USER MOD reduce.3.24.130724 H: found=0, std=0, add=555, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 553 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 147 HIS HE2 : A 147 HIS NE2 : A 187 ZNZN :(H bumps) USER MOD NoAdj-H: A 169 HIS HE2 : A 169 HIS NE2 : A 188 ZNZN :(H bumps) USER MOD Set 1.1: B 6 A O2' : rot -49:sc= 1.82 USER MOD Set 1.2: B 7 U O2' : rot -82:sc= 0.317 USER MOD Set 2.1: A 150 LYS NZ :NH3+ -144:sc= 0.145 (180deg=0.0586) USER MOD Set 2.2: B 4 A O2' : rot 180:sc= -0.0397 USER MOD Set 3.1: A 148 HIS : no HD1:sc= -0.834 X(o=-0.18,f=-0.061) USER MOD Set 3.2: B 5 G O2' : rot 66:sc= 0.653 USER MOD Set 4.1: A 135 LYS NZ :NH3+ -126:sc= -0.0741 (180deg=-0.299) USER MOD Set 4.2: B 7 U O3' : rot -172:sc= 1.27 USER MOD Set 5.1: A 130 GLN : amide:sc= 0.0216 K(o=0.48,f=-4.7!) USER MOD Set 5.2: A 131 LYS NZ :NH3+ -135:sc= 0.454 (180deg=0) USER MOD Set 6.1: A 128 SER OG : rot 180:sc= 0 USER MOD Set 6.2: A 129 MET CE :methyl -163:sc= -0.0302 (180deg=-0.391) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 164:sc= -0.0652 (180deg=-0.467) USER MOD Single : A 134 SER OG : rot -78:sc= 1.15 USER MOD Single : A 140 TYR OH : rot 180:sc= -0.222 USER MOD Single : A 141 ASN : amide:sc= -0.466 K(o=-0.47,f=-1.2) USER MOD Single : A 153 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00449) USER MOD Single : A 157 GLN : amide:sc= -0.703 K(o=-0.7,f=-0.13) USER MOD Single : A 159 LYS NZ :NH3+ 138:sc= 1.11 (180deg=-0.271) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 HIS : no HD1:sc= -0.445 X(o=-0.44,f=-0.87) USER MOD Single : A 165 GLN : amide:sc= -1.26 X(o=-1.3,f=-1.2) USER MOD Single : A 166 SER OG : rot 75:sc= 1.32 USER MOD Single : A 168 SER OG : rot 180:sc= 0 USER MOD Single : A 170 MET CE :methyl -176:sc= -3.47! (180deg=-3.68!) USER MOD Single : A 173 SER OG : rot -49:sc= 0.0242 USER MOD Single : A 177 LYS NZ :NH3+ -164:sc= -0.0154 (180deg=-0.249) USER MOD Single : A 179 GLN : amide:sc= -0.654 K(o=-0.65,f=-2.7!) USER MOD Single : A 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD Single : A 185 GLN : amide:sc= 0.842 K(o=0.84,f=-0.89) USER MOD Single : B 1 A O2' : rot -9:sc= -0.476 USER MOD Single : B 1 A O5' : rot 150:sc= 0.0633 USER MOD Single : B 2 G O2' : rot 49:sc= 0.831 USER MOD Single : B 3 G O2' : rot -131:sc= 0.779 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 124 15.107 -1.778 -0.026 1.00 0.00 N ATOM 2 CA PRO A 124 16.407 -1.208 -0.420 1.00 0.00 C ATOM 3 C PRO A 124 16.265 0.222 -0.918 1.00 0.00 C ATOM 4 O PRO A 124 15.267 0.555 -1.559 1.00 0.00 O ATOM 5 CB PRO A 124 17.008 -2.125 -1.484 1.00 0.00 C ATOM 6 CG PRO A 124 16.514 -3.486 -1.016 1.00 0.00 C ATOM 7 CD PRO A 124 15.094 -3.147 -0.571 1.00 0.00 C ATOM 0 HA PRO A 124 17.071 -1.155 0.443 1.00 0.00 H new ATOM 0 HB2 PRO A 124 16.653 -1.881 -2.485 1.00 0.00 H new ATOM 0 HB3 PRO A 124 18.096 -2.069 -1.509 1.00 0.00 H new ATOM 0 HG2 PRO A 124 16.529 -4.227 -1.815 1.00 0.00 H new ATOM 0 HG3 PRO A 124 17.117 -3.885 -0.200 1.00 0.00 H new ATOM 0 HD2 PRO A 124 14.403 -3.217 -1.411 1.00 0.00 H new ATOM 0 HD3 PRO A 124 14.751 -3.855 0.183 1.00 0.00 H new ATOM 15 N LYS A 125 17.262 1.068 -0.625 1.00 0.00 N ATOM 16 CA LYS A 125 17.257 2.481 -0.993 1.00 0.00 C ATOM 17 C LYS A 125 15.982 3.182 -0.526 1.00 0.00 C ATOM 18 O LYS A 125 15.611 4.220 -1.075 1.00 0.00 O ATOM 19 CB LYS A 125 17.477 2.628 -2.503 1.00 0.00 C ATOM 20 CG LYS A 125 18.788 1.989 -2.957 1.00 0.00 C ATOM 21 CD LYS A 125 19.986 2.673 -2.297 1.00 0.00 C ATOM 22 CE LYS A 125 21.285 2.082 -2.841 1.00 0.00 C ATOM 23 NZ LYS A 125 22.448 2.758 -2.241 1.00 0.00 N ATOM 0 H LYS A 125 18.101 0.783 -0.120 1.00 0.00 H new ATOM 0 HA LYS A 125 18.082 2.976 -0.480 1.00 0.00 H new ATOM 0 HB2 LYS A 125 16.646 2.167 -3.037 1.00 0.00 H new ATOM 0 HB3 LYS A 125 17.479 3.685 -2.768 1.00 0.00 H new ATOM 0 HG2 LYS A 125 18.786 0.928 -2.706 1.00 0.00 H new ATOM 0 HG3 LYS A 125 18.875 2.060 -4.041 1.00 0.00 H new ATOM 0 HD2 LYS A 125 19.955 3.745 -2.489 1.00 0.00 H new ATOM 0 HD3 LYS A 125 19.941 2.542 -1.216 1.00 0.00 H new ATOM 0 HE2 LYS A 125 21.325 1.015 -2.624 1.00 0.00 H new ATOM 0 HE3 LYS A 125 21.314 2.188 -3.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 23.324 2.345 -2.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 22.416 3.772 -2.469 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 22.427 2.635 -1.209 1.00 0.00 H new ATOM 37 N GLY A 126 15.305 2.623 0.481 1.00 0.00 N ATOM 38 CA GLY A 126 14.055 3.163 0.984 1.00 0.00 C ATOM 39 C GLY A 126 14.268 4.367 1.883 1.00 0.00 C ATOM 40 O GLY A 126 13.482 5.315 1.853 1.00 0.00 O ATOM 0 H GLY A 126 15.616 1.781 0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 126 13.421 3.447 0.144 1.00 0.00 H new ATOM 0 HA3 GLY A 126 13.524 2.389 1.537 1.00 0.00 H new ATOM 44 N LYS A 127 15.337 4.312 2.675 1.00 0.00 N ATOM 45 CA LYS A 127 15.669 5.308 3.681 1.00 0.00 C ATOM 46 C LYS A 127 14.456 5.726 4.516 1.00 0.00 C ATOM 47 O LYS A 127 13.441 5.035 4.563 1.00 0.00 O ATOM 48 CB LYS A 127 16.340 6.512 3.009 1.00 0.00 C ATOM 49 CG LYS A 127 17.556 6.114 2.166 1.00 0.00 C ATOM 50 CD LYS A 127 18.650 5.501 3.042 1.00 0.00 C ATOM 51 CE LYS A 127 19.861 5.117 2.190 1.00 0.00 C ATOM 52 NZ LYS A 127 20.402 6.286 1.476 1.00 0.00 N ATOM 0 H LYS A 127 16.013 3.550 2.630 1.00 0.00 H new ATOM 0 HA LYS A 127 16.370 4.859 4.384 1.00 0.00 H new ATOM 0 HB2 LYS A 127 15.614 7.021 2.375 1.00 0.00 H new ATOM 0 HB3 LYS A 127 16.650 7.224 3.774 1.00 0.00 H new ATOM 0 HG2 LYS A 127 17.255 5.399 1.400 1.00 0.00 H new ATOM 0 HG3 LYS A 127 17.947 6.990 1.648 1.00 0.00 H new ATOM 0 HD2 LYS A 127 18.950 6.212 3.812 1.00 0.00 H new ATOM 0 HD3 LYS A 127 18.264 4.620 3.555 1.00 0.00 H new ATOM 0 HE2 LYS A 127 20.634 4.686 2.826 1.00 0.00 H new ATOM 0 HE3 LYS A 127 19.575 4.349 1.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 21.359 6.070 1.131 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 19.787 6.516 0.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 20.443 7.099 2.123 1.00 0.00 H new ATOM 66 N SER A 128 14.567 6.868 5.188 1.00 0.00 N ATOM 67 CA SER A 128 13.501 7.400 6.022 1.00 0.00 C ATOM 68 C SER A 128 13.577 8.915 6.060 1.00 0.00 C ATOM 69 O SER A 128 14.629 9.495 5.789 1.00 0.00 O ATOM 70 CB SER A 128 13.649 6.835 7.430 1.00 0.00 C ATOM 71 OG SER A 128 14.862 7.273 7.994 1.00 0.00 O ATOM 0 H SER A 128 15.404 7.451 5.167 1.00 0.00 H new ATOM 0 HA SER A 128 12.534 7.112 5.610 1.00 0.00 H new ATOM 0 HB2 SER A 128 12.812 7.156 8.050 1.00 0.00 H new ATOM 0 HB3 SER A 128 13.624 5.746 7.399 1.00 0.00 H new ATOM 0 HG SER A 128 14.952 6.909 8.899 1.00 0.00 H new ATOM 77 N MET A 129 12.451 9.551 6.400 1.00 0.00 N ATOM 78 CA MET A 129 12.351 10.995 6.524 1.00 0.00 C ATOM 79 C MET A 129 13.062 11.729 5.391 1.00 0.00 C ATOM 80 O MET A 129 13.686 12.768 5.609 1.00 0.00 O ATOM 81 CB MET A 129 12.870 11.403 7.902 1.00 0.00 C ATOM 82 CG MET A 129 11.971 10.807 8.986 1.00 0.00 C ATOM 83 SD MET A 129 12.528 11.128 10.678 1.00 0.00 S ATOM 84 CE MET A 129 14.057 10.156 10.680 1.00 0.00 C ATOM 0 H MET A 129 11.577 9.064 6.598 1.00 0.00 H new ATOM 0 HA MET A 129 11.305 11.289 6.436 1.00 0.00 H new ATOM 0 HB2 MET A 129 13.895 11.055 8.033 1.00 0.00 H new ATOM 0 HB3 MET A 129 12.889 12.489 7.988 1.00 0.00 H new ATOM 0 HG2 MET A 129 10.964 11.206 8.866 1.00 0.00 H new ATOM 0 HG3 MET A 129 11.907 9.729 8.836 1.00 0.00 H new ATOM 0 HE1 MET A 129 14.379 9.986 11.707 1.00 0.00 H new ATOM 0 HE2 MET A 129 13.880 9.198 10.192 1.00 0.00 H new ATOM 0 HE3 MET A 129 14.834 10.699 10.142 1.00 0.00 H new ATOM 94 N GLN A 130 12.975 11.176 4.178 1.00 0.00 N ATOM 95 CA GLN A 130 13.638 11.735 3.011 1.00 0.00 C ATOM 96 C GLN A 130 13.209 13.174 2.753 1.00 0.00 C ATOM 97 O GLN A 130 12.118 13.589 3.143 1.00 0.00 O ATOM 98 CB GLN A 130 13.342 10.872 1.787 1.00 0.00 C ATOM 99 CG GLN A 130 14.312 9.698 1.693 1.00 0.00 C ATOM 100 CD GLN A 130 15.686 10.141 1.204 1.00 0.00 C ATOM 101 OE1 GLN A 130 16.040 11.315 1.269 1.00 0.00 O ATOM 102 NE2 GLN A 130 16.480 9.201 0.698 1.00 0.00 N ATOM 0 H GLN A 130 12.442 10.329 3.984 1.00 0.00 H new ATOM 0 HA GLN A 130 14.711 11.741 3.205 1.00 0.00 H new ATOM 0 HB2 GLN A 130 12.319 10.499 1.840 1.00 0.00 H new ATOM 0 HB3 GLN A 130 13.413 11.479 0.885 1.00 0.00 H new ATOM 0 HG2 GLN A 130 14.408 9.226 2.671 1.00 0.00 H new ATOM 0 HG3 GLN A 130 13.909 8.946 1.014 1.00 0.00 H new ATOM 0 HE21 GLN A 130 16.161 8.233 0.656 1.00 0.00 H new ATOM 0 HE22 GLN A 130 17.407 9.448 0.352 1.00 0.00 H new ATOM 111 N LYS A 131 14.085 13.926 2.087 1.00 0.00 N ATOM 112 CA LYS A 131 13.841 15.315 1.739 1.00 0.00 C ATOM 113 C LYS A 131 12.839 15.390 0.591 1.00 0.00 C ATOM 114 O LYS A 131 12.528 14.377 -0.033 1.00 0.00 O ATOM 115 CB LYS A 131 15.152 15.988 1.328 1.00 0.00 C ATOM 116 CG LYS A 131 16.109 16.219 2.500 1.00 0.00 C ATOM 117 CD LYS A 131 16.730 14.947 3.088 1.00 0.00 C ATOM 118 CE LYS A 131 17.503 14.166 2.023 1.00 0.00 C ATOM 119 NZ LYS A 131 18.129 12.962 2.595 1.00 0.00 N ATOM 0 H LYS A 131 14.991 13.579 1.773 1.00 0.00 H new ATOM 0 HA LYS A 131 13.432 15.833 2.606 1.00 0.00 H new ATOM 0 HB2 LYS A 131 15.649 15.372 0.579 1.00 0.00 H new ATOM 0 HB3 LYS A 131 14.929 16.945 0.857 1.00 0.00 H new ATOM 0 HG2 LYS A 131 16.912 16.878 2.170 1.00 0.00 H new ATOM 0 HG3 LYS A 131 15.572 16.742 3.291 1.00 0.00 H new ATOM 0 HD2 LYS A 131 17.399 15.211 3.907 1.00 0.00 H new ATOM 0 HD3 LYS A 131 15.946 14.317 3.508 1.00 0.00 H new ATOM 0 HE2 LYS A 131 16.828 13.880 1.217 1.00 0.00 H new ATOM 0 HE3 LYS A 131 18.270 14.805 1.