 1.00 0.00 C ATOM 1010 C4' DC B 3 -5.655 13.488 -9.081 1.00 0.00 C ATOM 1011 O4' DC B 3 -6.409 14.165 -8.045 1.00 0.00 O ATOM 1012 C3' DC B 3 -5.447 12.059 -8.580 1.00 0.00 C ATOM 1013 O3' DC B 3 -4.182 11.944 -7.923 1.00 0.00 O ATOM 1014 C2' DC B 3 -6.584 11.866 -7.591 1.00 0.00 C ATOM 1015 C1' DC B 3 -6.743 13.258 -7.007 1.00 0.00 C ATOM 1016 N1 DC B 3 -8.100 13.582 -6.543 1.00 0.00 N ATOM 1017 C2 DC B 3 -8.250 14.326 -5.371 1.00 0.00 C ATOM 1018 O2 DC B 3 -7.234 14.690 -4.760 1.00 0.00 O ATOM 1019 N3 DC B 3 -9.493 14.629 -4.933 1.00 0.00 N ATOM 1020 C4 DC B 3 -10.561 14.219 -5.622 1.00 0.00 C ATOM 1021 N4 DC B 3 -11.769 14.542 -5.153 1.00 0.00 N ATOM 1022 C5 DC B 3 -10.438 13.459 -6.822 1.00 0.00 C ATOM 1023 C6 DC B 3 -9.201 13.167 -7.242 1.00 0.00 C ATOM 0 H5' DC B 3 -5.760 13.310 -11.211 1.00 0.00 H new ATOM 0 H5'' DC B 3 -7.250 12.905 -10.383 1.00 0.00 H new ATOM 0 H4' DC B 3 -4.676 13.925 -9.280 1.00 0.00 H new ATOM 0 H3' DC B 3 -5.447 11.317 -9.378 1.00 0.00 H new ATOM 0 H2' DC B 3 -7.496 11.524 -8.081 1.00 0.00 H new ATOM 0 H2'' DC B 3 -6.337 11.130 -6.826 1.00 0.00 H new ATOM 0 HO5' DC B 3 -6.944 15.402 -9.731 1.00 0.00 H new ATOM 0 H1' DC B 3 -6.103 13.321 -6.127 1.00 0.00 H new ATOM 0 H41 DC B 3 -12.607 14.245 -5.654 1.00 0.00 H new ATOM 0 H42 DC B 3 -11.854 15.085 -4.294 1.00 0.00 H new ATOM 0 H5 DC B 3 -11.309 13.132 -7.371 1.00 0.00 H new ATOM 0 H6 DC B 3 -9.070 12.594 -8.148 1.00 0.00 H new ATOM 1035 P DC B 4 -3.390 10.547 -7.958 1.00 0.00 P ATOM 1036 OP1 DC B 4 -1.964 10.849 -8.244 1.00 0.00 O ATOM 1037 OP2 DC B 4 -4.133 9.611 -8.842 1.00 0.00 O ATOM 1038 O5' DC B 4 -3.492 10.010 -6.462 1.00 0.00 O ATOM 1039 C5' DC B 4 -2.616 10.499 -5.448 1.00 0.00 C ATOM 1040 C4' DC B 4 -3.304 10.464 -4.103 1.00 0.00 C ATOM 1041 O4' DC B 4 -4.632 11.004 -4.244 1.00 0.00 O ATOM 1042 C3' DC B 4 -3.498 9.068 -3.512 1.00 0.00 C ATOM 1043 O3' DC B 4 -2.467 8.793 -2.559 1.00 0.00 O ATOM 1044 C2' DC B 4 -4.856 9.134 -2.825 1.00 0.00 C ATOM 1045 C1' DC B 4 -5.429 10.501 -3.191 1.00 0.00 C ATOM 1046 N1 DC B 4 -6.824 10.475 -3.657 1.00 0.00 N ATOM 1047 C2 DC B 4 -7.812 11.051 -2.854 1.00 0.00 C ATOM 1048 O2 DC B 4 -7.483 11.559 -1.772 1.00 0.00 O ATOM 1049 N3 DC B 4 -9.096 11.039 -3.276 1.00 0.00 N ATOM 1050 C4 DC B 4 -9.407 10.480 -4.448 1.00 0.00 C ATOM 1051 N4 DC B 4 -10.689 10.493 -4.826 1.00 0.00 N ATOM 1052 C5 DC B 4 -8.421 9.882 -5.285 1.00 0.00 C ATOM 1053 C6 DC B 4 -7.153 9.902 -4.854 1.00 0.00 C ATOM 0 H5' DC B 4 -2.310 11.519 -5.682 1.00 0.00 H new ATOM 0 H5'' DC B 4 -1.710 9.894 -5.417 1.00 0.00 H new ATOM 0 H4' DC B 4 -2.650 11.032 -3.441 1.00 0.00 H new ATOM 0 H3' DC B 4 -3.453 8.281 -4.264 1.00 0.00 H new ATOM 0 H2' DC B 4 -5.508 8.330 -3.166 1.00 0.00 H new ATOM 0 H2'' DC B 4 -4.756 9.026 -1.745 1.00 0.00 H new ATOM 0 H1' DC B 4 -5.419 11.112 -2.289 1.00 0.00 H new ATOM 0 H41 DC B 4 -10.963 10.075 -5.715 1.00 0.00 H new ATOM 0 H42 DC B 4 -11.393 10.921 -4.225 1.00 0.00 H new ATOM 0 H5 DC B 4 -8.686 9.430 -6.230 1.00 0.00 H new ATOM 0 H6 DC B 4 -6.378 9.458 -5.462 1.00 0.00 H new ATOM 1065 P DT B 5 -2.690 7.649 -1.451 1.00 0.00 P ATOM 1066 OP1 DT B 5 -1.385 7.425 -0.779 1.00 0.00 O ATOM 1067 OP2 DT B 5 -3.392 6.508 -2.091 1.00 0.00 O ATOM 1068 O5' DT B 5 -3.680 8.321 -0.398 1.00 0.00 O ATOM 1069 C5' DT B 5 -3.286 9.478 0.342 1.00 0.00 C ATOM 1070 C4' DT B 5 -4.377 9.870 1.312 1.00 0.00 C ATOM 1071 O4' DT B 5 -5.650 9.855 0.619 1.00 0.00 O ATOM 1072 C3' DT B 5 -4.543 8.929 2.504 1.00 0.00 C ATOM 1073 O3' DT B 5 -4.935 9.665 3.667 1.00 0.00 O ATOM 1074 C2' DT B 5 -5.655 7.997 2.059 1.00 0.00 C ATOM 1075 C1' DT B 5 -6.525 8.910 1.217 1.00 0.00 C ATOM 1076 N1 DT B 5 -7.263 8.230 0.138 1.00 0.00 N ATOM 1077 C2 DT B 5 -8.633 8.357 0.108 1.00 0.00 C ATOM 1078 O2 DT B 5 -9.261 9.002 0.931 1.00 0.00 O ATOM 1079 N3 DT B 5 -9.245 7.698 -0.927 1.00 0.00 N ATOM 1080 C4 DT B 5 -8.637 6.948 -1.912 1.00 0.00 C ATOM 1081 O4 DT B 5 -9.319 6.420 -2.787 1.00 0.00 O ATOM 1082 C5 DT B 5 -7.198 6.854 -1.817 1.00 0.00 C ATOM 1083 C7 DT B 5 -6.457 6.050 -2.838 1.00 0.59 C ATOM 1084 C6 DT B 5 -6.585 7.491 -0.809 1.00 0.00 C ATOM 0 H5' DT B 5 -3.081 10.303 -0.340 1.00 0.00 H new ATOM 0 H5'' DT B 5 -2.362 9.276 0.884 1.00 0.00 H new ATOM 0 H4' DT B 5 -4.084 10.850 1.688 1.00 0.00 H new ATOM 0 H3' DT B 5 -3.627 8.402 2.770 1.00 0.00 H new ATOM 0 H2' DT B 5 -5.273 7.154 1.483 1.00 0.00 H new ATOM 0 H2'' DT B 5 -6.201 7.582 2.906 1.00 0.00 H new ATOM 0 H1' DT B 5 -7.280 9.346 1.872 1.00 0.00 H new ATOM 0 H3 DT B 5 -10.261 7.770 -0.974 1.00 0.00 H new ATOM 0 H71 DT B 5 -7.092 5.239 -3.193 1.00 0.59 H new ATOM 0 H72 DT B 5 -6.183 6.690 -3.677 1.00 0.59 H new ATOM 0 H73 DT B 5 -5.555 5.634 -2.389 1.00 0.59 H new ATOM 0 H6 DT B 5 -5.510 7.422 -0.735 1.00 0.00 H new ATOM 1097 P DT B 6 -4.198 9.392 5.068 1.00 0.00 P ATOM 1098 OP1 DT B 6 -4.263 10.647 5.858 1.00 0.00 O ATOM 1099 OP2 DT B 6 -2.880 8.770 4.787 1.00 0.00 O ATOM 1100 O5' DT B 6 -5.122 8.309 5.784 1.00 0.00 O ATOM 1101 C5' DT B 6 -6.543 8.391 5.698 1.00 0.00 C ATOM 1102 C4' DT B 6 -7.166 7.080 6.120 1.00 0.00 C ATOM 1103 O4' DT B 6 -8.334 6.829 5.310 1.00 0.00 O ATOM 1104 C3' DT B 6 -6.280 5.855 5.931 1.00 0.00 C ATOM 1105 O3' DT B 6 -5.491 5.627 7.102 1.00 0.00 O ATOM 1106 C2' DT B 6 -7.285 4.736 5.728 1.00 0.00 C ATOM 1107 C1' DT B 6 -8.481 5.432 5.082 1.00 0.00 C ATOM 1108 N1 DT B 6 -8.589 5.221 3.627 1.00 0.00 N ATOM 1109 C2 DT B 6 -9.841 5.261 3.056 1.00 0.00 C ATOM 1110 O2 DT B 6 -10.858 5.464 3.696 1.00 0.00 O ATOM 1111 N3 DT B 6 -9.858 5.049 1.701 1.00 0.00 N ATOM 1112 C4 DT B 6 -8.774 4.810 0.882 1.00 0.00 C ATOM 1113 O4 DT B 6 -8.944 4.630 -0.320 1.00 0.00 O ATOM 1114 C5 DT B 6 -7.491 4.784 1.547 1.00 0.00 C ATOM 1115 C7 DT B 6 -6.260 4.534 0.735 1.00 0.59 C ATOM 1116 C6 DT B 6 -7.459 4.988 2.872 1.00 0.00 C ATOM 0 H5' DT B 6 -6.840 8.632 4.677 1.00 0.00 H new ATOM 0 H5'' DT B 6 -6.908 9.197 6.334 1.00 0.00 H new ATOM 0 H4' DT B 6 -7.369 7.202 7.184 1.00 0.00 H new ATOM 0 H3' DT B 6 -5.574 5.950 5.106 1.00 0.00 H new ATOM 0 H2' DT B 6 -6.885 3.951 5.087 1.00 0.00 H new ATOM 0 H2'' DT B 6 -7.558 4.267 6.673 1.00 0.00 H new ATOM 0 H1' DT B 6 -9.381 5.009 5.529 1.00 0.00 H new ATOM 0 H3 DT B 6 -10.772 5.070 1.249 1.00 0.00 H new ATOM 0 H71 DT B 6 -5.412 5.042 1.194 1.00 0.59 H new ATOM 0 H72 DT B 6 -6.062 3.463 0.694 1.00 0.59 H new ATOM 0 H73 DT B 6 -6.407 4.914 -0.276 1.00 0.59 H new ATOM 0 H6 DT B 6 -6.502 4.969 3.372 1.00 0.00 H new ATOM 1129 P DT B 7 -4.837 4.180 7.351 1.00 0.00 P ATOM 1130 OP1 DT B 7 -4.051 4.261 8.610 1.00 0.00 O ATOM 1131 OP2 DT B 7 -4.169 3.748 6.098 1.00 0.00 O ATOM 1132 O5' DT B 7 -6.091 3.230 7.605 1.00 0.00 O ATOM 1133 C5' DT B 7 -6.603 3.027 8.921 1.00 0.00 C ATOM 1134 C4' DT B 7 -7.959 2.363 8.857 1.00 0.00 C ATOM 1135 O4' DT B 7 -8.487 2.503 7.515 1.00 0.00 O ATOM 1136 C3' DT B 7 -7.953 0.863 9.146 1.00 0.00 C ATOM 1137 O3' DT B 7 -9.165 0.478 9.803 1.00 0.00 O ATOM 1138 C2' DT B 7 -7.874 0.244 7.763 1.00 0.00 C ATOM 1139 C1' DT B 7 -8.673 1.224 6.924 1.00 0.00 C ATOM 1140 N1 DT B 7 -8.248 1.310 5.515 1.00 0.00 N ATOM 1141 C2 DT B 7 -9.212 1.202 4.540 1.00 0.00 C ATOM 1142 O2 DT B 7 -10.396 1.046 4.789 1.00 0.00 O ATOM 1143 N3 DT B 7 -8.739 1.285 3.256 1.00 0.00 N ATOM 1144 C4 DT B 7 -7.429 1.471 2.861 1.00 0.00 C ATOM 1145 O4 DT B 7 -7.153 1.533 1.668 1.00 0.00 O ATOM 1146 C5 DT B 7 -6.471 1.577 3.938 1.00 0.00 C ATOM 1147 C7 DT B 7 -5.026 1.771 3.602 1.00 0.59 C ATOM 1148 C6 DT B 7 -6.918 1.492 5.198 1.00 0.00 C ATOM 0 H5' DT B 7 -6.682 3.982 9.440 1.00 0.00 H new ATOM 0 H5'' DT B 7 -5.914 2.408 9.496 1.00 0.00 H new ATOM 0 H4' DT B 7 -8.553 2.857 9.626 1.00 0.00 H new ATOM 0 H3' DT B 7 -7.139 0.552 9.800 1.00 0.00 H new ATOM 0 H2' DT B 7 -6.845 0.156 7.415 1.00 0.00 H new ATOM 0 H2'' DT B 7 -8.305 -0.757 7.740 1.00 0.00 H new ATOM 0 H1' DT B 7 -9.708 0.882 6.910 1.00 0.00 H new ATOM 0 H3 DT B 7 -9.430 1.200 2.511 1.00 0.00 H new ATOM 0 H71 DT B 7 -4.541 2.339 4.396 1.00 0.59 H new ATOM 0 H72 DT B 7 -4.542 0.799 3.502 1.00 0.59 H new ATOM 0 H73 DT B 7 -4.941 2.317 2.662 1.00 0.59 H new ATOM 0 H6 DT B 7 -6.203 1.570 6.004 1.00 0.00 H new ATOM 1161 P DG B 8 -9.248 -0.943 10.548 1.00 0.00 P ATOM 1162 OP1 DG B 8 -9.749 -0.694 11.924 1.00 0.00 O ATOM 1163 OP2 DG B 8 -7.956 -1.647 10.354 1.00 0.00 O ATOM 1164 O5' DG B 8 -10.376 -1.733 9.746 1.00 0.00 O ATOM 1165 C5' DG B 8 -11.745 -1.654 10.139 1.00 0.00 C ATOM 1166 C4' DG B 8 -12.578 -2.612 9.320 1.00 0.00 C ATOM 1167 O4' DG B 8 -12.227 -2.463 7.921 1.00 0.00 O ATOM 1168 C3' DG B 8 -12.360 -4.089 9.642 1.00 0.00 C ATOM 1169 O3' DG B 8 -13.567 -4.828 9.426 1.00 0.00 O ATOM 1170 C2' DG B 8 -11.291 -4.500 8.646 1.00 0.00 C ATOM 1171 C1' DG B 8 -11.645 -3.662 7.431 1.00 0.00 C ATOM 1172 N9 DG B 8 -10.500 -3.299 6.602 1.00 0.00 N ATOM 1173 C8 DG B 8 -9.236 -2.983 7.033 1.00 0.00 C ATOM 1174 N7 DG B 8 -8.418 -2.694 6.060 1.00 0.00 N ATOM 1175 C5 DG B 8 -9.187 -2.829 4.913 1.00 0.00 C ATOM 1176 C6 DG B 8 -8.846 -2.645 3.548 1.00 0.00 C ATOM 1177 O6 DG B 8 -7.757 -2.315 3.065 1.00 0.00 O ATOM 1178 N1 DG B 8 -9.930 -2.888 2.711 1.00 0.00 N ATOM 1179 C2 DG B 8 -11.183 -3.260 3.132 1.00 0.00 C ATOM 1180 N2 DG B 8 -12.098 -3.449 2.171 1.00 0.00 N ATOM 1181 N3 DG B 8 -11.516 -3.434 4.401 1.00 0.00 N ATOM 1182 C4 DG B 8 -10.477 -3.203 5.231 1.00 0.00 C ATOM 0 H5' DG B 8 -12.111 -0.636 10.005 1.00 0.00 H new ATOM 0 H5'' DG B 8 -11.841 -1.891 11.199 1.00 0.00 H new ATOM 0 H4' DG B 8 -13.612 -2.358 9.554 1.00 0.00 H new ATOM 0 H3' DG B 8 -12.074 -4.272 10.678 1.00 0.00 H new ATOM 0 H2' DG B 8 -10.288 -4.282 9.012 1.00 0.00 H new ATOM 0 H2'' DG B 8 -11.326 -5.568 8.428 1.00 0.00 H new ATOM 0 H1' DG B 8 -12.309 -4.253 6.800 1.00 0.00 H new ATOM 0 H8 DG B 8 -8.948 -2.975 8.074 1.00 0.00 H new ATOM 0 H1 DG B 8 -9.783 -2.782 1.707 1.00 0.00 H new ATOM 0 H21 DG B 8 -13.048 -3.726 2.419 1.00 0.00 H new ATOM 0 H22 DG B 8 -11.844 -3.315 1.192 1.00 0.00 H new ATOM 1194 P DA B 9 -13.580 -6.420 9.650 1.00 0.00 P ATOM 1195 OP1 DA B 9 -14.677 -6.724 10.604 1.00 0.00 O ATOM 1196 OP2 DA B 9 -12.197 -6.863 9.957 1.00 0.00 O ATOM 1197 O5' DA B 9 -13.991 -7.003 8.226 1.00 0.00 O ATOM 1198 C5' DA B 9 -15.174 -6.554 7.564 1.00 0.00 C ATOM 1199 C4' DA B 9 -15.310 -7.231 6.221 1.00 0.00 C ATOM 1200 O4' DA B 9 -14.137 -6.936 5.424 1.00 0.00 O ATOM 1201 C3' DA B 9 -15.398 -8.756 6.274 1.00 0.00 C ATOM 1202 O3' DA B 9 -16.230 -9.238 5.213 1.00 0.00 O ATOM 1203 C2' DA B 9 -13.958 -9.187 6.080 1.00 0.00 C ATOM 1204 C1' DA B 9 -13.436 -8.132 5.122 1.00 0.00 C ATOM 1205 N9 DA B 9 -12.005 -7.862 5.250 1.00 0.00 N ATOM 1206 C8 DA B 9 -11.265 -7.823 6.404 1.00 0.00 C ATOM 1207 N7 DA B 9 -9.997 -7.550 6.210 1.00 0.00 N ATOM 1208 C5 DA B 9 -9.896 -7.403 4.833 1.00 0.00 C ATOM 1209 C6 DA B 9 -8.810 -7.107 3.991 1.00 0.00 C ATOM 1210 N6 DA B 9 -7.566 -6.899 4.431 1.00 0.00 N ATOM 1211 N1 DA B 9 -9.047 -7.032 2.663 1.00 0.00 N ATOM 1212 C2 DA B 9 -10.296 -7.242 2.223 1.00 0.00 C ATOM 1213 N3 DA B 9 -11.396 -7.526 2.915 1.00 0.00 N ATOM 1214 C4 DA B 9 -11.125 -7.592 4.230 1.00 0.00 C ATOM 0 H5' DA B 9 -15.137 -5.473 7.432 1.00 0.00 H new ATOM 0 H5'' DA B 9 -16.048 -6.771 8.179 1.00 0.00 H new ATOM 0 H4' DA B 9 -16.243 -6.848 5.807 1.00 0.00 H new ATOM 0 H3' DA B 9 -15.833 -9.141 7.196 1.00 0.00 H new ATOM 0 H2' DA B 9 -13.405 -9.194 7.019 1.00 0.00 H new ATOM 0 H2'' DA B 9 -13.886 -10.190 5.660 1.00 0.00 H new ATOM 0 H1' DA B 9 -13.590 -8.495 4.106 1.00 0.00 H new ATOM 0 H8 DA B 9 -11.687 -8.001 7.382 1.00 0.00 H new ATOM 0 H61 DA B 9 -6.819 -6.688 3.769 1.00 0.00 H new ATOM 0 H62 DA B 9 -7.363 -6.951 5.429 1.00 0.00 H new ATOM 0 H2 DA B 9 -10.428 -7.170 1.153 1.00 0.00 H new ATOM 1226 P DC B 10 -16.416 -10.821 5.000 1.00 0.00 P ATOM 1227 OP1 DC B 10 -17.875 -11.097 5.011 1.00 0.00 O ATOM 1228 OP2 DC B 10 -15.528 -11.535 5.952 1.00 0.00 O ATOM 1229 O5' DC B 10 -15.878 -11.073 3.522 1.00 0.00 O ATOM 1230 C5' DC B 10 -16.522 -10.473 2.397 1.00 0.00 C ATOM 1231 C4' DC B 10 -15.973 -11.044 1.111 1.00 0.00 C ATOM 1232 O4' DC B 10 -14.557 -10.760 1.036 1.00 0.00 O ATOM 1233 C3' DC B 10 -16.098 -12.558 0.969 1.00 0.00 C ATOM 1234 O3' DC B 10 -16.252 -12.919 -0.406 1.00 0.00 O ATOM 1235 C2' DC B 10 -14.775 -13.070 1.513 1.00 0.00 C ATOM 1236 C1' DC B 10 -13.797 -11.952 1.176 1.00 0.00 C ATOM 1237 N1 DC B 10 -12.774 -11.713 2.205 1.00 0.00 N ATOM 1238 C2 DC B 10 -11.458 -11.467 1.806 1.00 0.00 C ATOM 1239 O2 DC B 10 -11.186 -11.463 0.594 1.00 0.00 O ATOM 1240 N3 DC B 10 -10.514 -11.240 2.749 1.00 0.00 N ATOM 1241 C4 DC B 10 -10.846 -11.255 4.042 1.00 0.00 C ATOM 1242 N4 DC B 10 -9.883 -11.023 4.940 1.00 0.00 N ATOM 1243 C5 DC B 10 -12.179 -11.506 4.476 1.00 0.00 C ATOM 1244 C6 DC B 10 -13.103 -11.727 3.533 1.00 0.00 C ATOM 0 H5' DC B 10 -16.372 -9.394 2.417 1.00 0.00 H new ATOM 0 H5'' DC B 10 -17.597 -10.646 2.450 1.00 0.00 H new ATOM 0 H4' DC B 10 -16.567 -10.579 0.324 1.00 0.00 H new ATOM 0 H3' DC B 10 -16.962 -12.970 1.491 1.00 0.00 H new ATOM 0 H2' DC B 10 -14.825 -13.250 2.587 1.00 0.00 H new ATOM 0 H2'' DC B 10 -14.486 -14.011 1.045 