USER MOD reduce.3.24.130724 H: found=0, std=0, add=602, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 187 HIS : no HD1:sc= -0.667 X(o=-3,f=-3.2) USER MOD Set 1.2: A 206 MET CE :methyl 162:sc= -2.38! (180deg=-1.62!) USER MOD Set 2.1: A 157 TYR OH : rot 75:sc= 0.3 USER MOD Set 2.2: A 159 ASN : amide:sc= 0.235 K(o=0.53,f=0) USER MOD Set 3.1: A 153 ASN : amide:sc= -2.32 K(o=-3.4,f=-8.5!) USER MOD Set 3.2: A 205 MET CE :methyl 176:sc= -1.07 (180deg=-1.12) USER MOD Set 4.1: A 134 MET CE :methyl -127:sc= -0.0308 (180deg=-0.11) USER MOD Set 4.2: A 217 GLN : amide:sc= -0.132 K(o=-0.16,f=-1.6) USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= -0.38 X(o=-0.38,f=-0.37) USER MOD Single : A 143 SER OG : rot 180:sc= 0 USER MOD Single : A 145 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 TYR OH : rot -121:sc= 1.81 USER MOD Single : A 154 MET CE :methyl 170:sc= -0.741 (180deg=-0.957) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 160 GLN : amide:sc= -0.96 K(o=-0.96,f=-1.5) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 ASN : amide:sc=-0.00906 X(o=-0.0091,f=-0.011) USER MOD Single : A 177 HIS : no HD1:sc= -0.0108 X(o=-0.011,f=-0.17) USER MOD Single : A 178 ASN : amide:sc= -0.0527 K(o=-0.053,f=-0.6) USER MOD Single : A 179 CYS SG : rot 180:sc= 0 USER MOD Single : A 181 ASN : amide:sc= -0.0274 X(o=-0.027,f=-0.48) USER MOD Single : A 183 THR OG1 : rot 180:sc= 0.038 USER MOD Single : A 185 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 186 GLN :FLIP amide:sc= -0.25 F(o=-0.9,f=-0.25) USER MOD Single : A 188 THR OG1 : rot 180:sc= 0 USER MOD Single : A 190 THR OG1 : rot 180:sc= 0 USER MOD Single : A 191 THR OG1 : rot -88:sc= 1.18 USER MOD Single : A 192 THR OG1 : rot 80:sc= 0.0528 USER MOD Single : A 193 THR OG1 : rot 180:sc= 0 USER MOD Single : A 194 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 197 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 199 THR OG1 : rot 180:sc= 0.0816 USER MOD Single : A 201 THR OG1 : rot 180:sc= 0 USER MOD Single : A 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 212 GLN :FLIP amide:sc= -0.0903 F(o=-2.4!,f=-0.09) USER MOD Single : A 213 MET CE :methyl -126:sc= -2.33 (180deg=-5.77!) USER MOD Single : A 214 CYS SG : rot 180:sc= 0 USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 218 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 108 N ALA A 133 12.934 -11.737 -16.122 1.00 0.00 N ATOM 109 CA ALA A 133 14.161 -11.232 -16.726 1.00 0.00 C ATOM 110 C ALA A 133 14.005 -11.073 -18.234 1.00 0.00 C ATOM 111 O ALA A 133 13.005 -11.497 -18.812 1.00 0.00 O ATOM 112 CB ALA A 133 15.325 -12.159 -16.408 1.00 0.00 C ATOM 0 HA ALA A 133 14.368 -10.249 -16.303 1.00 0.00 H new ATOM 0 HB1 ALA A 133 16.235 -11.770 -16.865 1.00 0.00 H new ATOM 0 HB2 ALA A 133 15.458 -12.218 -15.328 1.00 0.00 H new ATOM 0 HB3 ALA A 133 15.117 -13.153 -16.803 1.00 0.00 H new ATOM 118 N MET A 134 15.000 -10.458 -18.865 1.00 0.00 N ATOM 119 CA MET A 134 14.973 -10.244 -20.308 1.00 0.00 C ATOM 