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 19.108 12.884 2.254 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 18.128 13.030 3.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 17.593 12.120 2.303 1.00 0.00 H new ATOM 133 N ARG A 132 12.344 16.602 0.322 1.00 0.00 N ATOM 134 CA ARG A 132 11.407 16.897 -0.754 1.00 0.00 C ATOM 135 C ARG A 132 10.299 15.845 -0.841 1.00 0.00 C ATOM 136 O ARG A 132 10.005 15.190 0.159 1.00 0.00 O ATOM 137 CB ARG A 132 12.217 17.097 -2.026 1.00 0.00 C ATOM 138 CG ARG A 132 13.232 18.214 -1.750 1.00 0.00 C ATOM 139 CD ARG A 132 13.910 18.678 -3.029 1.00 0.00 C ATOM 140 NE ARG A 132 15.050 19.550 -2.722 1.00 0.00 N ATOM 141 CZ ARG A 132 15.905 20.017 -3.636 1.00 0.00 C ATOM 142 NH1 ARG A 132 15.731 19.766 -4.926 1.00 0.00 N ATOM 143 NH2 ARG A 132 16.949 20.749 -3.254 1.00 0.00 N ATOM 0 H ARG A 132 12.595 17.427 0.867 1.00 0.00 H new ATOM 0 HA ARG A 132 10.858 17.820 -0.566 1.00 0.00 H new ATOM 0 HB2 ARG A 132 12.727 16.175 -2.306 1.00 0.00 H new ATOM 0 HB3 ARG A 132 11.566 17.366 -2.858 1.00 0.00 H new ATOM 0 HG2 ARG A 132 12.728 19.057 -1.278 1.00 0.00 H new ATOM 0 HG3 ARG A 132 13.984 17.858 -1.046 1.00 0.00 H new ATOM 0 HD2 ARG A 132 14.249 17.814 -3.601 1.00 0.00 H new ATOM 0 HD3 ARG A 132 13.194 19.213 -3.653 1.00 0.00 H new ATOM 0 HE ARG A 132 15.199 19.816 -1.749 1.00 0.00 H new ATOM 0 HH11 ARG A 132 14.934 19.208 -5.234 1.00 0.00 H new ATOM 0 HH12 ARG A 132 16.394 20.131 -5.610 1.00 0.00 H new ATOM 0 HH21 ARG A 132 17.095 20.952 -2.265 1.00 0.00 H new ATOM 0 HH22 ARG A 132 17.603 21.107 -3.950 1.00 0.00 H new ATOM 157 N ARG A 133 9.675 15.671 -2.010 1.00 0.00 N ATOM 158 CA ARG A 133 8.568 14.733 -2.143 1.00 0.00 C ATOM 159 C ARG A 133 9.030 13.339 -2.547 1.00 0.00 C ATOM 160 O ARG A 133 10.152 13.141 -3.010 1.00 0.00 O ATOM 161 CB ARG A 133 7.548 15.297 -3.132 1.00 0.00 C ATOM 162 CG ARG A 133 6.880 16.558 -2.577 1.00 0.00 C ATOM 163 CD ARG A 133 6.132 16.221 -1.285 1.00 0.00 C ATOM 164 NE ARG A 133 5.318 17.341 -0.810 1.00 0.00 N ATOM 165 CZ ARG A 133 4.549 17.261 0.280 1.00 0.00 C ATOM 166 NH1 ARG A 133 4.514 16.139 1.000 1.00 0.00 N ATOM 167 NH2 ARG A 133 3.808 18.295 0.658 1.00 0.00 N ATOM 0 H ARG A 133 9.919 16.165 -2.868 1.00 0.00 H new ATOM 0 HA ARG A 133 8.097 14.617 -1.167 1.00 0.00 H new ATOM 0 HB2 ARG A 133 8.042 15.529 -4.076 1.00 0.00 H new ATOM 0 HB3 ARG A 133 6.789 14.544 -3.346 1.00 0.00 H new ATOM 0 HG2 ARG A 133 7.631 17.324 -2.384 1.00 0.00 H new ATOM 0 HG3 ARG A 133 6.188 16.968 -3.313 1.00 0.00 H new ATOM 0 HD2 ARG A 133 5.492 15.354 -1.453 1.00 0.00 H new ATOM 0 HD3 ARG A 133 6.850 15.943 -0.513 1.00 0.00 H new ATOM 0 HE ARG A 133 5.339 18.217 -1.332 1.00 0.00 H new ATOM 0 HH11 ARG A 133 5.076 15.335 0.720 1.00 0.00 H new ATOM 0 HH12 ARG A 133 3.925 16.084 1.831 1.00 0.00 H new ATOM 0 HH21 ARG A 133 3.823 19.159 0.115 1.00 0.00 H new ATOM 0 HH22 ARG A 133 3.224 18.226 1.491 1.00 0.00 H new ATOM 181 N SER A 134 8.120 12.373 -2.359 1.00 0.00 N ATOM 182 CA SER A 134 8.344 10.962 -2.631 1.00 0.00 C ATOM 183 C SER A 134 8.698 10.706 -4.094 1.00 0.00 C ATOM 184 O SER A 134 8.433 11.535 -4.960 1.00 0.00 O ATOM 185 CB SER A 134 7.097 10.186 -2.216 1.00 0.00 C ATOM 186 OG SER A 134 7.254 8.805 -2.459 1.00 0.00 O ATOM 0 H SER A 134 7.184 12.566 -2.003 1.00 0.00 H new ATOM 0 HA SER A 134 9.202 10.621 -2.052 1.00 0.00 H new ATOM 0 HB2 SER A 134 6.897 10.352 -1.157 1.00 0.00 H new ATOM 0 HB3 SER A 134 6.233 10.559 -2.766 1.00 0.00 H new ATOM 0 HG SER A 134 7.118 8.623 -3.412 1.00 0.00 H new ATOM 192 N LYS A 135 9.299 9.547 -4.374 1.00 0.00 N ATOM 193 CA LYS A 135 9.763 9.189 -5.705 1.00 0.00 C ATOM 194 C LYS A 135 9.662 7.684 -5.928 1.00 0.00 C ATOM 195 O LYS A 135 9.502 6.919 -4.978 1.00 0.00 O ATOM 196 CB LYS A 135 11.195 9.676 -5.878 1.00 0.00 C ATOM 197 CG LYS A 135 12.149 9.017 -4.886 1.00 0.00 C ATOM 198 CD LYS A 135 13.557 9.481 -5.224 1.00 0.00 C ATOM 199 CE LYS A 135 13.763 10.962 -4.895 1.00 0.00 C ATOM 200 NZ LYS A 135 13.645 11.215 -3.450 1.00 0.00 N ATOM 0 H LYS A 135 9.476 8.828 -3.673 1.00 0.00 H new ATOM 0 HA LYS A 135 9.130 9.669 -6.452 1.00 0.00 H new ATOM 0 HB2 LYS A 135 11.528 9.467 -6.894 1.00 0.00 H new ATOM 0 HB3 LYS A 135 11.228 10.758 -5.748 1.00 0.00 H new ATOM 0 HG2 LYS A 135 11.890 9.294 -3.864 1.00 0.00 H new ATOM 0 HG3 LYS A 135 12.078 7.931 -4.950 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.280 8.882 -4.670 1.00 0.00 H new ATOM 0 HD3 LYS A 135 13.750 9.314 -6.284 1.00 0.00 H new ATOM 0 HE2 LYS A 135 14.746 11.279 -5.242 1.00 0.00 H new ATOM 0 HE3 LYS A 135 13.027 11.561 -5.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 12.941 11.962 -3.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 13.345 10.343 -2.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 14.566 11.519 -3.074 1.00 0.00 H new ATOM 214 N GLY A 136 9.757 7.251 -7.190 1.00 0.00 N ATOM 215 CA GLY A 136 9.701 5.839 -7.539 1.00 0.00 C ATOM 216 C GLY A 136 8.322 5.233 -7.276 1.00 0.00 C ATOM 217 O GLY A 136 8.177 4.015 -7.304 1.00 0.00 O ATOM 0 H GLY A 136 9.874 7.872 -7.991 1.00 0.00 H new ATOM 0 HA2 GLY A 136 9.955 5.716 -8.592 1.00 0.00 H new ATOM 0 HA3 GLY A 136 10.451 5.295 -6.965 1.00 0.00 H new ATOM 221 N ASP A 137 7.321 6.074 -7.020 1.00 0.00 N ATOM 222 CA ASP A 137 5.954 5.659 -6.737 1.00 0.00 C ATOM 223 C ASP A 137 5.278 5.034 -7.960 1.00 0.00 C ATOM 224 O ASP A 137 5.852 4.966 -9.048 1.00 0.00 O ATOM 225 CB ASP A 137 5.177 6.875 -6.236 1.00 0.00 C ATOM 226 CG ASP A 137 5.705 7.315 -4.879 1.00 0.00 C ATOM 227 OD1 ASP A 137 5.514 6.541 -3.910 1.00 0.00 O ATOM 228 OD2 ASP A 137 6.293 8.418 -4.821 1.00 0.00 O ATOM 0 H ASP A 137 7.444 7.086 -7.004 1.00 0.00 H new ATOM 0 HA ASP A 137 5.967 4.884 -5.971 1.00 0.00 H new ATOM 0 HB2 ASP A 137 5.266 7.693 -6.951 1.00 0.00 H new ATOM 0 HB3 ASP A 137 4.117 6.632 -6.160 1.00 0.00 H new ATOM 233 N ARG A 138 4.038 4.574 -7.765 1.00 0.00 N ATOM 234 CA ARG A 138 3.244 3.859 -8.757 1.00 0.00 C ATOM 235 C ARG A 138 1.783 4.298 -8.681 1.00 0.00 C ATOM 236 O ARG A 138 1.435 5.107 -7.822 1.00 0.00 O ATOM 237 CB ARG A 138 3.356 2.359 -8.462 1.00 0.00 C ATOM 238 CG ARG A 138 4.672 1.806 -9.013 1.00 0.00 C ATOM 239 CD ARG A 138 4.920 0.378 -8.526 1.00 0.00 C ATOM 240 NE ARG A 138 4.893 0.282 -7.060 1.00 0.00 N ATOM 241 CZ ARG A 138 5.800 0.836 -6.246 1.00 0.00 C ATOM 242 NH1 ARG A 138 6.855 1.487 -6.730 1.00 0.00 N ATOM 243 NH2 ARG A 138 5.653 0.740 -4.933 1.00 0.00 N ATOM 0 H ARG A 138 3.547 4.696 -6.880 1.00 0.00 H new ATOM 0 HA ARG A 138 3.612 4.077 -9.759 1.00 0.00 H new ATOM 0 HB2 ARG A 138 3.304 2.188 -7.387 1.00 0.00 H new ATOM 0 HB3 ARG A 138 2.515 1.830 -8.910 1.00 0.00 H new ATOM 0 HG2 ARG A 138 4.648 1.822 -10.103 1.00 0.00 H new ATOM 0 HG3 ARG A 138 5.497 2.447 -8.703 1.00 0.00 H new ATOM 0 HD2 ARG A 138 4.163 -0.285 -8.946 1.00 0.00 H new ATOM 0 HD3 ARG A 138 5.886 0.033 -8.894 1.00 0.00 H new ATOM 0 HE ARG A 138 4.130 -0.243 -6.633 1.00 0.00 H new ATOM 0 HH11 ARG A 138 6.984 1.571 -7.738 1.00 0.00 H new ATOM 0 HH12 ARG A 138 7.535 1.902 -6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 138 4.850 0.245 -4.545 1.00 0.00 H new ATOM 0 HH22 ARG A 138 6.343 1.161 -4.310 1.00 0.00 H new ATOM 257 N CYS A 139 0.932 3.774 -9.567 1.00 0.00 N ATOM 258 CA CYS A 139 -0.508 3.986 -9.556 1.00 0.00 C ATOM 259 C CYS A 139 -1.028 3.828 -8.133 1.00 0.00 C ATOM 260 O CYS A 139 -1.075 2.724 -7.591 1.00 0.00 O ATOM 261 CB CYS A 139 -1.178 3.000 -10.527 1.00 0.00 C ATOM 262 SG CYS A 139 -2.965 2.917 -10.255 1.00 0.00 S ATOM 0 H CYS A 139 1.240 3.174 -10.332 1.00 0.00 H new ATOM 0 HA CYS A 139 -0.748 4.995 -9.890 1.00 0.00 H new ATOM 0 