1.00 0.00 H new ATOM 0 H1' DC B 10 -13.267 -12.247 0.270 1.00 0.00 H new ATOM 0 H41 DC B 10 -10.103 -11.027 5.936 1.00 0.00 H new ATOM 0 H42 DC B 10 -8.929 -10.842 4.629 1.00 0.00 H new ATOM 0 H5 DC B 10 -12.434 -11.518 5.525 1.00 0.00 H new ATOM 0 H6 DC B 10 -14.125 -11.919 3.825 1.00 0.00 H new ATOM 1256 P DC B 11 -16.837 -14.366 -0.788 1.00 0.00 P ATOM 1257 OP1 DC B 11 -17.957 -14.155 -1.740 1.00 0.00 O ATOM 1258 OP2 DC B 11 -17.075 -15.119 0.469 1.00 0.00 O ATOM 1259 O5' DC B 11 -15.643 -15.068 -1.575 1.00 0.00 O ATOM 1260 C5' DC B 11 -15.208 -14.573 -2.841 1.00 0.00 C ATOM 1261 C4' DC B 11 -13.912 -15.234 -3.242 1.00 0.00 C ATOM 1262 O4' DC B 11 -12.873 -14.825 -2.319 1.00 0.00 O ATOM 1263 C3' DC B 11 -13.931 -16.764 -3.206 1.00 0.00 C ATOM 1264 O3' DC B 11 -13.199 -17.291 -4.316 1.00 0.00 O ATOM 1265 C2' DC B 11 -13.238 -17.098 -1.897 1.00 0.00 C ATOM 1266 C1' DC B 11 -12.235 -15.968 -1.775 1.00 0.00 C ATOM 1267 N1 DC B 11 -11.824 -15.647 -0.400 1.00 0.00 N ATOM 1268 C2 DC B 11 -10.479 -15.366 -0.150 1.00 0.00 C ATOM 1269 O2 DC B 11 -9.676 -15.397 -1.097 1.00 0.00 O ATOM 1270 N3 DC B 11 -10.087 -15.069 1.110 1.00 0.00 N ATOM 1271 C4 DC B 11 -10.983 -15.048 2.100 1.00 0.00 C ATOM 1272 N4 DC B 11 -10.552 -14.749 3.328 1.00 0.00 N ATOM 1273 C5 DC B 11 -12.361 -15.330 1.874 1.00 0.00 C ATOM 1274 C6 DC B 11 -12.734 -15.622 0.621 1.00 0.00 C ATOM 0 H5' DC B 11 -15.073 -13.493 -2.790 1.00 0.00 H new ATOM 0 H5'' DC B 11 -15.971 -14.764 -3.596 1.00 0.00 H new ATOM 0 H4' DC B 11 -13.741 -14.923 -4.273 1.00 0.00 H new ATOM 0 H3' DC B 11 -14.934 -17.185 -3.270 1.00 0.00 H new ATOM 0 H2' DC B 11 -13.935 -17.117 -1.059 1.00 0.00 H new ATOM 0 H2'' DC B 11 -12.752 -18.073 -1.930 1.00 0.00 H new ATOM 0 H1' DC B 11 -11.324 -16.273 -2.290 1.00 0.00 H new ATOM 0 H41 DC B 11 -11.210 -14.724 4.107 1.00 0.00 H new ATOM 0 H42 DC B 11 -9.565 -14.546 3.487 1.00 0.00 H new ATOM 0 H5 DC B 11 -13.077 -15.309 2.682 1.00 0.00 H new ATOM 0 H6 DC B 11 -13.771 -15.841 0.413 1.00 0.00 H new ATOM 1286 P DA B 12 -13.219 -18.872 -4.606 1.00 0.00 P ATOM 1287 OP1 DA B 12 -13.661 -19.059 -6.012 1.00 0.00 O ATOM 1288 OP2 DA B 12 -13.964 -19.538 -3.508 1.00 0.00 O ATOM 1289 O5' DA B 12 -11.689 -19.302 -4.505 1.00 0.00 O ATOM 1290 C5' DA B 12 -10.689 -18.646 -5.285 1.00 0.00 C ATOM 1291 C4' DA B 12 -9.331 -19.235 -4.990 1.00 0.00 C ATOM 1292 O4' DA B 12 -8.924 -18.837 -3.659 1.00 0.00 O ATOM 1293 C3' DA B 12 -9.280 -20.761 -4.991 1.00 0.00 C ATOM 1294 O3' DA B 12 -7.977 -21.244 -5.350 1.00 0.00 O ATOM 1295 C2' DA B 12 -9.585 -21.099 -3.544 1.00 0.00 C ATOM 1296 C1' DA B 12 -8.898 -19.968 -2.796 1.00 0.00 C ATOM 1297 N9 DA B 12 -9.556 -19.595 -1.546 1.00 0.00 N ATOM 1298 C8 DA B 12 -10.903 -19.581 -1.286 1.00 0.00 C ATOM 1299 N7 DA B 12 -11.204 -19.204 -0.067 1.00 0.00 N ATOM 1300 C5 DA B 12 -9.969 -18.956 0.517 1.00 0.00 C ATOM 1301 C6 DA B 12 -9.601 -18.526 1.804 1.00 0.00 C ATOM 1302 N6 DA B 12 -10.478 -18.261 2.775 1.00 0.00 N ATOM 1303 N1 DA B 12 -8.284 -18.377 2.064 1.00 0.00 N ATOM 1304 C2 DA B 12 -7.404 -18.643 1.089 1.00 0.00 C ATOM 1305 N3 DA B 12 -7.627 -19.052 -0.157 1.00 0.00 N ATOM 1306 C4 DA B 12 -8.945 -19.191 -0.383 1.00 0.00 C ATOM 0 H5' DA B 12 -10.687 -17.579 -5.064 1.00 0.00 H new ATOM 0 H5'' DA B 12 -10.917 -18.751 -6.346 1.00 0.00 H new ATOM 0 H4' DA B 12 -8.686 -18.866 -5.788 1.00 0.00 H new ATOM 0 H3' DA B 12 -9.966 -21.210 -5.709 1.00 0.00 H new ATOM 0 H2' DA B 12 -10.657 -21.123 -3.349 1.00 0.00 H new ATOM 0 H2'' DA B 12 -9.188 -22.074 -3.262 1.00 0.00 H new ATOM 0 HO3' DA B 12 -7.977 -22.224 -5.340 1.00 0.00 H new ATOM 0 H1' DA B 12 -7.895 -20.302 -2.531 1.00 0.00 H new ATOM 0 H8 DA B 12 -11.647 -19.856 -2.019 1.00 0.00 H new ATOM 0 H61 DA B 12 -10.148 -17.952 3.689 1.00 0.00 H new ATOM 0 H62 DA B 12 -11.478 -18.368 2.602 1.00 0.00 H new ATOM 0 H2 DA B 12 -6.366 -18.506 1.352 1.00 0.00 H new TER 1318 DA B 12 ATOM 1319 O5' DT C 21 -3.747 -16.950 8.926 1.00 0.00 O ATOM 1320 C5' DT C 21 -2.621 -17.802 8.657 1.00 0.00 C ATOM 1321 C4' DT C 21 -2.195 -17.694 7.213 1.00 0.00 C ATOM 1322 O4' DT C 21 -3.286 -18.135 6.368 1.00 0.00 O ATOM 1323 C3' DT C 21 -1.860 -16.281 6.743 1.00 0.00 C ATOM 1324 O3' DT C 21 -0.859 -16.320 5.723 1.00 0.00 O ATOM 1325 C2' DT C 21 -3.182 -15.784 6.187 1.00 0.00 C ATOM 1326 C1' DT C 21 -3.787 -17.049 5.600 1.00 0.00 C ATOM 1327 