120 C MET A 134 16.292 -10.669 -20.946 1.00 0.00 C ATOM 121 O MET A 134 17.342 -10.632 -20.305 1.00 0.00 O ATOM 122 CB MET A 134 14.693 -8.773 -20.621 1.00 0.00 C ATOM 123 CG MET A 134 13.405 -8.254 -20.001 1.00 0.00 C ATOM 124 SD MET A 134 13.664 -7.520 -18.375 1.00 0.00 S ATOM 125 CE MET A 134 12.063 -6.772 -18.083 1.00 0.00 C ATOM 0 H MET A 134 15.834 -10.099 -18.401 1.00 0.00 H new ATOM 0 HA MET A 134 14.174 -10.856 -20.726 1.00 0.00 H new ATOM 0 HB2 MET A 134 15.527 -8.169 -20.264 1.00 0.00 H new ATOM 0 HB3 MET A 134 14.644 -8.643 -21.702 1.00 0.00 H new ATOM 0 HG2 MET A 134 12.961 -7.512 -20.664 1.00 0.00 H new ATOM 0 HG3 MET A 134 12.691 -9.073 -19.916 1.00 0.00 H new ATOM 0 HE1 MET A 134 12.194 -5.720 -17.829 1.00 0.00 H new ATOM 0 HE2 MET A 134 11.453 -6.855 -18.982 1.00 0.00 H new ATOM 0 HE3 MET A 134 11.567 -7.285 -17.259 1.00 0.00 H new ATOM 135 N SER A 135 16.229 -11.074 -22.210 1.00 0.00 N ATOM 136 CA SER A 135 17.417 -11.511 -22.933 1.00 0.00 C ATOM 137 C SER A 135 18.045 -10.350 -23.698 1.00 0.00 C ATOM 138 O SER A 135 17.462 -9.832 -24.650 1.00 0.00 O ATOM 139 CB SER A 135 17.065 -12.643 -23.900 1.00 0.00 C ATOM 140 OG SER A 135 18.228 -13.169 -24.515 1.00 0.00 O ATOM 0 H SER A 135 15.367 -11.109 -22.755 1.00 0.00 H new ATOM 0 HA SER A 135 18.141 -11.877 -22.205 1.00 0.00 H new ATOM 0 HB2 SER A 135 16.544 -13.435 -23.363 1.00 0.00 H new ATOM 0 HB3 SER A 135 16.381 -12.273 -24.664 1.00 0.00 H new ATOM 0 HG SER A 135 17.976 -13.892 -25.127 1.00 0.00 H new ATOM 146 N ARG A 136 19.238 -9.947 -23.274 1.00 0.00 N ATOM 147 CA ARG A 136 19.946 -8.846 -23.917 1.00 0.00 C ATOM 148 C ARG A 136 21.430 -8.873 -23.562 1.00 0.00 C ATOM 149 O ARG A 136 21.933 -8.022 -22.827 1.00 0.00 O ATOM 150 CB ARG A 136 19.335 -7.507 -23.501 1.00 0.00 C ATOM 151 CG ARG A 136 19.685 -6.361 -24.437 1.00 0.00 C ATOM 152 CD ARG A 136 19.088 -6.569 -25.820 1.00 0.00 C ATOM 153 NE ARG A 136 17.647 -6.805 -25.765 1.00 0.00 N ATOM 154 CZ ARG A 136 16.933 -7.238 -26.797 1.00 0.00 C ATOM 155 NH1 ARG A 136 17.523 -7.483 -27.959 1.00 0.00 N ATOM 156 NH2 ARG A 136 15.626 -7.429 -26.669 1.00 0.00 N ATOM 0 H ARG A 136 19.735 -10.366 -22.488 1.00 0.00 H new ATOM 0 HA ARG A 136 19.846 -8.963 -24.996 1.00 0.00 H new ATOM 0 HB2 ARG A 136 18.251 -7.610 -23.456 1.00 0.00 H new ATOM 0 HB3 ARG A 136 19.674 -7.260 -22.495 1.00 0.00 H new ATOM 0 HG2 ARG A 136 19.319 -5.423 -24.019 1.00 0.00 H new ATOM 0 HG3 ARG A 136 20.769 -6.273 -24.517 1.00 0.00 H new ATOM 0 HD2 ARG A 136 19.288 -5.693 -26.437 1.00 0.00 H new ATOM 0 HD3 ARG A 136 19.576 -7.416 -26.302 1.00 0.00 H new ATOM 0 HE ARG A 136 17.163 -6.627 -24.885 1.00 0.00 H new ATOM 0 HH11 ARG A 136 18.528 -7.339 -28.061 1.00 0.00 H new ATOM 0 HH12 ARG A 136 16.972 -7.816 -28.750 1.00 0.00 H new ATOM 0 HH21 ARG A 136 15.168 -7.243 -25.777 1.00 0.00 H new ATOM 0 HH22 ARG A 136 15.079 -7.762 -27.463 1.00 0.00 H new ATOM 170 N PRO A 137 22.148 -9.872 -24.095 1.00 0.00 N ATOM 171 CA PRO A 137 23.584 -10.033 -23.848 1.00 