HB2 CYS A 139 -0.979 3.306 -11.554 1.00 0.00 H new ATOM 0 HB3 CYS A 139 -0.743 2.009 -10.400 1.00 0.00 H new ATOM 267 N TYR A 140 -1.424 4.951 -7.529 1.00 0.00 N ATOM 268 CA TYR A 140 -1.941 4.980 -6.173 1.00 0.00 C ATOM 269 C TYR A 140 -3.317 4.314 -6.066 1.00 0.00 C ATOM 270 O TYR A 140 -3.985 4.462 -5.043 1.00 0.00 O ATOM 271 CB TYR A 140 -1.987 6.432 -5.698 1.00 0.00 C ATOM 272 CG TYR A 140 -0.627 6.976 -5.332 1.00 0.00 C ATOM 273 CD1 TYR A 140 0.077 6.418 -4.251 1.00 0.00 C ATOM 274 CD2 TYR A 140 -0.069 8.029 -6.065 1.00 0.00 C ATOM 275 CE1 TYR A 140 1.333 6.930 -3.892 1.00 0.00 C ATOM 276 CE2 TYR A 140 1.194 8.533 -5.719 1.00 0.00 C ATOM 277 CZ TYR A 140 1.887 8.004 -4.616 1.00 0.00 C ATOM 278 OH TYR A 140 3.084 8.538 -4.251 1.00 0.00 O ATOM 0 H TYR A 140 -1.392 5.867 -7.976 1.00 0.00 H new ATOM 0 HA TYR A 140 -1.276 4.404 -5.529 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -2.421 7.052 -6.483 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -2.646 6.505 -4.833 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -0.349 5.595 -3.697 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -0.610 8.454 -6.897 1.00 0.00 H new ATOM 0 HE1 TYR A 140 1.874 6.501 -3.062 1.00 0.00 H new ATOM 0 HE2 TYR A 140 1.635 9.329 -6.301 1.00 0.00 H new ATOM 0 HH TYR A 140 3.315 9.269 -4.861 1.00 0.00 H new ATOM 288 N ASN A 141 -3.752 3.591 -7.105 1.00 0.00 N ATOM 289 CA ASN A 141 -5.040 2.922 -7.095 1.00 0.00 C ATOM 290 C ASN A 141 -4.889 1.404 -7.219 1.00 0.00 C ATOM 291 O ASN A 141 -5.718 0.675 -6.676 1.00 0.00 O ATOM 292 CB ASN A 141 -5.896 3.469 -8.233 1.00 0.00 C ATOM 293 CG ASN A 141 -7.320 2.950 -8.158 1.00 0.00 C ATOM 294 OD1 ASN A 141 -8.168 3.547 -7.504 1.00 0.00 O ATOM 295 ND2 ASN A 141 -7.597 1.839 -8.826 1.00 0.00 N ATOM 0 H ASN A 141 -3.220 3.459 -7.965 1.00 0.00 H new ATOM 0 HA ASN A 141 -5.527 3.119 -6.140 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -5.902 4.558 -8.194 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -5.455 3.187 -9.189 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -8.541 1.454 -8.806 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -6.866 1.369 -9.360 1.00 0.00 H new ATOM 302 N CYS A 142 -3.859 0.918 -7.925 1.00 0.00 N ATOM 303 CA CYS A 142 -3.637 -0.509 -8.086 1.00 0.00 C ATOM 304 C CYS A 142 -2.231 -0.920 -7.673 1.00 0.00 C ATOM 305 O CYS A 142 -2.042 -1.980 -7.074 1.00 0.00 O ATOM 306 CB CYS A 142 -3.959 -0.902 -9.521 1.00 0.00 C ATOM 307 SG CYS A 142 -2.603 -0.477 -10.623 1.00 0.00 S ATOM 0 H CYS A 142 -3.167 1.504 -8.393 1.00 0.00 H new ATOM 0 HA CYS A 142 -4.305 -1.051 -7.417 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -4.154 -1.973 -9.574 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -4.869 -0.396 -9.845 1.00 0.00 H new ATOM 312 N GLY A 143 -1.248 -0.077 -8.003 1.00 0.00 N ATOM 313 CA GLY A 143 0.155 -0.337 -7.715 1.00 0.00 C ATOM 314 C GLY A 143 0.940 -0.621 -8.990 1.00 0.00 C ATOM 315 O GLY A 143 2.062 -1.113 -8.920 1.00 0.00 O ATOM 0 H GLY A 143 -1.410 0.810 -8.481 1.00 0.00 H new ATOM 0 HA2 GLY A 143 0.588 0.522 -7.203 1.00 0.00 H new ATOM 0 HA3 GLY A 143 0.238 -1.187 -7.038 1.00 0.00 H new ATOM 319 N GLY A 144 0.363 -0.314 -10.160 1.00 0.00 N ATOM 320 CA GLY A 144 1.026 -0.478 -11.445 1.00 0.00 C ATOM 321 C GLY A 144 1.923 0.709 -11.765 1.00 0.00 C ATOM 322 O GLY A 144 1.826 1.745 -11.120 1.00 0.00 O ATOM 0 H GLY A 144 -0.584 0.057 -10.233 1.00 0.00 H new ATOM 0 HA2 GLY A 144 1.620 -1.392 -11.435 1.00 0.00 H new ATOM 0 HA3 GLY A 144 0.278 -0.592 -12.230 1.00 0.00 H new ATOM 326 N LEU A 145 2.803 0.568 -12.759 1.00 0.00 N ATOM 327 CA LEU A 145 3.792 1.588 -13.074 1.00 0.00 C ATOM 328 C LEU A 145 3.573 2.148 -14.473 1.00 0.00 C ATOM 329 O LEU A 145 3.961 3.281 -14.757 1.00 0.00 O ATOM 330 CB LEU A 145 5.227 1.036 -12.982 1.00 0.00 C ATOM 331 CG LEU A 145 5.338 -0.484 -13.070 1.00 0.00 C ATOM 332 CD1 LEU A 145 6.753 -0.880 -13.482 1.00 0.00 C ATOM 333 CD2 LEU A 145 5.036 -1.099 -11.706 1.00 0.00 C ATOM 0 H LEU A 145 2.846 -0.253 -13.362 1.00 0.00 H new ATOM 0 HA LEU A 145 3.668 2.381 -12.337 1.00 0.00 H new ATOM 0 HB2 LEU A 145 5.822 1.476 -13.782 1.00 0.00 H new ATOM 0 HB3 LEU A 145 5.667 1.364 -12.040 1.00 0.00 H new ATOM 0 HG LEU A 145 4.625 -0.846 -13.810 1.00 0.00 H new ATOM 0 HD11 LEU A 145 6.824 -1.966 -13.542 1.00 0.00 H new ATOM 0 HD12 LEU A 145 6.983 -0.447 -14.455 1.00 0.00 H new ATOM 0 HD13 LEU A 145 7.464 -0.511 -12.743 1.00 0.00 H new ATOM 0 HD21 LEU A 145 5.116 -2.184 -11.770 1.00 0.00 H new ATOM 0 HD22 LEU A 145 5.750 -0.726 -10.972 1.00 0.00 H new ATOM 0 HD23 LEU A 145 4.026 -0.827 -11.400 1.00 0.00 H new ATOM 345 N ASP A 146 2.953 1.353 -15.347 1.00 0.00 N ATOM 346 CA ASP A 146 2.700 1.724 -16.727 1.00 0.00 C ATOM 347 C ASP A 146 1.575 2.759 -16.833 1.00 0.00 C ATOM 348 O ASP A 146 1.212 3.184 -17.927 1.00 0.00 O ATOM 349 CB ASP A 146 2.388 0.441 -17.497 1.00 0.00 C ATOM 350 CG ASP A 146 2.064 0.691 -18.962 1.00 0.00 C ATOM 351 OD1 ASP A 146 2.904 1.309 -19.649 1.00 0.00 O ATOM 352 OD2 ASP A 146 0.966 0.258 -19.381 1.00 0.00 O ATOM 0 H ASP A 146 2.611 0.423 -15.106 1.00 0.00 H new ATOM 0 HA ASP A 146 3.577 2.205 -17.161 1.00 0.00 H new ATOM 0 HB2 ASP A 146 3.242 -0.233 -17.429 1.00 0.00 H new ATOM 0 HB3 ASP A 146 1.545 -0.064 -17.025 1.00 0.00 H new ATOM 357 N HIS A 147 1.008 3.171 -15.693 1.00 0.00 N ATOM 358 CA HIS A 147 -0.091 4.121 -15.647 1.00 0.00 C ATOM 359 C HIS A 147 -0.143 4.796 -14.275 1.00 0.00 C ATOM 360 O HIS A 147 0.760 4.621 -13.457 1.00 0.00 O ATOM 361 CB HIS A 147 -1.397 3.382 -15.938 1.00 0.00 C ATOM 362 CG HIS A 147 -1.699 2.303 -14.936 1.00 0.00 C ATOM 363 ND1 HIS A 147 -1.187 1.027 -14.921 1.00 0.00 N ATOM 364 CD2 HIS A 147 -2.538 2.413 -13.865 1.00 0.00 C ATOM 365 CE1 HIS A 147 -1.697 0.390 -13.853 1.00 0.00 C ATOM 366 NE2 HIS A 147 -2.544 1.195 -13.184 1.00 0.00 N ATOM 0 H HIS A 147 1.307 2.847 -14.773 1.00 0.00 H new ATOM 0 HA HIS A 147 0.056 4.896 -16.399 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -2.218 4.099 -15.950 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -1.344 2.941 -16.933 1.00 0.00 H new ATOM 0 HD1 HIS A 147 -0.536 0.634 -15.600 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -3.101 3.293 -13.591 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -1.461 -0.625 -13.571 1.00 0.00 H new ATOM 374 N HIS A 148 -1.209 5.566 -14.032 1.00 0.00 N ATOM 375 CA HIS A 148 -1.435 6.262 -12.774 1.00 0.00 C ATOM 376 C HIS A 148 -2.853 5.994 -12.272 1.00 0.00 C ATOM 377 O HIS A 148 -3.683 5.459 -13.005 1.00 0.00 O ATOM 378 CB HIS A 148 -1.218 7.762 -12.981 1.00 0.00 C ATOM 379 CG HIS A 148 0.219 8.151 -13.216 1.00 0.00 C ATOM 380 ND1 HIS A 148 0.659 9.056 -14.185 1.00 0.00 N ATOM 381 CD2 HIS A 148 1.296 7.687 -12.517 1.00 0.00 C ATOM 382 CE1 HIS A 148 1.991 9.129 -14.027 1.00 0.00 C ATOM 383 NE2 HIS A 148 2.402 8.320 -13.036 1.00 0.00 N ATOM 0 H HIS A 148 -1.947 5.721 -14.719 1.00 0.00 H new ATOM 0 HA HIS A 148 -0.731 5.897 -12.026 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -1.815 8.090 -13.832 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -1.589 8.296 -12.106 1.00 0.00 H new ATOM 0 HD2 HIS A 148 1.283 6.965 -11.714 1.00 0.00 H new ATOM 0 HE1 HIS A 148 2.644 9.754 -14.618 1.00 0.00 H new ATOM 0 HE2 HIS A 148 3.365 8.197 -12.723 1.00 0.00 H new ATOM 391 N ALA A 149 -3.136 6.371 -11.021 1.00 0.00 N ATOM 392 CA ALA A 149 -4.411 6.096 -10.368 1.00 0.00 C ATOM 393 C ALA A 149 -5.596 6.659 -11.156 1.00 0.00 C ATOM 394 O ALA A 149 -6.694 6.105 -11.118 1.00 0.00 O ATOM 395 CB ALA A 149 -4.371 6.716 -8.971 1.00 0.00 C ATOM 0 H ALA A 149 -2.477 6.880 -10.431 1.00 0.00 H new ATOM 0 HA ALA A 149 -4.552 5.017 -10.313 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.315 6.524 -8.461 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -3.554 6.275 -8.400 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -4.216 7.792 -9.055 1.00 0.00 H new ATOM 401 N LYS A 150 -5.373 7.761 -11.877 1.00 0.00 N ATOM 402 CA LYS A 150 -6.397 8.413 -12.687 1.00 0.00 C ATOM 403 C LYS A 150 -6.595 7.713 -14.028 1.00 0.00 C ATOM 404 O LYS A 150 -7.575 7.959 -14.725 1.00 0.00 O ATOM 405 CB LYS A 150 -5.991 9.865 -12.901 1.00 0.00 C ATOM 406 CG LYS A 150 -4.628 9.972 -13.592 1.00 0.00 C ATOM 407 CD LYS A 150 -4.021 11.355 -13.375 1.00 0.00 C ATOM 408 CE LYS A 150 -3.645 11.495 -11.903 1.00 0.00 C ATOM 409 NZ LYS A 150 -3.074 12.825 -11.627 1.00 0.00 N ATOM 0 H LYS A 150 -4.467 8.228 -11.913 1.00 0.00 H new ATOM 0 HA LYS A 150 -7.349 8.359 -12.159 1.00 0.00 H new ATOM 0 HB2 LYS A 150 -6.746 10.370 -13.504 1.00 0.00 H new ATOM 0 HB3 LYS A 150 -5.954 10.379 -11.940 1.00 0.00 H new ATOM 0 HG2 LYS A 150 -3.955 9.209 -13.201 1.00 0.00 H new ATOM 0 HG3 LYS A 150 -4.740 9.782 -14.659 1.00 0.00 H new ATOM 0 HD2 LYS A 150 -3.141 11.485 -14.004 1.00 0.00 H new ATOM 0 HD3 LYS A 150 -4.733 12.130 -13.659 1.00 0.00 H new ATOM 0 HE2 LYS A 150 -4.527 11.338 -11.282 1.00 0.00 H new ATOM 0 HE3 LYS A 150 -2.924 10.723 -11.