N1 DT C 21 -5.259 -17.098 5.655 1.00 0.00 N ATOM 1328 C2 DT C 21 -5.944 -17.473 4.523 1.00 0.00 C ATOM 1329 O2 DT C 21 -5.390 -17.782 3.481 1.00 0.00 O ATOM 1330 N3 DT C 21 -7.310 -17.476 4.657 1.00 0.00 N ATOM 1331 C4 DT C 21 -8.035 -17.173 5.790 1.00 0.00 C ATOM 1332 O4 DT C 21 -9.261 -17.248 5.770 1.00 0.00 O ATOM 1333 C5 DT C 21 -7.252 -16.791 6.942 1.00 0.00 C ATOM 1334 C7 DT C 21 -7.959 -16.420 8.206 1.00 0.59 C ATOM 1335 C6 DT C 21 -5.917 -16.766 6.820 1.00 0.00 C ATOM 0 H5' DT C 21 -2.879 -18.836 8.888 1.00 0.00 H new ATOM 0 H5'' DT C 21 -1.790 -17.528 9.307 1.00 0.00 H new ATOM 0 H4' DT C 21 -1.293 -18.302 7.141 1.00 0.00 H new ATOM 0 H3' DT C 21 -1.461 -15.642 7.531 1.00 0.00 H new ATOM 0 H2' DT C 21 -3.814 -15.355 6.965 1.00 0.00 H new ATOM 0 H2'' DT C 21 -3.040 -15.013 5.430 1.00 0.00 H new ATOM 0 HO5' DT C 21 -4.006 -17.038 9.867 1.00 0.00 H new ATOM 0 H1' DT C 21 -3.515 -17.087 4.545 1.00 0.00 H new ATOM 0 H3 DT C 21 -7.847 -17.730 3.828 1.00 0.00 H new ATOM 0 H71 DT C 21 -7.332 -16.673 9.061 1.00 0.59 H new ATOM 0 H72 DT C 21 -8.161 -15.349 8.209 1.00 0.59 H new ATOM 0 H73 DT C 21 -8.900 -16.967 8.271 1.00 0.59 H new ATOM 0 H6 DT C 21 -5.328 -16.471 7.676 1.00 0.00 H new ATOM 1348 P DG C 22 -0.035 -14.988 5.364 1.00 0.00 P ATOM 1349 OP1 DG C 22 1.404 -15.354 5.310 1.00 0.00 O ATOM 1350 OP2 DG C 22 -0.484 -13.904 6.274 1.00 0.00 O ATOM 1351 O5' DG C 22 -0.512 -14.629 3.887 1.00 0.00 O ATOM 1352 C5' DG C 22 0.176 -15.140 2.746 1.00 0.00 C ATOM 1353 C4' DG C 22 -0.257 -14.398 1.504 1.00 0.00 C ATOM 1354 O4' DG C 22 -1.588 -14.840 1.146 1.00 0.00 O ATOM 1355 C3' DG C 22 -0.341 -12.881 1.668 1.00 0.00 C ATOM 1356 O3' DG C 22 0.807 -12.246 1.099 1.00 0.00 O ATOM 1357 C2' DG C 22 -1.576 -12.496 0.877 1.00 0.00 C ATOM 1358 C1' DG C 22 -2.450 -13.732 0.941 1.00 0.00 C ATOM 1359 N9 DG C 22 -3.430 -13.715 2.021 1.00 0.00 N ATOM 1360 C8 DG C 22 -3.202 -13.432 3.344 1.00 0.00 C ATOM 1361 N7 DG C 22 -4.278 -13.493 4.078 1.00 0.00 N ATOM 1362 C5 DG C 22 -5.283 -13.837 3.182 1.00 0.00 C ATOM 1363 C6 DG C 22 -6.671 -14.046 3.391 1.00 0.00 C ATOM 1364 O6 DG C 22 -7.314 -13.970 4.445 1.00 0.00 O ATOM 1365 N1 DG C 22 -7.320 -14.379 2.206 1.00 0.00 N ATOM 1366 C2 DG C 22 -6.716 -14.494 0.981 1.00 0.00 C ATOM 1367 N2 DG C 22 -7.519 -14.823 -0.040 1.00 0.00 N ATOM 1368 N3 DG C 22 -5.424 -14.300 0.771 1.00 0.00 N ATOM 1369 C4 DG C 22 -4.774 -13.977 1.908 1.00 0.00 C ATOM 0 H5' DG C 22 -0.030 -16.204 2.634 1.00 0.00 H new ATOM 0 H5'' DG C 22 1.252 -15.037 2.884 1.00 0.00 H new ATOM 0 H4' DG C 22 0.501 -14.614 0.752 1.00 0.00 H new ATOM 0 H3' DG C 22 -0.385 -12.581 2.715 1.00 0.00 H new ATOM 0 H2' DG C 22 -2.076 -11.631 1.312 1.00 0.00 H new ATOM 0 H2'' DG C 22 -1.327 -12.236 -0.152 1.00 0.00 H new ATOM 0 H1' DG C 22 -3.016 -13.783 0.011 1.00 0.00 H new ATOM 0 H8 DG C 22 -2.228 -13.183 3.738 1.00 0.00 H new ATOM 0 H1 DG C 22 -8.324 -14.551 2.253 1.00 0.00 H new ATOM 0 H21 DG C 22 -7.134 -14.925 -0.979 1.00 0.00 H new ATOM 0 H22 DG C 22 -8.515 -14.971 0.122 1.00 0.00 H new ATOM 1381 P DG C 23 0.846 -10.644 0.971 1.00 0.00 P ATOM 1382 OP1 DG C 23 2.078 -10.287 0.221 1.00 0.00 O ATOM 1383 OP2 DG C 23 0.616 -10.066 2.320 1.00 0.00 O ATOM 1384 O5' DG C 23 -0.411 -10.294 0.055 1.00 0.00 O ATOM 1385 C5' DG C 23 -0.312 -10.314 -1.369 1.00 0.00 C ATOM 1386 C4' DG C 23 -1.689 -10.381 -1.989 1.00 0.00 C ATOM 1387 O4' DG C 23 -2.622 -10.900 -1.008 1.00 0.00 O ATOM 1388 C3' DG C 23 -2.258 -9.036 -2.445 1.00 0.00 C ATOM 1389 O3' DG C 23 -2.921 -9.179 -3.704 1.00 0.00 O ATOM 1390 C2' DG C 23 -3.253 -8.672 -1.358 1.00 0.00 C ATOM 1391 C1' DG C 23 -3.727 -10.024 -0.867 1.00 0.00 C ATOM 1392 N9 DG C 23 -4.139 -10.047 0.533 1.00 0.00 N ATOM 1393 C8 DG C 23 -3.338 -9.840 1.629 1.00 0.00 C ATOM 1394 N7 DG C 23 -3.981 -9.918 2.760 1.00 0.00 N ATOM 1395 C5 DG C 23 -5.290 -10.198 2.391 1.00 0.00 C ATOM 1396 C6 DG C 23 -6.445 -10.396 3.189 1.00 0.00 C ATOM 1397 O6 DG C 23 -6.546 -10.366 4.422 1.00 0.00 O ATOM 1398 N1 DG C 23 -7.566 -10.656 2.409 1.00 0.00 N ATOM 1399 C2 DG C 23 -7.577 -10.716 1.038 1.00 0.00 C ATOM 1400 N2 DG C 23 -8.766 -10.979 0.477 1.00 0.00 N ATOM 1401 N3 DG C 23 -6.507 -10.533 0.280 1.00 0.00 N ATOM 1402 C4 DG C 23 -5.405 -10.280 1.018 1.00 0.00 C ATOM 0 H5' DG C 23 0.280 -11.172 -1.687 1.00 0.00 H new ATOM 0 H5'' DG C 23 0.208 -9.421 -1.717 1.00 