0.00 C ATOM 172 C PRO A 137 24.414 -8.947 -24.523 1.00 0.00 C ATOM 173 O PRO A 137 25.283 -8.338 -23.898 1.00 0.00 O ATOM 174 CB PRO A 137 23.897 -11.402 -24.459 1.00 0.00 C ATOM 175 CG PRO A 137 22.850 -11.600 -25.500 1.00 0.00 C ATOM 176 CD PRO A 137 21.614 -10.921 -24.979 1.00 0.00 C ATOM 0 HA PRO A 137 23.826 -9.958 -22.788 1.00 0.00 H new ATOM 0 HB2 PRO A 137 24.896 -11.422 -24.894 1.00 0.00 H new ATOM 0 HB3 PRO A 137 23.861 -12.189 -23.706 1.00 0.00 H new ATOM 0 HG2 PRO A 137 23.160 -11.169 -26.452 1.00 0.00 H new ATOM 0 HG3 PRO A 137 22.669 -12.661 -25.674 1.00 0.00 H new ATOM 0 HD2 PRO A 137 21.016 -10.500 -25.787 1.00 0.00 H new ATOM 0 HD3 PRO A 137 20.972 -11.615 -24.437 1.00 0.00 H new ATOM 184 N ILE A 138 24.140 -8.708 -25.801 1.00 0.00 N ATOM 185 CA ILE A 138 24.861 -7.693 -26.560 1.00 0.00 C ATOM 186 C ILE A 138 23.912 -6.619 -27.081 1.00 0.00 C ATOM 187 O ILE A 138 23.236 -6.812 -28.092 1.00 0.00 O ATOM 188 CB ILE A 138 25.621 -8.312 -27.748 1.00 0.00 C ATOM 189 CG1 ILE A 138 26.633 -9.346 -27.251 1.00 0.00 C ATOM 190 CG2 ILE A 138 26.317 -7.226 -28.554 1.00 0.00 C ATOM 191 CD1 ILE A 138 26.058 -10.739 -27.119 1.00 0.00 C ATOM 0 H ILE A 138 23.424 -9.203 -26.333 1.00 0.00 H new ATOM 0 HA ILE A 138 25.579 -7.239 -25.877 1.00 0.00 H new ATOM 0 HB ILE A 138 24.904 -8.816 -28.397 1.00 0.00 H new ATOM 0 HG12 ILE A 138 27.479 -9.374 -27.938 1.00 0.00 H new ATOM 0 HG13 ILE A 138 27.020 -9.028 -26.283 1.00 0.00 H new ATOM 0 HG21 ILE A 138 26.850 -7.679 -29.390 1.00 0.00 H new ATOM 0 HG22 ILE A 138 25.576 -6.523 -28.934 1.00 0.00 H new ATOM 0 HG23 ILE A 138 27.025 -6.697 -27.916 1.00 0.00 H new ATOM 0 HD11 ILE A 138 26.831 -11.419 -26.762 1.00 0.00 H new ATOM 0 HD12 ILE A 138 25.231 -10.725 -26.409 1.00 0.00 H new ATOM 0 HD13 ILE A 138 25.697 -11.077 -28.090 1.00 0.00 H new ATOM 203 N ILE A 139 23.868 -5.488 -26.386 1.00 0.00 N ATOM 204 CA ILE A 139 23.004 -4.382 -26.781 1.00 0.00 C ATOM 205 C ILE A 139 23.757 -3.378 -27.646 1.00 0.00 C ATOM 206 O ILE A 139 24.982 -3.270 -27.568 1.00 0.00 O ATOM 207 CB ILE A 139 22.426 -3.654 -25.553 1.00 0.00 C ATOM 208 CG1 ILE A 139 21.299 -2.710 -25.977 1.00 0.00 C ATOM 209 CG2 ILE A 139 23.522 -2.887 -24.828 1.00 0.00 C ATOM 210 CD1 ILE A 139 20.277 -2.462 -24.890 1.00 0.00 C ATOM 0 H ILE A 139 24.420 -5.313 -25.547 1.00 0.00 H new ATOM 0 HA ILE A 139 22.185 -4.811 -27.358 1.00 0.00 H new ATOM 0 HB ILE A 139 22.015 -4.396 -24.869 1.00 0.00 H new ATOM 0 HG12 ILE A 139 21.730 -1.757 -26.283 1.00 0.00 H new ATOM 0 HG13 ILE A 139 20.796 -3.127 -26.849 1.00 0.00 H new ATOM 0 HG21 ILE A 139 23.098 -2.378 -23.962 1.00 0.00 H new ATOM 0 HG22 ILE A 139 24.295 -3.581 -24.498 1.00 0.00 H new ATOM 0 HG23 ILE A 139 23.959 -2.152 -25.503 1.00 0.00 H new ATOM 0 HD11 ILE A 139 19.508 -1.784 -25.261 1.00 0.00 H new ATOM 0 HD12 ILE A 139 19.818 -3.407 -24.600 1.00 0.00 H new ATOM 0 HD13 ILE A 139 20.767 -2.016 -24.025 1.00 0.00 H new ATOM 222 N HIS A 140 23.017 -2.642 -28.470 1.00 0.00 N ATOM 223 CA HIS