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 -2.321 12.739 -10.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 -2.678 13.221 -12.503 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 -3.819 13.455 -11.268 1.00 0.00 H new ATOM 423 N GLU A 151 -5.655 6.837 -14.373 1.00 0.00 N ATOM 424 CA GLU A 151 -5.710 6.049 -15.598 1.00 0.00 C ATOM 425 C GLU A 151 -5.993 4.577 -15.297 1.00 0.00 C ATOM 426 O GLU A 151 -6.163 3.769 -16.210 1.00 0.00 O ATOM 427 CB GLU A 151 -4.385 6.145 -16.341 1.00 0.00 C ATOM 428 CG GLU A 151 -3.844 7.571 -16.336 1.00 0.00 C ATOM 429 CD GLU A 151 -2.643 7.700 -17.266 1.00 0.00 C ATOM 430 OE1 GLU A 151 -1.656 6.964 -17.042 1.00 0.00 O ATOM 431 OE2 GLU A 151 -2.725 8.538 -18.195 1.00 0.00 O ATOM 0 H GLU A 151 -4.828 6.654 -13.805 1.00 0.00 H new ATOM 0 HA GLU A 151 -6.517 6.450 -16.211 1.00 0.00 H new ATOM 0 HB2 GLU A 151 -3.658 5.477 -15.879 1.00 0.00 H new ATOM 0 HB3 GLU A 151 -4.518 5.809 -17.369 1.00 0.00 H new ATOM 0 HG2 GLU A 151 -4.627 8.262 -16.648 1.00 0.00 H new ATOM 0 HG3 GLU A 151 -3.556 7.852 -15.323 1.00 0.00 H new ATOM 438 N CYS A 152 -6.050 4.224 -14.007 1.00 0.00 N ATOM 439 CA CYS A 152 -6.281 2.862 -13.565 1.00 0.00 C ATOM 440 C CYS A 152 -7.620 2.332 -14.084 1.00 0.00 C ATOM 441 O CYS A 152 -8.479 3.104 -14.506 1.00 0.00 O ATOM 442 CB CYS A 152 -6.199 2.820 -12.042 1.00 0.00 C ATOM 443 SG CYS A 152 -5.716 1.154 -11.559 1.00 0.00 S ATOM 0 H CYS A 152 -5.935 4.888 -13.242 1.00 0.00 H new ATOM 0 HA CYS A 152 -5.513 2.206 -13.976 1.00 0.00 H new ATOM 0 HB2 CYS A 152 -5.473 3.548 -11.679 1.00 0.00 H new ATOM 0 HB3 CYS A 152 -7.161 3.081 -11.601 1.00 0.00 H new ATOM 448 N LYS A 153 -7.793 1.012 -14.047 1.00 0.00 N ATOM 449 CA LYS A 153 -8.938 0.351 -14.670 1.00 0.00 C ATOM 450 C LYS A 153 -9.693 -0.565 -13.711 1.00 0.00 C ATOM 451 O LYS A 153 -10.670 -1.204 -14.101 1.00 0.00 O ATOM 452 CB LYS A 153 -8.496 -0.397 -15.928 1.00 0.00 C ATOM 453 CG LYS A 153 -7.130 -1.080 -15.813 1.00 0.00 C ATOM 454 CD LYS A 153 -7.096 -2.152 -14.729 1.00 0.00 C ATOM 455 CE LYS A 153 -8.077 -3.281 -15.020 1.00 0.00 C ATOM 456 NZ LYS A 153 -7.617 -4.143 -16.126 1.00 0.00 N ATOM 0 H LYS A 153 -7.146 0.373 -13.586 1.00 0.00 H new ATOM 0 HA LYS A 153 -9.645 1.131 -14.954 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -9.246 -1.150 -16.170 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -8.468 0.304 -16.762 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -6.872 -1.530 -16.771 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -6.370 -0.329 -15.599 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -6.087 -2.558 -14.650 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -7.335 -1.702 -13.765 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -8.212 -3.884 -14.122 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -9.051 -2.860 -15.270 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -8.297 -4.917 -16.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -7.545 -3.581 -16.998 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -6.684 -4.540 -15.892 1.00 0.00 H new ATOM 470 N LEU A 154 -9.239 -0.629 -12.462 1.00 0.00 N ATOM 471 CA LEU A 154 -9.873 -1.421 -11.416 1.00 0.00 C ATOM 472 C LEU A 154 -10.321 -0.499 -10.283 1.00 0.00 C ATOM 473 O LEU A 154 -9.910 0.661 -10.231 1.00 0.00 O ATOM 474 CB LEU A 154 -8.925 -2.554 -10.986 1.00 0.00 C ATOM 475 CG LEU A 154 -7.483 -2.122 -10.759 1.00 0.00 C ATOM 476 CD1 LEU A 154 -7.422 -1.320 -9.475 1.00 0.00 C ATOM 477 CD2 LEU A 154 -6.605 -3.350 -10.597 1.00 0.00 C ATOM 0 H LEU A 154 -8.410 -0.126 -12.146 1.00 0.00 H new ATOM 0 HA LEU A 154 -10.777 -1.911 -11.778 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.306 -3.000 -10.067 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -8.941 -3.333 -11.748 1.00 0.00 H new ATOM 0 HG LEU A 154 -7.137 -1.529 -11.606 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.396 -1.001 -9.294 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -8.065 -0.444 -9.562 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.762 -1.938 -8.644 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -5.573 -3.040 -10.435 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -6.948 -3.932 -9.742 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -6.663 -3.960 -11.498 1.00 0.00 H new ATOM 489 N PRO A 155 -11.174 -0.987 -9.366 1.00 0.00 N ATOM 490 CA PRO A 155 -11.666 -0.198 -8.251 1.00 0.00 C ATOM 491 C PRO A 155 -10.520 0.119 -7.290 1.00 0.00 C ATOM 492 O PRO A 155 -9.442 -0.455 -7.418 1.00 0.00 O ATOM 493 CB PRO A 155 -12.750 -1.056 -7.597 1.00 0.00 C ATOM 494 CG PRO A 155 -12.337 -2.480 -7.955 1.00 0.00 C ATOM 495 CD PRO A 155 -11.722 -2.328 -9.345 1.00 0.00 C ATOM 0 HA PRO A 155 -12.073 0.765 -8.560 1.00 0.00 H new ATOM 0 HB2 PRO A 155 -12.784 -0.907 -6.518 1.00 0.00 H new ATOM 0 HB3 PRO A 155 -13.740 -0.816 -7.983 1.00 0.00 H new ATOM 0 HG2 PRO A 155 -11.620 -2.883 -7.240 1.00 0.00 H new ATOM 0 HG3 PRO A 155 -13.192 -3.156 -7.965 1.00 0.00 H new ATOM 0 HD2 PRO A 155 -10.947 -3.074 -9.518 1.00 0.00 H new ATOM 0 HD3 PRO A 155 -12.471 -2.461 -10.125 1.00 0.00 H new ATOM 503 N PRO A 156 -10.724 1.029 -6.331 1.00 0.00 N ATOM 504 CA PRO A 156 -9.673 1.480 -5.439 1.00 0.00 C ATOM 505 C PRO A 156 -9.170 0.341 -4.557 1.00 0.00 C ATOM 506 O PRO A 156 -9.826 -0.047 -3.587 1.00 0.00 O ATOM 507 CB PRO A 156 -10.284 2.629 -4.635 1.00 0.00 C ATOM 508 CG PRO A 156 -11.781 2.329 -4.669 1.00 0.00 C ATOM 509 CD PRO A 156 -11.978 1.692 -6.040 1.00 0.00 C ATOM 0 HA PRO A 156 -8.791 1.820 -5.982 1.00 0.00 H new ATOM 0 HB2 PRO A 156 -9.902 2.653 -3.614 1.00 0.00 H new ATOM 0 HB3 PRO A 156 -10.058 3.597 -5.082 1.00 0.00 H new ATOM 0 HG2 PRO A 156 -12.075 1.654 -3.865 1.00 0.00 H new ATOM 0 HG3 PRO A 156 -12.376 3.235 -4.557 1.00 0.00 H new ATOM 0 HD2 PRO A 156 -12.806 0.983 -6.030 1.00 0.00 H new ATOM 0 HD3 PRO A 156 -12.211 2.444 -6.794 1.00 0.00 H new ATOM 517 N GLN A 157 -7.991 -0.189 -4.893 1.00 0.00 N ATOM 518 CA GLN A 157 -7.361 -1.240 -4.115 1.00 0.00 C ATOM 519 C GLN A 157 -6.743 -0.636 -2.864 1.00 0.00 C ATOM 520 O GLN A 157 -6.469 0.563 -2.837 1.00 0.00 O ATOM 521 CB GLN A 157 -6.256 -1.908 -4.934 1.00 0.00 C ATOM 522 CG GLN A 157 -6.776 -2.379 -6.289 1.00 0.00 C ATOM 523 CD GLN A 157 -7.862 -3.435 -6.161 1.00 0.00 C ATOM 524 OE1 GLN A 157 -7.717 -4.407 -5.424 1.00 0.00 O ATOM 525 NE2 GLN A 157 -8.964 -3.247 -6.875 1.00 0.00 N ATOM 0 H GLN A 157 -7.454 0.102 -5.710 1.00 0.00 H new ATOM 0 HA GLN A 157 -8.114 -1.981 -3.846 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -5.435 -1.206 -5.081 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -5.854 -2.757 -4.381 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -7.168 -1.525 -6.841 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -5.948 -2.783 -6.872 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -9.048 -2.427 -7.476 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -9.727 -3.922 -6.823 1.00 0.00 H new ATOM 534 N PRO A 158 -6.519 -1.449 -1.832 1.00 0.00 N ATOM 535 CA PRO A 158 -5.816 -1.019 -0.648 1.00 0.00 C ATOM 536 C PRO A 158 -4.322 -0.949 -0.943 1.00 0.00 C ATOM 537 O PRO A 158 -3.730 -1.909 -1.439 1.00 0.00 O ATOM 538 CB PRO A 158 -6.140 -2.078 0.403 1.00 0.00 C ATOM 539 CG PRO A 158 -6.317 -3.349 -0.429 1.00 0.00 C ATOM 540 CD PRO A 158 -6.925 -2.838 -1.739 1.00 0.00 C ATOM 0 HA PRO A 158 -6.110 -0.027 -0.306 1.00 0.00 H new ATOM 0 HB2 PRO A 158 -5.336 -2.182 1.132 1.00 0.00 H new ATOM 0 HB3 PRO A 158 -7.044 -1.831 0.959 1.00 0.00 H new ATOM 0 HG2 PRO A 158 -5.366 -3.854 -0.598 1.00 0.00 H new ATOM 0 HG3 PRO A 158 -6.974 -4.064 0.066 1.00 0.00 H new ATOM 0 HD2 PRO A 158 -6.562 -3.412 -2.592 1.00 0.00 H new ATOM 0 HD3 PRO A 158 -8.011 -2.931 -1.731 1.00 0.00 H new ATOM 548 N LYS A 159 -3.719 0.195 -0.633 1.00 0.00 N ATOM 549 CA LYS A 159 -2.295 0.410 -0.826 1.00 0.00 C ATOM 550 C LYS A 159 -1.538 -0.307 0.287 1.00 0.00 C ATOM 551 O LYS A 159 -1.466 0.160 1.421 1.00 0.00 O ATOM 552 CB LYS A 159 -1.973 1.906 -0.924 1.00 0.00 C ATOM 553 CG LYS A 159 -2.549 2.745 0.220 1.00 0.00 C ATOM 554 CD LYS A 159 -2.045 4.184 0.102 1.00 0.00 C ATOM 555 CE LYS A 159 -1.226 4.531 1.342 1.00 0.00 C ATOM 556 NZ LYS A 159 -2.084 4.667 2.531 1.00 0.00 N ATOM 0 H LYS A 159 -4.209 0.999 -0.240 1.00 0.00 H new ATOM 0 HA LYS A 159 -1.970 -0.015 -1.776 1.00 0.00 H new ATOM 0 HB2 LYS A 159 -0.891 2.033 -0.945 1.00 0.00 H new ATOM 0 HB3 LYS A 159 -2.357 2.288 -1.870 1.00 0.00 H new ATOM 0 HG2 LYS A 159 -3.638 2.726 0.186 1.00 0.00 H new ATOM 0 HG3 LYS A 159 -2.253 2.322 1.180 1.00 0.00 H new ATOM 0 HD2 LYS A 159 -1.435 4.296 -0.795 1.00 0.00 H new ATOM 0 HD3 LYS A 159 -2.886 4.870 0.003 1.00 0.00 H new ATOM 0 HE2 LYS A 159 -0.480 3.755 1.516 1.00 0.00 H new ATOM 0 HE3 LYS A 159 -0.684 5.462 1.