0.00 H new ATOM 0 H4' DG C 23 -1.572 -11.012 -2.870 1.00 0.00 H new ATOM 0 H3' DG C 23 -1.489 -8.275 -2.583 1.00 0.00 H new ATOM 0 H2' DG C 23 -2.787 -8.093 -0.561 1.00 0.00 H new ATOM 0 H2'' DG C 23 -4.076 -8.072 -1.748 1.00 0.00 H new ATOM 0 H1' DG C 23 -4.606 -10.305 -1.448 1.00 0.00 H new ATOM 0 H8 DG C 23 -2.280 -9.633 1.561 1.00 0.00 H new ATOM 0 H1 DG C 23 -8.449 -10.815 2.894 1.00 0.00 H new ATOM 0 H21 DG C 23 -8.849 -11.038 -0.538 1.00 0.00 H new ATOM 0 H22 DG C 23 -9.587 -11.120 1.065 1.00 0.00 H new ATOM 1414 P DT C 24 -2.784 -8.022 -4.813 1.00 0.00 P ATOM 1415 OP1 DT C 24 -2.767 -8.679 -6.145 1.00 0.00 O ATOM 1416 OP2 DT C 24 -1.663 -7.131 -4.420 1.00 0.00 O ATOM 1417 O5' DT C 24 -4.143 -7.202 -4.683 1.00 0.00 O ATOM 1418 C5' DT C 24 -5.290 -7.556 -5.455 1.00 0.00 C ATOM 1419 C4' DT C 24 -6.502 -6.803 -4.961 1.00 0.00 C ATOM 1420 O4' DT C 24 -6.830 -7.262 -3.634 1.00 0.00 O ATOM 1421 C3' DT C 24 -6.311 -5.297 -4.825 1.00 0.00 C ATOM 1422 O3' DT C 24 -6.716 -4.637 -6.030 1.00 0.00 O ATOM 1423 C2' DT C 24 -7.229 -4.921 -3.671 1.00 0.00 C ATOM 1424 C1' DT C 24 -7.468 -6.223 -2.910 1.00 0.00 C ATOM 1425 N1 DT C 24 -6.928 -6.231 -1.539 1.00 0.00 N ATOM 1426 C2 DT C 24 -7.792 -6.495 -0.503 1.00 0.00 C ATOM 1427 O2 DT C 24 -8.980 -6.718 -0.668 1.00 0.00 O ATOM 1428 N3 DT C 24 -7.214 -6.490 0.740 1.00 0.00 N ATOM 1429 C4 DT C 24 -5.888 -6.251 1.041 1.00 0.00 C ATOM 1430 O4 DT C 24 -5.512 -6.283 2.210 1.00 0.00 O ATOM 1431 C5 DT C 24 -5.037 -5.980 -0.094 1.00 0.00 C ATOM 1432 C7 DT C 24 -3.585 -5.706 0.142 1.00 0.59 C ATOM 1433 C6 DT C 24 -5.589 -5.982 -1.317 1.00 0.00 C ATOM 0 H5' DT C 24 -5.467 -8.629 -5.387 1.00 0.00 H new ATOM 0 H5'' DT C 24 -5.115 -7.328 -6.506 1.00 0.00 H new ATOM 0 H4' DT C 24 -7.271 -6.991 -5.710 1.00 0.00 H new ATOM 0 H3' DT C 24 -5.274 -5.010 -4.649 1.00 0.00 H new ATOM 0 H2' DT C 24 -6.768 -4.169 -3.030 1.00 0.00 H new ATOM 0 H2'' DT C 24 -8.166 -4.499 -4.034 1.00 0.00 H new ATOM 0 H1' DT C 24 -8.547 -6.350 -2.823 1.00 0.00 H new ATOM 0 H3 DT C 24 -7.831 -6.684 1.529 1.00 0.00 H new ATOM 0 H71 DT C 24 -3.007 -6.040 -0.720 1.00 0.59 H new ATOM 0 H72 DT C 24 -3.435 -4.636 0.286 1.00 0.59 H new ATOM 0 H73 DT C 24 -3.253 -6.242 1.031 1.00 0.59 H new ATOM 0 H6 DT C 24 -4.955 -5.779 -2.168 1.00 0.00 H new ATOM 1446 P DC C 25 -7.253 -3.123 -5.970 1.00 0.00 P ATOM 1447 OP1 DC C 25 -7.133 -2.552 -7.337 1.00 0.00 O ATOM 1448 OP2 DC C 25 -6.596 -2.438 -4.829 1.00 0.00 O ATOM 1449 O5' DC C 25 -8.804 -3.276 -5.634 1.00 0.00 O ATOM 1450 C5' DC C 25 -9.667 -4.033 -6.480 1.00 0.00 C ATOM 1451 C4' DC C 25 -11.096 -3.914 -6.006 1.00 0.00 C ATOM 1452 O4' DC C 25 -11.133 -4.094 -4.571 1.00 0.00 O ATOM 1453 C3' DC C 25 -11.748 -2.558 -6.261 1.00 0.00 C ATOM 1454 O3' DC C 25 -13.162 -2.704 -6.414 1.00 0.00 O ATOM 1455 C2' DC C 25 -11.422 -1.782 -4.997 1.00 0.00 C ATOM 1456 C1' DC C 25 -11.431 -2.862 -3.923 1.00 0.00 C ATOM 1457 N1 DC C 25 -10.435 -2.661 -2.861 1.00 0.00 N ATOM 1458 C2 DC C 25 -10.818 -2.853 -1.533 1.00 0.00 C ATOM 1459 O2 DC C 25 -11.986 -3.191 -1.288 1.00 0.00 O ATOM 1460 N3 DC C 25 -9.908 -2.667 -0.549 1.00 0.00 N ATOM 1461 C4 DC C 25 -8.660 -2.303 -0.857 1.00 0.00 C ATOM 1462 N4 DC C 25 -7.792 -2.133 0.140 1.00 0.00 N ATOM 1463 C5 DC C 25 -8.245 -2.097 -2.203 1.00 0.00 C ATOM 1464 C6 DC C 25 -9.155 -2.289 -3.165 1.00 0.00 C ATOM 0 H5' DC C 25 -9.362 -5.079 -6.480 1.00 0.00 H new ATOM 0 H5'' DC C 25 -9.586 -3.677 -7.507 1.00 0.00 H new ATOM 0 H4' DC C 25 -11.641 -4.671 -6.570 1.00 0.00 H new ATOM 0 H3' DC C 25 -11.395 -2.070 -7.169 1.00 0.00 H new ATOM 0 H2' DC C 25 -10.453 -1.288 -5.065 1.00 0.00 H new ATOM 0 H2'' DC C 25 -12.162 -1.007 -4.797 1.00 0.00 H new ATOM 0 H1' DC C 25 -12.410 -2.841 -3.443 1.00 0.00 H new ATOM 0 H41 DC C 25 -6.832 -1.855 -0.062 1.00 0.00 H new ATOM 0 H42 DC C 25 -8.088 -2.281 1.105 1.00 0.00 H new ATOM 0 H5 DC C 25 -7.235 -1.797 -2.439 1.00 0.00 H new ATOM 0 H6 DC C 25 -8.874 -2.148 -4.198 1.00 0.00 H new ATOM 1476 P DA C 26 -14.071 -1.407 -6.689 1.00 0.00 P ATOM 1477 OP1 DA C 26 -15.242 -1.849 -7.487 1.00 0.00 O ATOM 1478 OP2 DA C 26 -13.197 -0.323 -7.207 1.00 0.00 O ATOM 1479 O5' DA C 26 -14.589 -0.985 -5.242 1.00 0.00 O ATOM 1480 C5' DA C 26 -15.612 -1.733 -4.584 1.00 0.00 C ATOM 1481 C4' DA C 26 -16.157 -0.953 -3.412 1.00 0.00 C ATOM 1482 O4' DA C 26 -15.095 -0.756 -2.446 1.00 