A 140 23.615 -1.644 -29.349 1.00 0.00 C ATOM 224 C HIS A 140 24.591 -2.294 -30.325 1.00 0.00 C ATOM 225 O HIS A 140 24.948 -3.463 -30.176 1.00 0.00 O ATOM 226 CB HIS A 140 24.335 -0.575 -28.526 1.00 0.00 C ATOM 227 CG HIS A 140 24.510 0.723 -29.253 1.00 0.00 C ATOM 228 ND1 HIS A 140 25.729 1.354 -29.383 1.00 0.00 N ATOM 229 CD2 HIS A 140 23.612 1.508 -29.893 1.00 0.00 C ATOM 230 CE1 HIS A 140 25.573 2.472 -30.069 1.00 0.00 C ATOM 231 NE2 HIS A 140 24.297 2.588 -30.391 1.00 0.00 N ATOM 0 H HIS A 140 22.003 -2.718 -28.547 1.00 0.00 H new ATOM 0 HA HIS A 140 22.815 -1.174 -29.921 1.00 0.00 H new ATOM 0 HB2 HIS A 140 23.774 -0.396 -27.609 1.00 0.00 H new ATOM 0 HB3 HIS A 140 25.314 -0.953 -28.232 1.00 0.00 H new ATOM 0 HD2 HIS A 140 22.553 1.320 -29.993 1.00 0.00 H new ATOM 0 HE1 HIS A 140 26.355 3.172 -30.323 1.00 0.00 H new ATOM 0 HE2 HIS A 140 23.887 3.356 -30.923 1.00 0.00 H new ATOM 239 N PHE A 141 25.019 -1.529 -31.324 1.00 0.00 N ATOM 240 CA PHE A 141 25.953 -2.031 -32.325 1.00 0.00 C ATOM 241 C PHE A 141 27.154 -2.699 -31.663 1.00 0.00 C ATOM 242 O PHE A 141 27.731 -3.642 -32.204 1.00 0.00 O ATOM 243 CB PHE A 141 26.423 -0.892 -33.232 1.00 0.00 C ATOM 244 CG PHE A 141 25.366 -0.407 -34.182 1.00 0.00 C ATOM 245 CD1 PHE A 141 25.020 -1.156 -35.295 1.00 0.00 C ATOM 246 CD2 PHE A 141 24.720 0.799 -33.963 1.00 0.00 C ATOM 247 CE1 PHE A 141 24.048 -0.712 -36.172 1.00 0.00 C ATOM 248 CE2 PHE A 141 23.746 1.247 -34.836 1.00 0.00 C ATOM 249 CZ PHE A 141 23.411 0.491 -35.943 1.00 0.00 C ATOM 0 H PHE A 141 24.734 -0.559 -31.462 1.00 0.00 H new ATOM 0 HA PHE A 141 25.434 -2.775 -32.929 1.00 0.00 H new ATOM 0 HB2 PHE A 141 26.754 -0.058 -32.613 1.00 0.00 H new ATOM 0 HB3 PHE A 141 27.288 -1.227 -33.804 1.00 0.00 H new ATOM 0 HD1 PHE A 141 25.515 -2.098 -35.480 1.00 0.00 H new ATOM 0 HD2 PHE A 141 24.980 1.396 -33.101 1.00 0.00 H new ATOM 0 HE1 PHE A 141 23.787 -1.306 -37.036 1.00 0.00 H new ATOM 0 HE2 PHE A 141 23.247 2.187 -34.653 1.00 0.00 H new ATOM 0 HZ PHE A 141 22.652 0.841 -36.628 1.00 0.00 H new ATOM 259 N GLY A 142 27.527 -2.201 -30.488 1.00 0.00 N ATOM 260 CA GLY A 142 28.658 -2.760 -29.770 1.00 0.00 C ATOM 261 C GLY A 142 29.918 -2.794 -30.611 1.00 0.00 C ATOM 262 O GLY A 142 30.593 -3.820 -30.689 1.00 0.00 O ATOM 0 H GLY A 142 27.066 -1.420 -30.020 1.00 0.00 H new ATOM 0 HA2 GLY A 142 28.841 -2.171 -28.871 1.00 0.00 H new ATOM 0 HA3 GLY A 142 28.414 -3.771 -29.445 1.00 0.00 H new ATOM 266 N SER A 143 30.236 -1.669 -31.244 1.00 0.00 N ATOM 267 CA SER A 143 31.421 -1.576 -32.088 1.00 0.00 C ATOM 268 C SER A 143 32.661 -2.055 -31.340 1.00 0.00 C ATOM 269 O SER A 143 32.617 -2.294 -30.133 1.00 0.00 O ATOM 270 CB SER A 143 31.624 -0.135 -32.562 1.00 0.00 C ATOM 271 OG SER A 143 30.966 0.093 -33.797 1.00 0.00 O ATOM 0 H SER A 143 29.689 -0.810 -31.188 1.00 0.00 H new ATOM 0 HA SER A 143 31.270 -2.219 -32.955 1.00 0.00 H new ATOM 0 HB2 SER A 143 31.242 0.556 -31.810 1.00 0.00 H new ATOM 0 HB3 SER A 143 32.689 0.069 -32.671 1.00 