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 -1.624 4.212 3.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 -2.234 5.675 2.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 -3.001 4.210 2.352 1.00 0.00 H new ATOM 570 N LYS A 160 -0.970 -1.463 -0.044 1.00 0.00 N ATOM 571 CA LYS A 160 -0.273 -2.308 0.912 1.00 0.00 C ATOM 572 C LYS A 160 1.065 -1.713 1.324 1.00 0.00 C ATOM 573 O LYS A 160 1.602 -0.833 0.655 1.00 0.00 O ATOM 574 CB LYS A 160 -0.021 -3.665 0.256 1.00 0.00 C ATOM 575 CG LYS A 160 -1.317 -4.402 -0.053 1.00 0.00 C ATOM 576 CD LYS A 160 -1.125 -5.416 -1.172 1.00 0.00 C ATOM 577 CE LYS A 160 -2.405 -5.409 -2.009 1.00 0.00 C ATOM 578 NZ LYS A 160 -2.280 -6.265 -3.196 1.00 0.00 N ATOM 0 H LYS A 160 -0.982 -1.840 -0.992 1.00 0.00 H new ATOM 0 HA LYS A 160 -0.891 -2.400 1.805 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.543 -3.522 -0.666 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.595 -4.277 0.915 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -1.671 -4.910 0.844 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -2.087 -3.685 -0.338 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.262 -5.155 -1.785 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.937 -6.409 -0.764 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -3.241 -5.752 -1.399 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -2.633 -4.389 -2.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -3.166 -6.236 -3.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.498 -5.923 -3.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.087 -7.243 -2.900 1.00 0.00 H new ATOM 592 N CYS A 161 1.595 -2.217 2.436 1.00 0.00 N ATOM 593 CA CYS A 161 2.938 -1.922 2.890 1.00 0.00 C ATOM 594 C CYS A 161 3.934 -2.243 1.768 1.00 0.00 C ATOM 595 O CYS A 161 3.934 -3.355 1.240 1.00 0.00 O ATOM 596 CB CYS A 161 3.173 -2.767 4.144 1.00 0.00 C ATOM 597 SG CYS A 161 4.865 -2.645 4.766 1.00 0.00 S ATOM 0 H CYS A 161 1.089 -2.852 3.053 1.00 0.00 H new ATOM 0 HA CYS A 161 3.074 -0.869 3.136 1.00 0.00 H new ATOM 0 HB2 CYS A 161 2.481 -2.451 4.924 1.00 0.00 H new ATOM 0 HB3 CYS A 161 2.947 -3.810 3.921 1.00 0.00 H new ATOM 602 N HIS A 162 4.780 -1.276 1.406 1.00 0.00 N ATOM 603 CA HIS A 162 5.826 -1.463 0.397 1.00 0.00 C ATOM 604 C HIS A 162 6.887 -2.458 0.876 1.00 0.00 C ATOM 605 O HIS A 162 7.919 -2.608 0.224 1.00 0.00 O ATOM 606 CB HIS A 162 6.521 -0.130 0.116 1.00 0.00 C ATOM 607 CG HIS A 162 5.725 0.873 -0.680 1.00 0.00 C ATOM 608 ND1 HIS A 162 4.855 0.581 -1.732 1.00 0.00 N ATOM 609 CD2 HIS A 162 5.772 2.223 -0.495 1.00 0.00 C ATOM 610 CE1 HIS A 162 4.413 1.776 -2.165 1.00 0.00 C ATOM 611 NE2 HIS A 162 4.945 2.776 -1.441 1.00 0.00 N ATOM 0 H HIS A 162 4.759 -0.338 1.806 1.00 0.00 H new ATOM 0 HA HIS A 162 5.348 -1.848 -0.504 1.00 0.00 H new ATOM 0 HB2 HIS A 162 6.792 0.324 1.069 1.00 0.00 H new ATOM 0 HB3 HIS A 162 7.450 -0.332 -0.416 1.00 0.00 H new ATOM 0 HD2 HIS A 162 6.347 2.753 0.250 1.00 0.00 H new ATOM 0 HE1 HIS A 162 3.723 1.913 -2.985 1.00 0.00 H new ATOM 0 HE2 HIS A 162 4.766 3.772 -1.572 1.00 0.00 H new ATOM 619 N PHE A 163 6.650 -3.134 2.000 1.00 0.00 N ATOM 620 CA PHE A 163 7.692 -3.891 2.662 1.00 0.00 C ATOM 621 C PHE A 163 7.267 -5.306 3.026 1.00 0.00 C ATOM 622 O PHE A 163 8.089 -6.222 2.971 1.00 0.00 O ATOM 623 CB PHE A 163 8.015 -3.108 3.922 1.00 0.00 C ATOM 624 CG PHE A 163 9.401 -3.315 4.453 1.00 0.00 C ATOM 625 CD1 PHE A 163 9.694 -4.472 5.181 1.00 0.00 C ATOM 626 CD2 PHE A 163 10.380 -2.344 4.220 1.00 0.00 C ATOM 627 CE1 PHE A 163 10.994 -4.668 5.664 1.00 0.00 C ATOM 628 CE2 PHE A 163 11.673 -2.526 4.725 1.00 0.00 C ATOM 629 CZ PHE A 163 11.979 -3.687 5.435 1.00 0.00 C ATOM 0 H PHE A 163 5.743 -3.168 2.465 1.00 0.00 H new ATOM 0 HA PHE A 163 8.547 -4.009 1.996 1.00 0.00 H new ATOM 0 HB2 PHE A 163 7.874 -2.046 3.719 1.00 0.00 H new ATOM 0 HB3 PHE A 163 7.299 -3.383 4.697 1.00 0.00 H new ATOM 0 HD1 PHE A 163 8.926 -5.207 5.369 1.00 0.00 H new ATOM 0 HD2 PHE A 163 10.140 -1.457 3.653 1.00 0.00 H new ATOM 0 HE1 PHE A 163 11.240 -5.567 6.209 1.00 0.00 H new ATOM 0 HE2 PHE A 163 12.429 -1.772 4.566 1.00 0.00 H new ATOM 0 HZ PHE A 163 12.980 -3.835 5.813 1.00 0.00 H new ATOM 639 N CYS A 164 5.998 -5.498 3.402 1.00 0.00 N ATOM 640 CA CYS A 164 5.473 -6.815 3.726 1.00 0.00 C ATOM 641 C CYS A 164 4.106 -7.034 3.079 1.00 0.00 C ATOM 642 O CYS A 164 3.469 -8.064 3.297 1.00 0.00 O ATOM 643 CB CYS A 164 5.379 -6.910 5.237 1.00 0.00 C ATOM 644 SG CYS A 164 4.102 -5.764 5.780 1.00 0.00 S ATOM 0 H CYS A 164 5.315 -4.745 3.488 1.00 0.00 H new ATOM 0 HA CYS A 164 6.133 -7.591 3.338 1.00 0.00 H new ATOM 0 HB2 CYS A 164 5.134 -7.928 5.542 1.00 0.00 H new ATOM 0 HB3 CYS A 164 6.336 -6.661 5.696 1.00 0.00 H new ATOM 649 N GLN A 165 3.670 -6.055 2.281 1.00 0.00 N ATOM 650 CA GLN A 165 2.386 -6.025 1.590 1.00 0.00 C ATOM 651 C GLN A 165 1.193 -6.142 2.543 1.00 0.00 C ATOM 652 O GLN A 165 0.098 -6.509 2.117 1.00 0.00 O ATOM 653 CB GLN A 165 2.336 -7.037 0.443 1.00 0.00 C ATOM 654 CG GLN A 165 3.320 -6.675 -0.673 1.00 0.00 C ATOM 655 CD GLN A 165 4.771 -6.821 -0.247 1.00 0.00 C ATOM 656 OE1 GLN A 165 5.265 -7.930 -0.076 1.00 0.00 O ATOM 657 NE2 GLN A 165 5.478 -5.709 -0.064 1.00 0.00 N ATOM 0 H GLN A 165 4.232 -5.225 2.093 1.00 0.00 H new ATOM 0 HA GLN A 165 2.296 -5.037 1.138 1.00 0.00 H new ATOM 0 HB2 GLN A 165 2.568 -8.031 0.824 1.00 0.00 H new ATOM 0 HB3 GLN A 165 1.325 -7.079 0.038 1.00 0.00 H new ATOM 0 HG2 GLN A 165 3.134 -7.313 -1.537 1.00 0.00 H new ATOM 0 HG3 GLN A 165 3.141 -5.648 -0.991 1.00 0.00 H new ATOM 0 HE21 GLN A 165 5.044 -4.798 -0.213 1.00 0.00 H new ATOM 0 HE22 GLN A 165 6.454 -5.767 0.225 1.00 0.00 H new ATOM 666 N SER A 166 1.386 -5.833 3.825 1.00 0.00 N ATOM 667 CA SER A 166 0.319 -5.884 4.812 1.00 0.00 C ATOM 668 C SER A 166 -0.453 -4.571 4.815 1.00 0.00 C ATOM 669 O SER A 166 0.057 -3.562 5.295 1.00 0.00 O ATOM 670 CB SER A 166 0.931 -6.123 6.190 1.00 0.00 C ATOM 671 OG SER A 166 1.670 -7.330 6.201 1.00 0.00 O ATOM 0 H SER A 166 2.287 -5.541 4.204 1.00 0.00 H new ATOM 0 HA SER A 166 -0.367 -6.694 4.565 1.00 0.00 H new ATOM 0 HB2 SER A 166 1.581 -5.289 6.455 1.00 0.00 H new ATOM 0 HB3 SER A 166 0.143 -6.165 6.942 1.00 0.00 H new ATOM 0 HG SER A 166 2.515 -7.200 5.723 1.00 0.00 H new ATOM 677 N ILE A 167 -1.675 -4.587 4.286 1.00 0.00 N ATOM 678 CA ILE A 167 -2.573 -3.432 4.288 1.00 0.00 C ATOM 679 C ILE A 167 -2.890 -2.953 5.696 1.00 0.00 C ATOM 680 O ILE A 167 -3.286 -1.802 5.883 1.00 0.00 O ATOM 681 CB ILE A 167 -3.893 -3.797 3.600 1.00 0.00 C ATOM 682 CG1 ILE A 167 -4.536 -5.002 4.306 1.00 0.00 C ATOM 683 CG2 ILE A 167 -3.630 -4.113 2.135 1.00 0.00 C ATOM 684 CD1 ILE A 167 -5.586 -5.664 3.427 1.00 0.00 C ATOM 0 H ILE A 167 -2.075 -5.412 3.838 1.00 0.00 H new ATOM 0 HA ILE A 167 -2.061 -2.632 3.754 1.00 0.00 H new ATOM 0 HB ILE A 167 -4.582 -2.954 3.661 1.00 0.00 H new ATOM 0 HG12 ILE A 167 -3.765 -5.728 4.565 1.00 0.00 H new ATOM 0 HG13 ILE A 167 -4.994 -4.677 5.240 1.00 0.00 H new ATOM 0 HG21 ILE A 167 -4.568 -4.373 1.645 1.00 0.00 H new ATOM 0 HG22 ILE A 167 -3.195 -3.241 1.647 1.00 0.00 H new ATOM 0 HG23 ILE A 167 -2.938 -4.952 2.062 1.00 0.00 H new ATOM 0 HD11 ILE A 167 -6.021 -6.512 3.956 1.00 0.00 H new ATOM 0 HD12 ILE A 167 -6.369 -4.944 3.190 1.00 0.00 H new ATOM 0 HD13 ILE A 167 -5.121 -6.011 2.504 1.00 0.00 H new ATOM 696 N SER A 168 -2.717 -3.834 6.685 1.00 0.00 N ATOM 697 CA SER A 168 -2.886 -3.503 8.094 1.00 0.00 C ATOM 698 C SER A 168 -2.187 -2.190 8.419 1.00 0.00 C ATOM 699 O SER A 168 -2.768 -1.302 9.044 1.00 0.00 O ATOM 700 CB SER A 168 -2.367 -4.650 8.953 1.00 0.00 C ATOM 701 OG SER A 168 -2.577 -4.358 10.315 1.00 0.00 O ATOM 0 H SER A 168 -2.453 -4.806 6.524 1.00 0.00 H new ATOM 0 HA SER A 168 -3.945 -3.367 8.314 1.00 0.00 H new ATOM 0 HB2 SER A 168 -2.877 -5.576 8.687 1.00 0.00 H new ATOM 0 HB3 SER A 168 -1.305 -4.806 8.764 1.00 0.00 H new ATOM 0 HG SER A 168 -2.243 -5.098 10.864 1.00 0.00 H new ATOM 707 N HIS A 169 -0.929 -2.080 7.997 1.00 