0.00 O ATOM 1483 C3' DA C 26 -16.672 0.446 -3.753 1.00 0.00 C ATOM 1484 O3' DA C 26 -17.781 0.785 -2.916 1.00 0.00 O ATOM 1485 C2' DA C 26 -15.480 1.335 -3.453 1.00 0.00 C ATOM 1486 C1' DA C 26 -14.839 0.629 -2.273 1.00 0.00 C ATOM 1487 N9 DA C 26 -13.390 0.809 -2.174 1.00 0.00 N ATOM 1488 C8 DA C 26 -12.487 0.947 -3.199 1.00 0.00 C ATOM 1489 N7 DA C 26 -11.250 1.097 -2.796 1.00 0.00 N ATOM 1490 C5 DA C 26 -11.343 1.055 -1.411 1.00 0.00 C ATOM 1491 C6 DA C 26 -10.377 1.158 -0.395 1.00 0.00 C ATOM 1492 N6 DA C 26 -9.075 1.330 -0.626 1.00 0.00 N ATOM 1493 N1 DA C 26 -10.803 1.076 0.885 1.00 0.00 N ATOM 1494 C2 DA C 26 -12.111 0.904 1.117 1.00 0.00 C ATOM 1495 N3 DA C 26 -13.113 0.793 0.247 1.00 0.00 N ATOM 1496 C4 DA C 26 -12.656 0.879 -1.015 1.00 0.00 C ATOM 0 H5' DA C 26 -15.211 -2.687 -4.241 1.00 0.00 H new ATOM 0 H5'' DA C 26 -16.416 -1.959 -5.285 1.00 0.00 H new ATOM 0 H4' DA C 26 -16.995 -1.544 -3.044 1.00 0.00 H new ATOM 0 H3' DA C 26 -17.026 0.540 -4.780 1.00 0.00 H new ATOM 0 H2' DA C 26 -14.801 1.405 -4.303 1.00 0.00 H new ATOM 0 H2'' DA C 26 -15.784 2.352 -3.203 1.00 0.00 H new ATOM 0 H1' DA C 26 -15.263 1.053 -1.363 1.00 0.00 H new ATOM 0 H8 DA C 26 -12.771 0.933 -4.241 1.00 0.00 H new ATOM 0 H61 DA C 26 -8.423 1.398 0.155 1.00 0.00 H new ATOM 0 H62 DA C 26 -8.731 1.394 -1.584 1.00 0.00 H new ATOM 0 H2 DA C 26 -12.393 0.847 2.158 1.00 0.00 H new ATOM 1508 P DA C 27 -18.641 2.106 -3.232 1.00 0.00 P ATOM 1509 OP1 DA C 27 -20.064 1.695 -3.352 1.00 0.00 O ATOM 1510 OP2 DA C 27 -17.990 2.831 -4.352 1.00 0.00 O ATOM 1511 O5' DA C 27 -18.493 2.988 -1.913 1.00 0.00 O ATOM 1512 C5' DA C 27 -19.424 2.859 -0.838 1.00 0.00 C ATOM 1513 C4' DA C 27 -19.299 4.033 0.105 1.00 0.00 C ATOM 1514 O4' DA C 27 -17.900 4.236 0.419 1.00 0.00 O ATOM 1515 C3' DA C 27 -19.791 5.366 -0.456 1.00 0.00 C ATOM 1516 O3' DA C 27 -20.307 6.187 0.596 1.00 0.00 O ATOM 1517 C2' DA C 27 -18.534 5.972 -1.048 1.00 0.00 C ATOM 1518 C1' DA C 27 -17.453 5.481 -0.100 1.00 0.00 C ATOM 1519 N9 DA C 27 -16.150 5.261 -0.728 1.00 0.00 N ATOM 1520 C8 DA C 27 -15.883 5.022 -2.054 1.00 0.00 C ATOM 1521 N7 DA C 27 -14.609 4.858 -2.314 1.00 0.00 N ATOM 1522 C5 DA C 27 -13.995 4.998 -1.077 1.00 0.00 C ATOM 1523 C6 DA C 27 -12.650 4.933 -0.677 1.00 0.00 C ATOM 1524 N6 DA C 27 -11.637 4.697 -1.515 1.00 0.00 N ATOM 1525 N1 DA C 27 -12.374 5.119 0.632 1.00 0.00 N ATOM 1526 C2 DA C 27 -13.389 5.354 1.474 1.00 0.00 C ATOM 1527 N3 DA C 27 -14.693 5.437 1.218 1.00 0.00 N ATOM 1528 C4 DA C 27 -14.931 5.247 -0.092 1.00 0.00 C ATOM 0 H5' DA C 27 -19.242 1.929 -0.299 1.00 0.00 H new ATOM 0 H5'' DA C 27 -20.439 2.806 -1.231 1.00 0.00 H new ATOM 0 H4' DA C 27 -19.920 3.772 0.962 1.00 0.00 H new ATOM 0 H3' DA C 27 -20.597 5.263 -1.182 1.00 0.00 H new ATOM 0 H2' DA C 27 -18.362 5.633 -2.070 1.00 0.00 H new ATOM 0 H2'' DA C 27 -18.584 7.060 -1.078 1.00 0.00 H new ATOM 0 H1' DA C 27 -17.304 6.253 0.655 1.00 0.00 H new ATOM 0 H8 DA C 27 -16.651 4.974 -2.812 1.00 0.00 H new ATOM 0 H61 DA C 27 -10.681 4.662 -1.162 1.00 0.00 H new ATOM 0 H62 DA C 27 -11.820 4.552 -2.508 1.00 0.00 H new ATOM 0 H2 DA C 27 -13.110 5.496 2.508 1.00 0.00 H new ATOM 1540 P DA C 28 -20.664 7.726 0.301 1.00 0.00 P ATOM 1541 OP1 DA C 28 -21.908 8.043 1.049 1.00 0.00 O ATOM 1542 OP2 DA C 28 -20.615 7.945 -1.166 1.00 0.00 O ATOM 1543 O5' DA C 28 -19.464 8.533 0.968 1.00 0.00 O ATOM 1544 C5' DA C 28 -19.246 8.492 2.378 1.00 0.00 C ATOM 1545 C4' DA C 28 -18.353 9.635 2.800 1.00 0.00 C ATOM 1546 O4' DA C 28 -16.987 9.321 2.439 1.00 0.00 O ATOM 1547 C3' DA C 28 -18.659 10.970 2.124 1.00 0.00 C ATOM 1548 O3' DA C 28 -18.344 12.056 3.002 1.00 0.00 O ATOM 1549 C2' DA C 28 -17.741 10.959 0.917 1.00 0.00 C ATOM 1550 C1' DA C 28 -16.523 10.207 1.430 1.00 0.00 C ATOM 1551 N9 DA C 28 -15.840 9.414 0.410 1.00 0.00 N ATOM 1552 C8 DA C 28 -16.407 8.747 -0.646 1.00 0.00 C ATOM 1553 N7 DA C 28 -15.540 8.118 -1.401 1.00 0.00 N ATOM 1554 C5 DA C 28 -14.319 8.388 -0.802 1.00 0.00 C ATOM 1555 C6 DA C 28 -13.003 8.010 -1.121 1.00 0.00 C ATOM 1556 N6 DA C 28 -12.684 7.243 -2.168 1.00 0.00 N ATOM 1557 N1 DA C 28 -12.010 8.449 -0.316 1.00 0.00 N ATOM 1558 C2 DA C 28 -12.329 9.217 0.734 1.00 0.00 C ATOM 1559 N3 DA C 28 -13.525 9.640 1.136 1.00 0.00 N ATOM 1560 C4 DA C 28 -14.488 9.186 0.316 1.00 0.00 C ATOM 0 H5' DA C 28 -18.789 7.542 2.655 1.00 0.00 H