0.00 H new ATOM 0 HG SER A 143 31.109 1.021 -34.078 1.00 0.00 H new ATOM 277 N ASP A 144 33.765 -2.194 -32.065 1.00 0.00 N ATOM 278 CA ASP A 144 35.019 -2.645 -31.470 1.00 0.00 C ATOM 279 C ASP A 144 35.510 -1.652 -30.422 1.00 0.00 C ATOM 280 O ASP A 144 36.122 -2.038 -29.425 1.00 0.00 O ATOM 281 CB ASP A 144 36.083 -2.831 -32.553 1.00 0.00 C ATOM 282 CG ASP A 144 36.252 -4.283 -32.954 1.00 0.00 C ATOM 283 OD1 ASP A 144 36.383 -5.137 -32.052 1.00 0.00 O ATOM 284 OD2 ASP A 144 36.254 -4.566 -34.171 1.00 0.00 O ATOM 0 H ASP A 144 33.818 -2.001 -33.065 1.00 0.00 H new ATOM 0 HA ASP A 144 34.838 -3.602 -30.981 1.00 0.00 H new ATOM 0 HB2 ASP A 144 35.811 -2.244 -33.430 1.00 0.00 H new ATOM 0 HB3 ASP A 144 37.036 -2.443 -32.193 1.00 0.00 H new ATOM 289 N TYR A 145 35.240 -0.372 -30.653 1.00 0.00 N ATOM 290 CA TYR A 145 35.658 0.676 -29.730 1.00 0.00 C ATOM 291 C TYR A 145 34.810 0.656 -28.462 1.00 0.00 C ATOM 292 O TYR A 145 35.337 0.606 -27.351 1.00 0.00 O ATOM 293 CB TYR A 145 35.557 2.047 -30.403 1.00 0.00 C ATOM 294 CG TYR A 145 36.231 2.109 -31.755 1.00 0.00 C ATOM 295 CD1 TYR A 145 37.607 2.263 -31.860 1.00 0.00 C ATOM 296 CD2 TYR A 145 35.491 2.012 -32.927 1.00 0.00 C ATOM 297 CE1 TYR A 145 38.227 2.321 -33.093 1.00 0.00 C ATOM 298 CE2 TYR A 145 36.102 2.068 -34.164 1.00 0.00 C ATOM 299 CZ TYR A 145 37.470 2.223 -34.242 1.00 0.00 C ATOM 300 OH TYR A 145 38.084 2.279 -35.473 1.00 0.00 O ATOM 0 H TYR A 145 34.733 -0.035 -31.472 1.00 0.00 H new ATOM 0 HA TYR A 145 36.696 0.489 -29.454 1.00 0.00 H new ATOM 0 HB2 TYR A 145 34.505 2.309 -30.518 1.00 0.00 H new ATOM 0 HB3 TYR A 145 36.003 2.797 -29.749 1.00 0.00 H new ATOM 0 HD1 TYR A 145 38.203 2.339 -30.962 1.00 0.00 H new ATOM 0 HD2 TYR A 145 34.419 1.891 -32.869 1.00 0.00 H new ATOM 0 HE1 TYR A 145 39.298 2.442 -33.157 1.00 0.00 H new ATOM 0 HE2 TYR A 145 35.512 1.991 -35.065 1.00 0.00 H new ATOM 0 HH TYR A 145 37.410 2.194 -36.179 1.00 0.00 H new ATOM 310 N GLU A 146 33.493 0.695 -28.638 1.00 0.00 N ATOM 311 CA GLU A 146 32.571 0.680 -27.508 1.00 0.00 C ATOM 312 C GLU A 146 32.647 -0.648 -26.760 1.00 0.00 C ATOM 313 O GLU A 146 32.416 -0.706 -25.553 1.00 0.00 O ATOM 314 CB GLU A 146 31.139 0.927 -27.987 1.00 0.00 C ATOM 315 CG GLU A 146 30.915 2.323 -28.544 1.00 0.00 C ATOM 316 CD GLU A 146 29.641 2.961 -28.026 1.00 0.00 C ATOM 317 OE1 GLU A 146 29.533 3.159 -26.798 1.00 0.00 O ATOM 318 OE2 GLU A 146 28.752 3.263 -28.849 1.00 0.00 O ATOM 0 H GLU A 146 33.041 0.737 -29.551 1.00 0.00 H new ATOM 0 HA GLU A 146 32.861 1.478 -26.825 1.00 0.00 H new ATOM 0 HB2 GLU A 146 30.890 0.194 -28.755 1.00 0.00 H new ATOM 0 HB3 GLU A 146 30.453 0.762 -27.156 1.00 0.00 H new ATOM 0 HG2 GLU A 146 31.765 2.954 -28.284 1.00 0.00 H new ATOM 0 HG3 GLU A 146 30.876 2.274 -29.632 1.00 0.00 H new ATOM 325 N ASP A 147 32.973 -1.711 -27.487 1.00 0.00 N ATOM 326 CA ASP A 147 33.080 -3.039 -26.894 1.00 0.00 C ATOM 327 C ASP A 147 33.979 -3.012 -25.661 1.00 0.00 C ATOM 328 O ASP A 147 33.743 -3.735 -24.693 1.00 