0.00 N ATOM 708 CA HIS A 169 -0.084 -0.930 8.266 1.00 0.00 C ATOM 709 C HIS A 169 0.539 -0.429 6.972 1.00 0.00 C ATOM 710 O HIS A 169 0.103 -0.781 5.879 1.00 0.00 O ATOM 711 CB HIS A 169 0.983 -1.309 9.298 1.00 0.00 C ATOM 712 CG HIS A 169 1.834 -2.485 8.881 1.00 0.00 C ATOM 713 ND1 HIS A 169 1.742 -3.773 9.363 1.00 0.00 N ATOM 714 CD2 HIS A 169 2.850 -2.480 7.964 1.00 0.00 C ATOM 715 CE1 HIS A 169 2.675 -4.508 8.739 1.00 0.00 C ATOM 716 NE2 HIS A 169 3.386 -3.762 7.878 1.00 0.00 N ATOM 0 H HIS A 169 -0.465 -2.804 7.449 1.00 0.00 H new ATOM 0 HA HIS A 169 -0.683 -0.119 8.680 1.00 0.00 H new ATOM 0 HB2 HIS A 169 1.628 -0.448 9.475 1.00 0.00 H new ATOM 0 HB3 HIS A 169 0.495 -1.541 10.245 1.00 0.00 H new ATOM 0 HD1 HIS A 169 1.084 -4.107 10.067 1.00 0.00 H new ATOM 0 HD2 HIS A 169 3.182 -1.621 7.399 1.00 0.00 H new ATOM 0 HE1 HIS A 169 2.834 -5.563 8.907 1.00 0.00 H new ATOM 724 N MET A 170 1.573 0.396 7.095 1.00 0.00 N ATOM 725 CA MET A 170 2.305 0.929 5.968 1.00 0.00 C ATOM 726 C MET A 170 3.777 0.650 6.199 1.00 0.00 C ATOM 727 O MET A 170 4.172 0.365 7.327 1.00 0.00 O ATOM 728 CB MET A 170 2.081 2.441 5.920 1.00 0.00 C ATOM 729 CG MET A 170 0.636 2.835 5.633 1.00 0.00 C ATOM 730 SD MET A 170 0.279 3.186 3.895 1.00 0.00 S ATOM 731 CE MET A 170 0.490 1.537 3.181 1.00 0.00 C ATOM 0 H MET A 170 1.926 0.714 7.998 1.00 0.00 H new ATOM 0 HA MET A 170 1.975 0.476 5.033 1.00 0.00 H new ATOM 0 HB2 MET A 170 2.385 2.875 6.872 1.00 0.00 H new ATOM 0 HB3 MET A 170 2.725 2.871 5.153 1.00 0.00 H new ATOM 0 HG2 MET A 170 -0.019 2.031 5.969 1.00 0.00 H new ATOM 0 HG3 MET A 170 0.389 3.716 6.226 1.00 0.00 H new ATOM 0 HE1 MET A 170 0.374 1.592 2.099 1.00 0.00 H new ATOM 0 HE2 MET A 170 1.484 1.161 3.421 1.00 0.00 H new ATOM 0 HE3 MET A 170 -0.262 0.863 3.592 1.00 0.00 H new ATOM 741 N VAL A 171 4.598 0.732 5.154 1.00 0.00 N ATOM 742 CA VAL A 171 6.040 0.611 5.325 1.00 0.00 C ATOM 743 C VAL A 171 6.506 1.670 6.307 1.00 0.00 C ATOM 744 O VAL A 171 7.552 1.545 6.936 1.00 0.00 O ATOM 745 CB VAL A 171 6.742 0.795 3.985 1.00 0.00 C ATOM 746 CG1 VAL A 171 6.671 2.254 3.560 1.00 0.00 C ATOM 747 CG2 VAL A 171 8.205 0.410 4.083 1.00 0.00 C ATOM 0 H VAL A 171 4.292 0.880 4.192 1.00 0.00 H new ATOM 0 HA VAL A 171 6.284 -0.380 5.709 1.00 0.00 H new ATOM 0 HB VAL A 171 6.241 0.156 3.258 1.00 0.00 H new ATOM 0 HG11 VAL A 171 7.175 2.379 2.601 1.00 0.00 H new ATOM 0 HG12 VAL A 171 5.628 2.555 3.464 1.00 0.00 H new ATOM 0 HG13 VAL A 171 7.160 2.876 4.310 1.00 0.00 H new ATOM 0 HG21 VAL A 171 8.684 0.550 3.114 1.00 0.00 H new ATOM 0 HG22 VAL A 171 8.698 1.038 4.825 1.00 0.00 H new ATOM 0 HG23 VAL A 171 8.287 -0.635 4.380 1.00 0.00 H new ATOM 757 N ALA A 172 5.699 2.726 6.430 1.00 0.00 N ATOM 758 CA ALA A 172 5.964 3.824 7.329 1.00 0.00 C ATOM 759 C ALA A 172 5.918 3.362 8.782 1.00 0.00 C ATOM 760 O ALA A 172 6.298 4.104 9.689 1.00 0.00 O ATOM 761 CB ALA A 172 4.912 4.896 7.094 1.00 0.00 C ATOM 0 H ALA A 172 4.836 2.833 5.897 1.00 0.00 H new ATOM 0 HA ALA A 172 6.962 4.219 7.136 1.00 0.00 H new ATOM 0 HB1 ALA A 172 5.093 5.737 7.764 1.00 0.00 H new ATOM 0 HB2 ALA A 172 4.965 5.238 6.060 1.00 0.00 H new ATOM 0 HB3 ALA A 172 3.922 4.483 7.289 1.00 0.00 H new ATOM 767 N SER A 173 5.447 2.135 8.985 1.00 0.00 N ATOM 768 CA SER A 173 5.242 1.537 10.292 1.00 0.00 C ATOM 769 C SER A 173 5.529 0.042 10.258 1.00 0.00 C ATOM 770 O SER A 173 5.198 -0.657 11.215 1.00 0.00 O ATOM 771 CB SER A 173 3.788 1.756 10.697 1.00 0.00 C ATOM 772 OG SER A 173 3.646 1.737 12.101 1.00 0.00 O ATOM 0 H SER A 173 5.191 1.514 8.218 1.00 0.00 H new ATOM 0 HA SER A 173 5.921 2.001 11.007 1.00 0.00 H new ATOM 0 HB2 SER A 173 3.437 2.711 10.305 1.00 0.00 H new ATOM 0 HB3 SER A 173 3.163 0.981 10.254 1.00 0.00 H new ATOM 0 HG SER A 173 4.102 0.950 12.465 1.00 0.00 H new ATOM 778 N CYS A 174 6.135 -0.462 9.170 1.00 0.00 N ATOM 779 CA CYS A 174 6.326 -1.905 9.034 1.00 0.00 C ATOM 780 C CYS A 174 7.018 -2.463 10.284 1.00 0.00 C ATOM 781 O CYS A 174 8.038 -1.932 10.717 1.00 0.00 O ATOM 782 CB CYS A 174 7.107 -2.261 7.771 1.00 0.00 C ATOM 783 SG CYS A 174 6.887 -4.021 7.415 1.00 0.00 S ATOM 0 H CYS A 174 6.491 0.096 8.394 1.00 0.00 H new ATOM 0 HA CYS A 174 5.343 -2.366 8.938 1.00 0.00 H new ATOM 0 HB2 CYS A 174 6.757 -1.661 6.931 1.00 0.00 H new ATOM 0 HB3 CYS A 174 8.164 -2.034 7.906 1.00 0.00 H new ATOM 788 N PRO A 175 6.473 -3.540 10.866 1.00 0.00 N ATOM 789 CA PRO A 175 7.043 -4.188 12.029 1.00 0.00 C ATOM 790 C PRO A 175 8.289 -4.986 11.660 1.00 0.00 C ATOM 791 O PRO A 175 9.050 -5.377 12.544 1.00 0.00 O ATOM 792 CB PRO A 175 5.941 -5.118 12.525 1.00 0.00 C ATOM 793 CG PRO A 175 5.193 -5.485 11.250 1.00 0.00 C ATOM 794 CD PRO A 175 5.254 -4.203 10.442 1.00 0.00 C ATOM 0 HA PRO A 175 7.357 -3.468 12.785 1.00 0.00 H new ATOM 0 HB2 PRO A 175 6.350 -5.999 13.019 1.00 0.00 H new ATOM 0 HB3 PRO A 175 5.290 -4.622 13.245 1.00 0.00 H new ATOM 0 HG2 PRO A 175 5.668 -6.315 10.727 1.00 0.00 H new ATOM 0 HG3 PRO A 175 4.165 -5.784 11.456 1.00 0.00 H new ATOM 0 HD2 PRO A 175 5.272 -4.413 9.373 1.00 0.00 H new ATOM 0 HD3 PRO A 175 4.381 -3.578 10.630 1.00 0.00 H new ATOM 802 N LEU A 176 8.513 -5.229 10.363 1.00 0.00 N ATOM 803 CA LEU A 176 9.659 -5.994 9.917 1.00 0.00 C ATOM 804 C LEU A 176 10.885 -5.108 9.761 1.00 0.00 C ATOM 805 O LEU A 176 11.958 -5.434 10.268 1.00 0.00 O ATOM 806 CB LEU A 176 9.360 -6.620 8.559 1.00 0.00 C ATOM 807 CG LEU A 176 8.048 -7.399 8.548 1.00 0.00 C ATOM 808 CD1 LEU A 176 7.900 -8.027 7.170 1.00 0.00 C ATOM 809 CD2 LEU A 176 8.068 -8.476 9.621 1.00 0.00 C ATOM 0 H LEU A 176 7.908 -4.901 9.610 1.00 0.00 H new ATOM 0 HA LEU A 176 9.857 -6.760 10.667 1.00 0.00 H new ATOM 0 HB2 LEU A 176 9.319 -5.836 7.803 1.00 0.00 H new ATOM 0 HB3 LEU A 176 10.177 -7.287 8.283 1.00 0.00 H new ATOM 0 HG LEU A 176 7.207 -6.737 8.757 1.00 0.00 H new ATOM 0 HD11 LEU A 176 6.970 -8.593 7.126 1.00 0.00 H new ATOM 0 HD12 LEU A 176 7.883 -7.243 6.413 1.00 0.00 H new ATOM 0 HD13 LEU A 176 8.741 -8.695 6.982 1.00 0.00 H new ATOM 0 HD21 LEU A 176 7.126 -9.025 9.603 1.00 0.00 H new ATOM 0 HD22 LEU A 176 8.892 -9.163 9.431 1.00 0.00 H new ATOM 0 HD23 LEU A 176 8.199 -8.013 10.599 1.00 0.00 H new ATOM 821 N LYS A 177 10.734 -3.978 9.060 1.00 0.00 N ATOM 822 CA LYS A 177 11.856 -3.096 8.784 1.00 0.00 C ATOM 823 C LYS A 177 12.523 -2.637 10.063 1.00 0.00 C ATOM 824 O LYS A 177 13.651 -2.147 10.027 1.00 0.00 O ATOM 825 CB LYS A 177 11.387 -1.909 7.950 1.00 0.00 C ATOM 826 CG LYS A 177 10.642 -0.917 8.830 1.00 0.00 C ATOM 827 CD LYS A 177 10.275 0.336 8.038 1.00 0.00 C ATOM 828 CE LYS A 177 11.521 1.135 7.652 1.00 0.00 C ATOM 829 NZ LYS A 177 12.225 1.663 8.831 1.00 0.00 N ATOM 0 H LYS A 177 9.844 -3.660 8.677 1.00 0.00 H new ATOM 0 HA LYS A 177 12.602 -3.651 8.215 1.00 0.00 H new ATOM 0 HB2 LYS A 177 12.243 -1.422 7.482 1.00 0.00 H new ATOM 0 HB3 LYS A 177 10.737 -2.253 7.145 1.00 0.00 H new ATOM 0 HG2 LYS A 177 9.739 -1.381 9.226 1.00 0.00 H new ATOM 0 HG3 LYS A 177 11.261 -0.645 9.685 1.00 0.00 H new ATOM 0 HD2 LYS A 177 9.729 0.053 7.138 1.00 0.00 H new ATOM 0 HD3 LYS A 177 9.609 0.962 8.632 1.00 0.00 H new ATOM 0 HE2 LYS A 177 12.197 0.499 7.081 1.00 0.00 H new ATOM 0 HE3 LYS A 177 11.235 1.961 7.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 12.888 2.407 8.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 11.534 2.061 9.