new ATOM 0 H5'' DA C 28 -20.199 8.553 2.903 1.00 0.00 H new ATOM 0 H4' DA C 28 -18.521 9.745 3.871 1.00 0.00 H new ATOM 0 H3' DA C 28 -19.709 11.096 1.858 1.00 0.00 H new ATOM 0 H2' DA C 28 -18.198 10.456 0.065 1.00 0.00 H new ATOM 0 H2'' DA C 28 -17.487 11.968 0.592 1.00 0.00 H new ATOM 0 H1' DA C 28 -15.801 10.942 1.786 1.00 0.00 H new ATOM 0 H8 DA C 28 -17.470 8.741 -0.838 1.00 0.00 H new ATOM 0 H61 DA C 28 -11.709 7.003 -2.346 1.00 0.00 H new ATOM 0 H62 DA C 28 -13.416 6.897 -2.789 1.00 0.00 H new ATOM 0 H2 DA C 28 -11.496 9.539 1.341 1.00 0.00 H new ATOM 1572 P DG C 29 -18.539 13.570 2.499 1.00 0.00 P ATOM 1573 OP1 DG C 29 -19.419 14.251 3.483 1.00 0.00 O ATOM 1574 OP2 DG C 29 -18.927 13.543 1.066 1.00 0.00 O ATOM 1575 O5' DG C 29 -17.084 14.209 2.614 1.00 0.00 O ATOM 1576 C5' DG C 29 -16.664 14.854 3.814 1.00 0.00 C ATOM 1577 C4' DG C 29 -15.156 14.919 3.875 1.00 0.00 C ATOM 1578 O4' DG C 29 -14.605 13.953 2.946 1.00 0.00 O ATOM 1579 C3' DG C 29 -14.555 16.271 3.480 1.00 0.00 C ATOM 1580 O3' DG C 29 -13.447 16.586 4.327 1.00 0.00 O ATOM 1581 C2' DG C 29 -14.093 16.054 2.051 1.00 0.00 C ATOM 1582 C1' DG C 29 -13.701 14.592 2.062 1.00 0.00 C ATOM 1583 N9 DG C 29 -13.793 13.926 0.768 1.00 0.00 N ATOM 1584 C8 DG C 29 -14.928 13.721 0.021 1.00 0.00 C ATOM 1585 N7 DG C 29 -14.699 13.096 -1.103 1.00 0.00 N ATOM 1586 C5 DG C 29 -13.328 12.873 -1.097 1.00 0.00 C ATOM 1587 C6 DG C 29 -12.497 12.237 -2.055 1.00 0.00 C ATOM 1588 O6 DG C 29 -12.815 11.726 -3.135 1.00 0.00 O ATOM 1589 N1 DG C 29 -11.165 12.227 -1.650 1.00 0.00 N ATOM 1590 C2 DG C 29 -10.694 12.763 -0.477 1.00 0.00 C ATOM 1591 N2 DG C 29 -9.373 12.654 -0.265 1.00 0.00 N ATOM 1592 N3 DG C 29 -11.458 13.360 0.424 1.00 0.00 N ATOM 1593 C4 DG C 29 -12.755 13.379 0.051 1.00 0.00 C ATOM 0 H5' DG C 29 -17.047 14.312 4.679 1.00 0.00 H new ATOM 0 H5'' DG C 29 -17.080 15.860 3.859 1.00 0.00 H new ATOM 0 H4' DG C 29 -14.906 14.727 4.918 1.00 0.00 H new ATOM 0 H3' DG C 29 -15.260 17.097 3.574 1.00 0.00 H new ATOM 0 H2' DG C 29 -14.886 16.258 1.331 1.00 0.00 H new ATOM 0 H2'' DG C 29 -13.253 16.699 1.792 1.00 0.00 H new ATOM 0 H1' DG C 29 -12.654 14.529 2.357 1.00 0.00 H new ATOM 0 H8 DG C 29 -15.911 14.044 0.332 1.00 0.00 H new ATOM 0 H1 DG C 29 -10.487 11.788 -2.273 1.00 0.00 H new ATOM 0 H21 DG C 29 -8.960 13.032 0.588 1.00 0.00 H new ATOM 0 H22 DG C 29 -8.782 12.193 -0.957 1.00 0.00 H new ATOM 1605 P DG C 30 -13.187 18.111 4.765 1.00 0.00 P ATOM 1606 OP1 DG C 30 -13.129 18.143 6.249 1.00 0.00 O ATOM 1607 OP2 DG C 30 -14.161 18.974 4.051 1.00 0.00 O ATOM 1608 O5' DG C 30 -11.730 18.431 4.206 1.00 0.00 O ATOM 1609 C5' DG C 30 -10.570 18.195 5.004 1.00 0.00 C ATOM 1610 C4' DG C 30 -9.342 18.735 4.310 1.00 0.00 C ATOM 1611 O4' DG C 30 -9.201 18.078 3.028 1.00 0.00 O ATOM 1612 C3' DG C 30 -9.383 20.231 4.003 1.00 0.00 C ATOM 1613 O3' DG C 30 -8.065 20.803 4.014 1.00 0.00 O ATOM 1614 C2' DG C 30 -9.959 20.273 2.599 1.00 0.00 C ATOM 1615 C1' DG C 30 -9.388 19.011 1.972 1.00 0.00 C ATOM 1616 N9 DG C 30 -10.252 18.391 0.975 1.00 0.00 N ATOM 1617 C8 DG C 30 -11.625 18.400 0.949 1.00 0.00 C ATOM 1618 N7 DG C 30 -12.125 17.763 -0.074 1.00 0.00 N ATOM 1619 C5 DG C 30 -11.014 17.302 -0.768 1.00 0.00 C ATOM 1620 C6 DG C 30 -10.926 16.543 -1.962 1.00 0.00 C ATOM 1621 O6 DG C 30 -11.844 16.113 -2.672 1.00 0.00 O ATOM 1622 N1 DG C 30 -9.604 16.292 -2.313 1.00 0.00 N ATOM 1623 C2 DG C 30 -8.506 16.718 -1.604 1.00 0.00 C ATOM 1624 N2 DG C 30 -7.310 16.373 -2.106 1.00 0.00 N ATOM 1625 N3 DG C 30 -8.574 17.426 -0.489 1.00 0.00 N ATOM 1626 C4 DG C 30 -9.850 17.681 -0.131 1.00 0.00 C ATOM 0 H5' DG C 30 -10.455 17.126 5.184 1.00 0.00 H new ATOM 0 H5'' DG C 30 -10.686 18.672 5.977 1.00 0.00 H new ATOM 0 H4' DG C 30 -8.521 18.550 5.003 1.00 0.00 H new ATOM 0 H3' DG C 30 -9.960 20.796 4.735 1.00 0.00 H new ATOM 0 H2' DG C 30 -11.049 20.265 2.607 1.00 0.00 H new ATOM 0 H2'' DG C 30 -9.651 21.169 2.060 1.00 0.00 H new ATOM 0 HO3' DG C 30 -8.122 21.760 3.813 1.00 0.00 H new ATOM 0 H1' DG C 30 -8.469 19.287 1.455 1.00 0.00 H new ATOM 0 H8 DG C 30 -12.230 18.886 1.700 1.00 0.00 H new ATOM 0 H1 DG C 30 -9.436 15.751 -3.161 1.00 0.00 H new ATOM 0 H21 DG C 30 -6.455 16.658 -1.628 1.00 0.00 H new ATOM 0 H22 DG C 30 -7.256 15.826 -2.965 1.00 0.00 H new TER 1638 DG C 30 HETATM 1639 ZN ZN A 500 4.944 2.919 -12.750 1.00 0.46 ZN