0.00 O ATOM 329 CB ASP A 147 33.627 -4.035 -27.917 1.00 0.00 C ATOM 330 CG ASP A 147 32.564 -4.996 -28.414 1.00 0.00 C ATOM 331 OD1 ASP A 147 31.369 -4.642 -28.351 1.00 0.00 O ATOM 332 OD2 ASP A 147 32.928 -6.102 -28.866 1.00 0.00 O ATOM 0 H ASP A 147 33.168 -1.679 -28.488 1.00 0.00 H new ATOM 0 HA ASP A 147 32.083 -3.355 -26.588 1.00 0.00 H new ATOM 0 HB2 ASP A 147 34.044 -3.490 -28.764 1.00 0.00 H new ATOM 0 HB3 ASP A 147 34.443 -4.601 -27.468 1.00 0.00 H new ATOM 337 N ARG A 148 35.011 -2.175 -25.705 1.00 0.00 N ATOM 338 CA ARG A 148 35.946 -2.056 -24.594 1.00 0.00 C ATOM 339 C ARG A 148 35.219 -1.666 -23.310 1.00 0.00 C ATOM 340 O ARG A 148 35.380 -2.309 -22.273 1.00 0.00 O ATOM 341 CB ARG A 148 37.025 -1.021 -24.916 1.00 0.00 C ATOM 342 CG ARG A 148 37.976 -1.455 -26.020 1.00 0.00 C ATOM 343 CD ARG A 148 38.519 -0.260 -26.789 1.00 0.00 C ATOM 344 NE ARG A 148 39.221 0.678 -25.917 1.00 0.00 N ATOM 345 CZ ARG A 148 39.665 1.864 -26.320 1.00 0.00 C ATOM 346 NH1 ARG A 148 39.480 2.253 -27.574 1.00 0.00 N ATOM 347 NH2 ARG A 148 40.295 2.662 -25.468 1.00 0.00 N ATOM 0 H ARG A 148 35.220 -1.569 -26.499 1.00 0.00 H new ATOM 0 HA ARG A 148 36.417 -3.027 -24.444 1.00 0.00 H new ATOM 0 HB2 ARG A 148 36.545 -0.087 -25.208 1.00 0.00 H new ATOM 0 HB3 ARG A 148 37.600 -0.815 -24.013 1.00 0.00 H new ATOM 0 HG2 ARG A 148 38.804 -2.018 -25.588 1.00 0.00 H new ATOM 0 HG3 ARG A 148 37.458 -2.125 -26.706 1.00 0.00 H new ATOM 0 HD2 ARG A 148 39.197 -0.608 -27.568 1.00 0.00 H new ATOM 0 HD3 ARG A 148 37.697 0.254 -27.288 1.00 0.00 H new ATOM 0 HE ARG A 148 39.379 0.408 -24.946 1.00 0.00 H new ATOM 0 HH11 ARG A 148 38.996 1.642 -28.232 1.00 0.00 H new ATOM 0 HH12 ARG A 148 39.822 3.164 -27.881 1.00 0.00 H new ATOM 0 HH21 ARG A 148 40.439 2.365 -24.503 1.00 0.00 H new ATOM 0 HH22 ARG A 148 40.635 3.572 -25.778 1.00 0.00 H new ATOM 361 N TYR A 149 34.418 -0.609 -23.388 1.00 0.00 N ATOM 362 CA TYR A 149 33.669 -0.131 -22.233 1.00 0.00 C ATOM 363 C TYR A 149 32.476 -1.038 -21.944 1.00 0.00 C ATOM 364 O TYR A 149 32.283 -1.489 -20.815 1.00 0.00 O ATOM 365 CB TYR A 149 33.189 1.303 -22.467 1.00 0.00 C ATOM 366 CG TYR A 149 34.000 2.341 -21.726 1.00 0.00 C ATOM 367 CD1 TYR A 149 35.383 2.388 -21.848 1.00 0.00 C ATOM 368 CD2 TYR A 149 33.383 3.276 -20.904 1.00 0.00 C ATOM 369 CE1 TYR A 149 36.128 3.335 -21.172 1.00 0.00 C ATOM 370 CE2 TYR A 149 34.120 4.227 -20.225 1.00 0.00 C ATOM 371 CZ TYR A 149 35.492 4.253 -20.362 1.00 0.00 C ATOM 372 OH TYR A 149 36.231 5.198 -19.688 1.00 0.00 O ATOM 0 H TYR A 149 34.271 -0.067 -24.240 1.00 0.00 H new ATOM 0 HA TYR A 149 34.333 -0.148 -21.369 1.00 0.00 H new ATOM 0 HB2 TYR A 149 33.225 1.520 -23.535 1.00 0.00 H new ATOM 0 HB3 TYR A 149 32.146 1.383 -22.161 1.00 0.00 H new ATOM 0 HD1 TYR A 149 35.884 1.672 -22.482 1.00 0.00 H new ATOM 0 HD2 TYR A 149 32.309 3.259 -20.794 1.00 0.00 H new ATOM 0 HE1 TYR A 149 37.203 3.357 -21.277 1.00 0.00 H new ATOM 0 HE2 TYR A 149 33.624 4.946 -19.590 1.00 0.00 H new ATOM 0 HH TYR A 