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 12.751 0.895 9.294 1.00 0.00 H new ATOM 843 N ALA A 178 11.824 -2.802 11.189 1.00 0.00 N ATOM 844 CA ALA A 178 12.326 -2.426 12.492 1.00 0.00 C ATOM 845 C ALA A 178 13.618 -3.154 12.822 1.00 0.00 C ATOM 846 O ALA A 178 14.350 -2.745 13.723 1.00 0.00 O ATOM 847 CB ALA A 178 11.266 -2.740 13.537 1.00 0.00 C ATOM 0 H ALA A 178 10.887 -3.205 11.211 1.00 0.00 H new ATOM 0 HA ALA A 178 12.545 -1.358 12.489 1.00 0.00 H new ATOM 0 HB1 ALA A 178 11.634 -2.460 14.524 1.00 0.00 H new ATOM 0 HB2 ALA A 178 10.359 -2.178 13.315 1.00 0.00 H new ATOM 0 HB3 ALA A 178 11.045 -3.807 13.521 1.00 0.00 H new ATOM 853 N GLN A 179 13.903 -4.237 12.092 1.00 0.00 N ATOM 854 CA GLN A 179 15.146 -4.962 12.234 1.00 0.00 C ATOM 855 C GLN A 179 15.649 -5.471 10.879 1.00 0.00 C ATOM 856 O GLN A 179 16.612 -6.231 10.841 1.00 0.00 O ATOM 857 CB GLN A 179 14.959 -6.102 13.238 1.00 0.00 C ATOM 858 CG GLN A 179 13.825 -7.045 12.830 1.00 0.00 C ATOM 859 CD GLN A 179 12.457 -6.574 13.290 1.00 0.00 C ATOM 860 OE1 GLN A 179 12.329 -5.821 14.253 1.00 0.00 O ATOM 861 NE2 GLN A 179 11.410 -7.010 12.598 1.00 0.00 N ATOM 0 H GLN A 179 13.273 -4.626 11.391 1.00 0.00 H new ATOM 0 HA GLN A 179 15.912 -4.287 12.617 1.00 0.00 H new ATOM 0 HB2 GLN A 179 15.887 -6.667 13.322 1.00 0.00 H new ATOM 0 HB3 GLN A 179 14.748 -5.686 14.223 1.00 0.00 H new ATOM 0 HG2 GLN A 179 13.820 -7.148 11.745 1.00 0.00 H new ATOM 0 HG3 GLN A 179 14.019 -8.035 13.243 1.00 0.00 H new ATOM 0 HE21 GLN A 179 11.548 -7.634 11.803 1.00 0.00 H new ATOM 0 HE22 GLN A 179 10.468 -6.720 12.861 1.00 0.00 H new ATOM 870 N GLN A 180 15.009 -5.061 9.775 1.00 0.00 N ATOM 871 CA GLN A 180 15.446 -5.429 8.429 1.00 0.00 C ATOM 872 C GLN A 180 16.073 -4.221 7.738 1.00 0.00 C ATOM 873 O GLN A 180 16.842 -4.377 6.789 1.00 0.00 O ATOM 874 CB GLN A 180 14.256 -5.894 7.584 1.00 0.00 C ATOM 875 CG GLN A 180 13.375 -6.925 8.278 1.00 0.00 C ATOM 876 CD GLN A 180 13.460 -8.274 7.583 1.00 0.00 C ATOM 877 OE1 GLN A 180 12.947 -8.443 6.477 1.00 0.00 O ATOM 878 NE2 GLN A 180 14.103 -9.246 8.222 1.00 0.00 N ATOM 0 H GLN A 180 14.179 -4.468 9.793 1.00 0.00 H new ATOM 0 HA GLN A 180 16.172 -6.237 8.521 1.00 0.00 H new ATOM 0 HB2 GLN A 180 13.648 -5.028 7.322 1.00 0.00 H new ATOM 0 HB3 GLN A 180 14.628 -6.317 6.651 1.00 0.00 H new ATOM 0 HG2 GLN A 180 13.682 -7.029 9.319 1.00 0.00 H new ATOM 0 HG3 GLN A 180 12.341 -6.580 8.283 1.00 0.00 H new ATOM 0 HE21 GLN A 180 14.516 -9.068 9.138 1.00 0.00 H new ATOM 0 HE22 GLN A 180 14.184 -10.170 7.797 1.00 0.00 H new ATOM 887 N GLY A 181 15.746 -3.014 8.219 1.00 0.00 N ATOM 888 CA GLY A 181 16.291 -1.778 7.683 1.00 0.00 C ATOM 889 C GLY A 181 15.966 -0.579 8.571 1.00 0.00 C ATOM 890 O GLY A 181 15.452 0.420 8.071 1.00 0.00 O ATOM 0 H GLY A 181 15.095 -2.876 8.992 1.00 0.00 H new ATOM 0 HA2 GLY A 181 17.372 -1.872 7.582 1.00 0.00 H new ATOM 0 HA3 GLY A 181 15.891 -1.608 6.683 1.00 0.00 H new ATOM 894 N PRO A 182 16.261 -0.663 9.876 1.00 0.00 N ATOM 895 CA PRO A 182 16.017 0.405 10.834 1.00 0.00 C ATOM 896 C PRO A 182 16.999 1.558 10.642 1.00 0.00 C ATOM 897 O PRO A 182 16.999 2.497 11.433 1.00 0.00 O ATOM 898 CB PRO A 182 16.228 -0.239 12.205 1.00 0.00 C ATOM 899 CG PRO A 182 17.276 -1.309 11.912 1.00 0.00 C ATOM 900 CD PRO A 182 16.867 -1.806 10.531 1.00 0.00 C ATOM 0 HA PRO A 182 15.018 0.826 10.716 1.00 0.00 H new ATOM 0 HB2 PRO A 182 16.580 0.483 12.942 1.00 0.00 H new ATOM 0 HB3 PRO A 182 15.307 -0.670 12.596 1.00 0.00 H new ATOM 0 HG2 PRO A 182 18.286 -0.898 11.912 1.00 0.00 H new ATOM 0 HG3 PRO A 182 17.257 -2.109 12.653 1.00 0.00 H new ATOM 0 HD2 PRO A 182 17.730 -2.168 9.972 1.00 0.00 H new ATOM 0 HD3 PRO A 182 16.164 -2.636 10.604 1.00 0.00 H new ATOM 908 N SER A 183 17.839 1.479 9.603 1.00 0.00 N ATOM 909 CA SER A 183 18.871 2.455 9.274 1.00 0.00 C ATOM 910 C SER A 183 18.319 3.851 8.989 1.00 0.00 C ATOM 911 O SER A 183 17.112 4.088 9.027 1.00 0.00 O ATOM 912 CB SER A 183 19.628 1.950 8.045 1.00 0.00 C ATOM 913 OG SER A 183 20.115 0.643 8.272 1.00 0.00 O ATOM 0 H SER A 183 17.813 0.700 8.945 1.00 0.00 H new ATOM 0 HA SER A 183 19.523 2.553 10.142 1.00 0.00 H new ATOM 0 HB2 SER A 183 18.969 1.954 7.177 1.00 0.00 H new ATOM 0 HB3 SER A 183 20.457 2.620 7.819 1.00 0.00 H new ATOM 0 HG SER A 183 20.596 0.331 7.477 1.00 0.00 H new ATOM 919 N ALA A 184 19.237 4.780 8.699 1.00 0.00 N ATOM 920 CA ALA A 184 18.941 6.151 8.301 1.00 0.00 C ATOM 921 C ALA A 184 18.146 6.935 9.351 1.00 0.00 C ATOM 922 O ALA A 184 17.456 7.890 9.011 1.00 0.00 O ATOM 923 CB ALA A 184 18.249 6.134 6.931 1.00 0.00 C ATOM 0 H ALA A 184 20.238 4.587 8.738 1.00 0.00 H new ATOM 0 HA ALA A 184 19.884 6.692 8.220 1.00 0.00 H new ATOM 0 HB1 ALA A 184 18.023 7.155 6.625 1.00 0.00 H new ATOM 0 HB2 ALA A 184 18.908 5.672 6.196 1.00 0.00 H new ATOM 0 HB3 ALA A 184 17.323 5.563 6.998 1.00 0.00 H new ATOM 929 N GLN A 185 18.236 6.540 10.626 1.00 0.00 N ATOM 930 CA GLN A 185 17.539 7.233 11.707 1.00 0.00 C ATOM 931 C GLN A 185 17.974 8.697 11.818 1.00 0.00 C ATOM 932 O GLN A 185 18.921 9.133 11.161 1.00 0.00 O ATOM 933 CB GLN A 185 17.782 6.513 13.035 1.00 0.00 C ATOM 934 CG GLN A 185 17.286 5.069 12.946 1.00 0.00 C ATOM 935 CD GLN A 185 17.393 4.327 14.271 1.00 0.00 C ATOM 936 OE1 GLN A 185 17.558 4.930 15.330 1.00 0.00 O ATOM 937 NE2 GLN A 185 17.303 3.002 14.217 1.00 0.00 N ATOM 0 H GLN A 185 18.789 5.739 10.932 1.00 0.00 H new ATOM 0 HA GLN A 185 16.474 7.220 11.475 1.00 0.00 H new ATOM 0 HB2 GLN A 185 18.845 6.527 13.276 1.00 0.00 H new ATOM 0 HB3 GLN A 185 17.265 7.035 13.841 1.00 0.00 H new ATOM 0 HG2 GLN A 185 16.247 5.066 12.616 1.00 0.00 H new ATOM 0 HG3 GLN A 185 17.863 4.537 12.189 1.00 0.00 H new ATOM 0 HE21 GLN A 185 17.166 2.536 13.320 1.00 0.00 H new ATOM 0 HE22 GLN A 185 17.371 2.451 15.073 1.00 0.00 H new ATOM 946 N GLY A 186 17.275 9.461 12.662 1.00 0.00 N ATOM 947 CA GLY A 186 17.591 10.857 12.916 1.00 0.00 C ATOM 948 C GLY A 186 16.804 11.386 14.103 1.00 0.00 C ATOM 949 O GLY A 186 17.335 11.315 15.231 1.00 0.00 O ATOM 950 OXT GLY A 186 15.672 11.862 13.869 1.00 0.00 O ATOM 0 H GLY A 186 16.470 9.120 13.188 1.00 0.00 H new ATOM 0 HA2 GLY A 186 18.659 10.963 13.107 1.00 0.00 H new ATOM 0 HA3 GLY A 186 17.365 11.452 12.031 1.00 0.00 H new TER 954 GLY A 186 ATOM 955 O5' A B 1 10.522 7.421 7.351 1.00 0.00 O ATOM 956 C5' A B 1 9.385 6.700 6.925 1.00 0.00 C ATOM 957 C4' A B 1 8.809 7.317 5.653 1.00 0.00 C ATOM 958 O4' A B 1 9.530 6.861 4.506 1.00 0.00 O ATOM 959 C3' A B 1 7.361 6.852 5.495 1.00 0.00 C ATOM 960 O3' A B 1 6.644 7.848 4.787 1.00 0.00 O ATOM 961 C2' A B 1 7.555 5.624 4.622 1.00 0.00 C ATOM 962 O2' A B 1 6.400 5.274 3.905 1.00 0.00 O ATOM 963 C1' A B 1 8.594 6.187 3.691 1.00 0.00 C ATOM 964 N9 A B 1 9.113 5.167 2.762 1.00 0.00 N ATOM 965 C8 A B 1 8.861 5.113 1.419 1.00 0.00 C ATOM 966 N7 A B 1 9.402 4.091 0.815 1.00 0.00 N ATOM 967 C5 A B 1 10.021 3.393 1.847 1.00 0.00 C ATOM 968 C6 A B 1 10.760 2.194 1.887 1.00 0.00 C ATOM 969 N6 A B 1 11.048 1.463 0.799 1.00 0.00 N ATOM 970 N1 A B 1 11.205 1.753 3.069 1.00 0.00 N ATOM 971 C2 A B 1 10.938 2.464 4.154 1.00 0.00 C ATOM 972 N3 A B 1 10.263 3.601 4.261 1.00 0.00 N ATOM 973 C4 A B 1 9.821 4.021 3.049 1.00 0.00 C ATOM 0 H5' A B 1 8.630 6.701 7.711 1.00 0.00 H new ATOM 0 H5'' A B 1 9.654 5.659 6.743 1.00 0.00 H new ATOM 0 H4' A B 1 8.878 8.402 5.730 1.00 0.00 H new ATOM 0 H3' A B 1 6.819 6.662 6.421 1.00 0.00 H new ATOM 0 H2' A B 1 7.809 4.713 5.164 1.00 0.00 H new ATOM 0 HO2' A B 1 5.645 5.817 4.215 1.00 0.00 H new ATOM 0 HO5' A B 1 10.597 7.367 8.327 1.00 0.00 H new ATOM 0 H1' A B 1 8.192 6.918 2.989 1.00 0.00 H new ATOM 0 H8 A B 1 8.266 5.852 0.903 1.00 0.00 H new ATOM 0 H61 A B 1 11.588 0.602 0.891 1.00 0.00 H new ATOM 0 H62 A B 1 10.727 1.768 -0.120 1.00 0.00 H new ATOM 0 H2 A B 1 11.323 2.063 5.080 1.00 0.00 H new ATOM 986 P G B 2 5.482 8.695 5.495 1.00 0.00 P ATOM 987 OP1 G B 2 5.870 10.123 5.473 1.00 0.00 O ATOM 988 OP2 G B 2 5.148 8.052 6.782 1.00 0.00 O ATOM 989 O5' G B 2 4.246 8.481 4.492 1.00 0.00 O ATOM 990 C5' G B 2 4.005 9.372 3.417 1.00 0.00 C ATOM 991 C4' G B 2 2.816 8.890 2.587 1.00 0.00 C ATOM 992 O4' G B 2 3.199 7.841 1.715 1.00 0.00 O ATOM 993 C3' G B 2 1.677 8.384 3.471 1.00 0.00 C ATOM 994 O3' G B 2 0.683 9.334 3.825 1.00 0.00 O ATOM 995 C2' G B 2 1.088 7.227 2.673 1.00 0.00 C ATOM 996 O2' G B 2 -0.021 7.613 1.892 1.00 0.00 O ATOM 997 C1' G B 2 2.228 6.810 1.740 1.00 0.00 C ATOM 998 N9 G B 2 2.861 5.567 2.214 1.00 0.00 N ATOM 999 C8 G B 2 3.670 5.351 3.302 1.00 0.00 C ATOM 1000 N7 G B 2 3.972 4.098 3.478 1.00 0.00 N ATOM 1001 C5 G B 2 3.404 3.454 2.389 1.00 0.00 C ATOM 1002 C6 G B 2 3.476 2.091 1.990 1.00 0.00 C ATOM 1003 O6 G B 2 4.033 1.154 2.548 1.00 0.00 O ATOM 1004 N1 G B 2 2.809 1.848 0.808 1.00 0.00 N ATOM 1005 C2 G B 2 2.138 2.806 0.086 1.00 0.00 C ATOM 1006 N2 G B 2 1.551 2.413 -1.038 1.00 0.00 N ATOM 1007 N3 G B 2 2.057 4.091 0.449 1.00 0.00 N ATOM 1008 C4 G B 2 2.724 4.348 1.608 1.00 0.00 C ATOM 0 H5' G B 2 4.892 9.442 2.788 1.00 0.00 H new ATOM 0 H5'' G B 2 3.807 10.372 3.802 1.00 0.00 H new ATOM 0 H4' G B 2 2.472 9.749 2.012 1.00 0.00 H new ATOM 0 H3' G B 2 2.069 8.107 4.450 1.00 0.00 H new ATOM 0 H2' G B 2 0.731 6.439 3.336 1.00 0.00 H new ATOM 0 HO2' G B 2 0.202 8.420 1.384 1.00 0.00 H new ATOM 0 H1' G B 2 1.823 6.639 0.742 1.00 0.00 H new ATOM 0 H8 G B 2 4.021 6.143 3.948 1.00 0.00 H new ATOM 0 H1 G B 2 2.814 0.895 0.446 1.00 0.00 H new ATOM 0 H21 G B 2 1.041 3.086 -1.609 1.00 0.00 H new ATOM 0 H22 G B 2 1.610 1.438 -1.330 1.00 0.00 H new ATOM 1020 P G B 3 0.345 10.661 2.968 1.00 0.00 P ATOM 1021 OP1 G B 3 1.515 11.561 3.010 1.00 0.00 O ATOM 1022 OP2 G B 3 -0.972 11.155 3.426 1.00 0.00 O ATOM 1023 O5' G B 3 0.189 10.116 1.463 1.00 0.00 O ATOM 1024 C5' G B 3 -0.620 10.791 0.522 1.00 0.00 C ATOM 1025 C4' G B 3 -0.433 10.123 -0.840 1.00 0.00 C ATOM 1026 O4' G B 3 -1.004 8.825 -0.799 1.00 0.00 O ATOM 1027 C3' G B 3 -1.132 10.934 -1.936 1.00 0.00 C ATOM 1028 O3' G B 3 -0.230 11.150 -3.008 1.00 0.00 O ATOM 1029 C2' G B 3 -2.291 10.045 -2.368 1.00 0.00 C ATOM 1030 O2' G B 3 -2.479 10.096 -3.766 1.00 0.00 O ATOM 1031 C1' G B 3 -1.868 8.658 -1.904 1.00 0.00 C ATOM 1032 N9 G B 3 -3.059 7.863 -1.532 1.00 0.00 N ATOM 1033 C8 G B 3 -3.508 6.690 -2.086 1.00 0.00 C ATOM 1034 N7 G B 3 -4.631 6.255 -1.588 1.00 0.00 N ATOM 1035 C5 G B 3 -4.955 7.211 -0.623 1.00 0.00 C ATOM 1036 C6 G B 3 -6.082 7.285 0.253 1.00 0.00 C ATOM 1037 O6 G B 3 -7.043 6.522 0.327 1.00 0.00 O ATOM 1038 N1 G B 3 -6.015 8.386 1.087 1.00 0.00 N ATOM 1039 C2 G B 3 -4.996 9.306 1.090 1.00 0.00 C ATOM 1040 N2 G B 3 -5.086 10.290 1.976 1.00 0.00 N ATOM 1041 N3 G B 3 -3.942 9.252 0.267 1.00 0.00 N ATOM 1042 C4 G B 3 -3.988 8.186 -0.566 1.00 0.00 C ATOM 0 H5' G B 3 -0.343 11.844 0.469 1.00 0.00 H new ATOM 0 H5'' G B 3 -1.667 10.751 0.824 1.00 0.00 H new ATOM 0 H4' G B 3 0.633 10.067 -1.062 1.00 0.00 H new ATOM 0 H3' G B 3 -1.471 11.915 -1.604 1.00 0.00 H new ATOM 0 H2' G B 3 -3.247 10.352 -1.944 1.00 0.00 H new ATOM 0 HO2' G B 3 -3.425 10.260 -3.963 1.00 0.00 H new ATOM 0 H1' G B 3 -1.353 8.121 -2.700 1.00 0.00 H new ATOM 0 H8 G B 3 -2.975 6.171 -2.869 1.00 0.00 H new ATOM 0 H1 G B 3 -6.779 8.525 1.749 1.00 0.00 H new ATOM 0 H21 G B 3 -4.357 11.002 2.023 1.00 0.00 H new ATOM 0 H22 G B 3 -5.884 10.334 2.610 1.00 0.00 H new ATOM 1054 P A B 4 -0.194 12.562 -3.781 1.00 0.00 P ATOM 1055 OP1 A B 4 1.226 12.892 -4.031 1.00 0.00 O ATOM 1056 OP2 A B 4 -1.048 13.515 -3.046 1.00 0.00 O ATOM 1057 O5' A B 4 -0.896 12.297 -5.205 1.00 0.00 O ATOM 1058 C5' A B 4 -0.155 11.763 -6.280 1.00 0.00 C ATOM 1059 C4' A B 4 -0.899 11.910 -7.611 1.00 0.00 C ATOM 1060 O4' A B 4 -1.974 10.987 -7.697 1.00 0.00 O ATOM 1061 C3' A B 4 -1.466 13.321 -7.785 1.00 0.00 C ATOM 1062 O3' A B 4 -1.334 13.724 -9.141 1.00 0.00 O ATOM 1063 C2' A B 4 -2.929 13.120 -7.431 1.00 0.00 C ATOM 1064 O2' A B 4 -3.773 14.059 -8.055 1.00 0.00 O ATOM 1065 C1' A B 4 -3.175 11.701 -7.913 1.00 0.00 C ATOM 1066 N9 A B 4 -4.270 11.090 -7.149 1.00 0.00 N ATOM 1067 C8 A B 4 -4.466 11.120 -5.798 1.00 0.00 C ATOM 1068 N7 A B 4 -5.539 10.492 -5.400 1.00 0.00 N ATOM 1069 C5 A B 4 -6.094 10.023 -6.591 1.00 0.00 C ATOM 1070 C6 A B 4 -7.251 9.271 -6.883 1.00 0.00 C ATOM 1071 N6 A B 4 -8.099 8.818 -5.957 1.00 0.00 N ATOM 1072 N1 A B 4 -7.523 8.984 -8.166 1.00 0.00 N ATOM 1073 C2 A B 4 -6.701 9.433 -9.103 1.00 0.00 C ATOM 1074 N3 A B 4 -5.585 10.137 -8.973 1.00 0.00 N ATOM 1075 C4 A B 4 -5.338 10.396 -7.664 1.00 0.00 C ATOM 0 H5' A B 4 0.050 10.709 -6.092 1.00 0.00 H new ATOM 0 H5'' A B 4 0.809 12.269 -6.344 1.00 0.00 H new ATOM 0 H4' A B 4 -0.172 11.711 -8.398 1.00 0.00 H new ATOM 0 H3' A B 4 -0.971 14.084 -7.184 1.00 0.00 H new ATOM 0 H2' A B 4 -3.144 13.264 -6.372 1.00 0.00 H new ATOM 0 HO2' A B 4 -4.702 13.886 -7.796 1.00 0.00 H new ATOM 0 H1' A B 4 -3.457 11.687 -8.966 1.00 0.00 H new ATOM 0 H8 A B 4 -3.792 11.620 -5.118 1.00 0.00 H new ATOM 0 H61 A B 4 -8.919 8.279 -6.236 1.00 0.00 H new ATOM 0 H62 A B 4 -7.927 9.011 -4.970 1.00 0.00 H new ATOM 0 H2 A B 4 -6.980 9.191 -10.118 1.00 0.00 H new ATOM 1087 P G B 5 -1.291 15.283 -9.539 1.00 0.00 P ATOM 1088 OP1 G B 5 -1.853 16.071 -8.417 1.00 0.00 O ATOM 1089 OP2 G B 5 -1.867 15.423 -10.894 1.00 0.00 O ATOM 1090 O5' G B 5 0.285 15.572 -9.616 1.00 0.00 O ATOM 1091 C5' G B 5 1.006 15.270 -10.792 1.00 0.00 C ATOM 1092 C4' G B 5 2.312 14.557 -10.448 1.00 0.00 C ATOM 1093 O4' G B 5 2.010 13.337 -9.792 1.00 0.00 O ATOM 1094 C3' G B 5 3.065 14.186 -11.726 1.00 0.00 C ATOM 1095 O3' G B 5 4.410 13.967 -11.346 1.00 0.00 O ATOM 1096 C2' G B 5 2.309 12.910 -12.084 1.00 0.00 C ATOM 1097 O2' G B 5 2.949 12.108 -13.058 1.00 0.00 O ATOM 1098 C1' G B 5 2.251 12.281 -10.699 1.00 0.00 C ATOM 1099 N9 G B 5 1.184 11.282 -10.578 1.00 0.00 N ATOM 1100 C8 G B 5 -0.127 11.372 -10.958 1.00 0.00 C ATOM 1101 N7 G B 5 -0.837 10.316 -10.670 1.00 0.00 N ATOM 1102 C5 G B 5 0.080 9.448 -10.079 1.00 0.00 C ATOM 1103 C6 G B 5 -0.092 8.135 -9.547 1.00 0.00 C ATOM 1104 O6 G B 5 -1.115 7.461 -9.469 1.00 0.00 O ATOM 1105 N1 G B 5 1.096 7.609 -9.074 1.00 0.00 N ATOM 1106 C2 G B 5 2.310 8.252 -9.112 1.00 0.00 C ATOM 1107 N2 G B 5 3.363 7.582 -8.660 1.00 0.00 N ATOM 1108 N3 G B 5 2.481 9.491 -9.572 1.00 0.00 N ATOM 1109 C4 G B 5 1.327 10.023 -10.049 1.00 0.00 C ATOM 0 H5' G B 5 1.219 16.187 -11.341 1.00 0.00 H new ATOM 0 H5'' G B 5 0.402 14.640 -11.445 1.00 0.00 H new ATOM 0 H4' G B 5 2.912 15.220 -9.825 1.00 0.00 H new ATOM 0 H3' G B 5 3.100 14.897 -12.552 1.00 0.00 H new ATOM 0 H2' G B 5 1.344 13.062 -12.568 1.00 0.00 H new ATOM 0 HO2' G B 5 3.787 11.755 -12.692 1.00 0.00 H new ATOM 0 H1' G B 5 3.187 11.759 -10.497 1.00 0.00 H new ATOM 0 H8 G B 5 -0.538 12.240 -11.452 1.00 0.00 H new ATOM 0 H1 G B 5 1.069 6.674 -8.667 1.00 0.00 H new ATOM 0 H21 G B 5 4.286 8.017 -8.668 1.00 0.00 H new ATOM 0 H22 G B 5 3.249 6.632 -8.305 1.00 0.00 H new ATOM 1121 P A B 6 5.540 13.497 -12.381 1.00 0.00 P ATOM 1122 OP1 A B 6 5.477 14.365 -13.575 1.00 0.00 O ATOM 1123 OP2 A B 6 5.464 12.029 -12.536 1.00 0.00 O ATOM 1124 O5' A B 6 6.878 13.855 -11.570 1.00 0.00 O ATOM 1125 C5' A B 6 7.184 13.175 -10.373 1.00 0.00 C ATOM 1126 C4' A B 6 8.407 13.813 -9.718 1.00 0.00 C ATOM 1127 O4' A B 6 8.090 15.160 -9.396 1.00 0.00 O ATOM 1128 C3' A B 6 8.748 13.093 -8.413 1.00 0.00 C ATOM 1129 O3' A B 6 10.131 13.209 -8.143 1.00 0.00 O ATOM 1130 C2' A B 6 7.951 13.912 -7.408 1.00 0.00 C ATOM 1131 O2' A B 6 8.473 13.837 -6.098 1.00 0.00 O ATOM 1132 C1' A B 6 8.122 15.300 -7.991 1.00 0.00 C ATOM 1133 N9 A B 6 7.099 16.244 -7.505 1.00 0.00 N ATOM 1134 C8 A B 6 5.734 16.164 -7.610 1.00 0.00 C ATOM 1135 N7 A B 6 5.102 17.177 -7.077 1.00 0.00 N ATOM 1136 C5 A B 6 6.127 17.974 -6.571 1.00 0.00 C ATOM 1137 C6 A B 6 6.150 19.201 -5.880 1.00 0.00 C ATOM 1138 N6 A B 6 5.058 19.906 -5.574 1.00 0.00 N ATOM 1139 N1 A B 6 7.332 19.702 -5.504 1.00 0.00 N ATOM 1140 C2 A B 6 8.438 19.041 -5.806 1.00 0.00 C ATOM 1141 N3 A B 6 8.562 17.897 -6.466 1.00 0.00 N ATOM 1142 C4 A B 6 7.350 17.409 -6.825 1.00 0.00 C ATOM 0 H5' A B 6 7.378 12.123 -10.580 1.00 0.00 H new ATOM 0 H5'' A B 6 6.333 13.214 -9.693 1.00 0.00 H new ATOM 0 H4' A B 6 9.251 13.750 -10.404 1.00 0.00 H new ATOM 0 H3' A B 6 8.522 12.027 -8.411 1.00 0.00 H new ATOM 0 H2' A B 6 6.920 13.579 -7.288 1.00 0.00 H new ATOM 0 HO2' A B 6 8.626 12.899 -5.860 1.00 0.00 H new ATOM 0 H1' A B 6 9.071 15.729 -7.670 1.00 0.00 H new ATOM 0 H8 A B 6 5.227 15.339 -8.089 1.00 0.00 H new ATOM 0 H61 A B 6 5.145 20.789 -5.071 1.00 0.00 H new ATOM 0 H62 A B 6 4.137 19.561 -5.843 1.00 0.00 H new ATOM 0 H2 A B 6 9.360 19.492 -5.471 1.00 0.00 H new ATOM 1154 P U B 7 11.219 12.321 -8.920 1.00 0.00 P ATOM 1155 OP1 U B 7 11.488 12.943 -10.232 1.00 0.00 O ATOM 1156 OP2 U B 7 10.814 10.904 -8.845 1.00 0.00 O ATOM 1157 O5' U B 7 12.505 12.525 -7.986 1.00 0.00 O ATOM 1158 C5' U B 7 13.151 13.782 -7.924 1.00 0.00 C ATOM 1159 C4' U B 7 13.406 14.179 -6.471 1.00 0.00 C ATOM 1160 O4' U B 7 13.652 15.575 -6.408 1.00 0.00 O ATOM 1161 C3' U B 7 12.159 13.943 -5.610 1.00 0.00 C ATOM 1162 O3' U B 7 12.522 13.901 -4.243 1.00 0.00 O ATOM 1163 C2' U B 7 11.354 15.188 -5.937 1.00 0.00 C ATOM 1164 O2' U B 7 10.444 15.510 -4.905 1.00 0.00 O ATOM 1165 C1' U B 7 12.438 16.250 -6.104 1.00 0.00 C ATOM 1166 N1 U B 7 12.107 17.292 -7.108 1.00 0.00 N ATOM 1167 C2 U B 7 12.603 18.560 -6.851 1.00 0.00 C ATOM 1168 O2 U B 7 13.356 18.788 -5.912 1.00 0.00 O ATOM 1169 N3 U B 7 12.206 19.573 -7.708 1.00 0.00 N ATOM 1170 C4 U B 7 11.405 19.419 -8.821 1.00 0.00 C ATOM 1171 O4 U B 7 11.110 20.393 -9.511 1.00 0.00 O ATOM 1172 C5 U B 7 10.986 18.055 -9.059 1.00 0.00 C ATOM 1173 C6 U B 7 11.338 17.056 -8.218 1.00 0.00 C ATOM 0 H5' U B 7 12.536 14.538 -8.412 1.00 0.00 H new ATOM 0 H5'' U B 7 14.095 13.740 -8.467 1.00 0.00 H new ATOM 0 H4' U B 7 14.246 13.585 -6.111 1.00 0.00 H new ATOM 0 H3' U B 7 11.626 13.011 -5.797 1.00 0.00 H new ATOM 0 H2' U B 7 10.724 15.079 -6.820 1.00 0.00 H new ATOM 0 HO2' U B 7 9.633 14.969 -5.004 1.00 0.00 H new ATOM 0 HO3' U B 7 11.749 13.624 -3.708 1.00 0.00 H new ATOM 0 H1' U B 7 12.533 16.809 -5.173 1.00 0.00 H new ATOM 0 H3 U B 7 12.535 20.516 -7.498 1.00 0.00 H new ATOM 0 H5 U B 7 10.381 17.830 -9.925 1.00 0.00 H new ATOM 0 H6 U B 7 11.006 16.050 -8.426 1.00 0.00 H new TER 1185 U B 7 HETATM 1186 ZN ZN A 187 -3.597 1.222 -11.377 1.00 0.00 ZN HETATM 1187 ZN ZN A 188 4.974 -3.969 6.444 1.00 0.00 ZN