149 35.632 5.768 -19.163 1.00 0.00 H new ATOM 382 N TYR A 150 31.679 -1.300 -22.974 1.00 0.00 N ATOM 383 CA TYR A 150 30.503 -2.152 -22.832 1.00 0.00 C ATOM 384 C TYR A 150 30.876 -3.498 -22.219 1.00 0.00 C ATOM 385 O TYR A 150 30.057 -4.142 -21.564 1.00 0.00 O ATOM 386 CB TYR A 150 29.836 -2.365 -24.192 1.00 0.00 C ATOM 387 CG TYR A 150 28.623 -3.265 -24.136 1.00 0.00 C ATOM 388 CD1 TYR A 150 27.540 -2.957 -23.322 1.00 0.00 C ATOM 389 CD2 TYR A 150 28.558 -4.425 -24.899 1.00 0.00 C ATOM 390 CE1 TYR A 150 26.430 -3.777 -23.267 1.00 0.00 C ATOM 391 CE2 TYR A 150 27.451 -5.250 -24.852 1.00 0.00 C ATOM 392 CZ TYR A 150 26.390 -4.922 -24.034 1.00 0.00 C ATOM 393 OH TYR A 150 25.286 -5.741 -23.984 1.00 0.00 O ATOM 0 H TYR A 150 31.825 -0.935 -23.915 1.00 0.00 H new ATOM 0 HA TYR A 150 29.801 -1.652 -22.164 1.00 0.00 H new ATOM 0 HB2 TYR A 150 29.542 -1.397 -24.599 1.00 0.00 H new ATOM 0 HB3 TYR A 150 30.564 -2.793 -24.881 1.00 0.00 H new ATOM 0 HD1 TYR A 150 27.567 -2.060 -22.721 1.00 0.00 H new ATOM 0 HD2 TYR A 150 29.387 -4.686 -25.540 1.00 0.00 H new ATOM 0 HE1 TYR A 150 25.598 -3.523 -22.627 1.00 0.00 H new ATOM 0 HE2 TYR A 150 27.416 -6.147 -25.453 1.00 0.00 H new ATOM 0 HH TYR A 150 25.556 -6.636 -23.690 1.00 0.00 H new ATOM 403 N ARG A 151 32.119 -3.916 -22.437 1.00 0.00 N ATOM 404 CA ARG A 151 32.602 -5.185 -21.907 1.00 0.00 C ATOM 405 C ARG A 151 32.513 -5.208 -20.384 1.00 0.00 C ATOM 406 O ARG A 151 32.180 -6.231 -19.788 1.00 0.00 O ATOM 407 CB ARG A 151 34.046 -5.430 -22.348 1.00 0.00 C ATOM 408 CG ARG A 151 34.703 -6.611 -21.652 1.00 0.00 C ATOM 409 CD ARG A 151 35.463 -7.485 -22.637 1.00 0.00 C ATOM 410 NE ARG A 151 36.504 -6.740 -23.341 1.00 0.00 N ATOM 411 CZ ARG A 151 37.648 -6.367 -22.779 1.00 0.00 C ATOM 412 NH1 ARG A 151 37.898 -6.668 -21.512 1.00 0.00 N ATOM 413 NH2 ARG A 151 38.546 -5.691 -23.485 1.00 0.00 N ATOM 0 H ARG A 151 32.809 -3.394 -22.977 1.00 0.00 H new ATOM 0 HA ARG A 151 31.969 -5.979 -22.302 1.00 0.00 H new ATOM 0 HB2 ARG A 151 34.065 -5.597 -23.425 1.00 0.00 H new ATOM 0 HB3 ARG A 151 34.633 -4.532 -22.155 1.00 0.00 H new ATOM 0 HG2 ARG A 151 35.386 -6.248 -20.884 1.00 0.00 H new ATOM 0 HG3 ARG A 151 33.942 -7.206 -21.147 1.00 0.00 H new ATOM 0 HD2 ARG A 151 35.914 -8.323 -22.105 1.00 0.00 H new ATOM 0 HD3 ARG A 151 34.765 -7.906 -23.361 1.00 0.00 H new ATOM 0 HE ARG A 151 36.343 -6.493 -24.317 1.00 0.00 H new ATOM 0 HH11 ARG A 151 37.211 -7.188 -20.966 1.00 0.00 H new ATOM 0 HH12 ARG A 151 38.778 -6.380 -21.083 1.00 0.00 H new ATOM 0 HH21 ARG A 151 38.358 -5.458 -24.460 1.00 0.00 H new ATOM 0 HH22 ARG A 151 39.424 -5.405 -23.053 1.00 0.00 H new ATOM 427 N GLU A 152 32.813 -4.072 -19.762 1.00 0.00 N ATOM 428 CA GLU A 152 32.768 -3.963 -18.309 1.00 0.00 C ATOM 429 C GLU A 152 31.388 -3.512 -17.839 1.00 0.00 C ATOM 430 O GLU A 152 31.063 -3.603 -16.656 1.00 0.00 O ATOM 431 CB GLU A 152 33.832 -2.980 -17.816 1.00 0.00 C ATOM 432 CG GLU A 152 35.241 -3.333 -18.263 1.00 0.00 C ATOM 433 CD GLU A 152 36.124 -3.778 -17.113 1.00 0.00 C ATOM 434 OE1 GLU A 152 36.423 -2.941 -16.236 1.00 0.00 O ATOM 435 OE2 GLU A 152 36.515 -4.963 -17.091 1.00 0.00 O ATOM 0 H GLU A 152 33.090 -3.215 -20.241 1.00 0.00 H new ATOM 0 HA GLU A 152 32.971 -4.949 -17.890 1.00 0.00 H new ATOM 0 HB2 GLU A 152 33.586 -1.981 -18.175 1.00 0.00 H new ATOM 0 HB3 GLU A 152 33.804 -2.943 -16.727 1.00 0.00 H new ATOM 0 HG2 GLU A 152 35.193 -4.127 -19.008 1.00 0.00 H new ATOM 0 HG3 GLU A 152 35.692 -2.467 -18.748 1.00 0.00 H new ATOM 442 N ASN A 153 30.580 -3.027 -18.776 1.00 0.00 N ATOM 443 CA ASN A 153 29.235 -2.561 -18.459 1.00 0.00 C ATOM 444 C ASN A 153 28.230 -3.706 -18.541 1.00 0.00 C ATOM 445 O ASN A 153 27.184 -3.675 -17.892 1.00 0.00 O ATOM 446 CB ASN A 153 28.824 -1.437 -19.412 1.00 0.00 C ATOM 447 CG ASN A 153 29.911 -0.393 -19.578 1.00 0.00 C ATOM 448 OD1 ASN A 153 30.195 0.053 -20.690 1.00 0.00 O ATOM 449 ND2 ASN A 153 30.527 0.001 -18.470 1.00 0.00 N ATOM 0 H ASN A 153 30.833 -2.946 -19.761 1.00 0.00 H new ATOM 0 HA ASN A 153 29.241 -2.178 -17.438 1.00 0.00 H new ATOM 0 HB2 ASN A 153 28.580 -1.861 -20.386 1.00 0.00 H new ATOM 0 HB3 ASN A 153 27.919 -0.959 -19.037 1.00 0.00 H new ATOM 0 HD21 ASN A 153 31.268 0.700 -18.520 1.00 0.00 H new ATOM 0 HD22 ASN A 153 30.259 -0.395 -17.569 1.00 0.00 H new ATOM 456 N MET A 154 28.554 -4.715 -19.343 1.00 0.00 N ATOM 457 CA MET A 154 27.680 -5.871 -19.508 1.00 0.00 C ATOM 458 C MET A 154 27.728 -6.769 -18.277 1.00 0.00 C ATOM 459 O MET A 154 26.753 -7.447 -17.952 1.00 0.00 O ATOM 460 CB MET A 154 28.082 -6.667 -20.751 1.00 0.00 C ATOM 461 CG MET A 154 29.517 -7.167 -20.714 1.00 0.00 C ATOM 462 SD MET A 154 29.835 -8.457 -21.934 1.00 0.00 S ATOM 463 CE MET A 154 29.011 -7.774 -23.371 1.00 0.00 C ATOM 0 H MET A 154 29.415 -4.756 -19.889 1.00 0.00 H new ATOM 0 HA MET A 154 26.659 -5.509 -19.631 1.00 0.00 H new ATOM 0 HB2 MET A 154 27.411 -7.519 -20.859 1.00 0.00 H new ATOM 0 HB3 MET A 154 27.947 -6.041 -21.633 1.00 0.00 H new ATOM 0 HG2 MET A 154 30.194 -6.331 -20.890 1.00 0.00 H new ATOM 0 HG3 MET A 154 29.738 -7.551 -19.718 1.00 0.00 H new ATOM 0 HE1 MET A 154 29.266 -8.364 -24.251 1.00 0.00 H new ATOM 0 HE2 MET A 154 27.932 -7.798 -23.218 1.00 0.00 H new ATOM 0 HE3 MET A 154 29.333 -6.743 -23.520 1.00 0.00 H new ATOM 473 N HIS A 155 28.869 -6.770 -17.594 1.00 0.00 N ATOM 474 CA HIS A 155 29.043 -7.585 -16.397 1.00 0.00 C ATOM 475 C HIS A 155 28.241 -7.017 -15.231 1.00 0.00 C ATOM 476 O HIS A 155 27.804 -7.754 -14.347 1.00 0.00 O ATOM 477 CB HIS A 155 30.523 -7.668 -16.022 1.00 0.00 C ATOM 478 CG HIS A 155 31.090 -9.051 -16.122 1.00 0.00 C ATOM 479 ND1 HIS A 155 30.852 -10.031 -15.182 1.00 0.00 N ATOM 480 CD2 HIS A 155 31.887 -9.615 -17.059 1.00 0.00 C ATOM 481 CE1 HIS A 155 31.480 -11.139 -15.535 1.00 0.00 C ATOM 482 NE2 HIS A 155 32.115 -10.913 -16.671 1.00 0.00 N ATOM 0 H HIS A 155 29.686 -6.216 -17.849 1.00 0.00 H new ATOM 0 HA HIS A 155 28.674 -8.588 -16.613 1.00 0.00 H new ATOM 0 HB2 HIS A 155 31.092 -7.003 -16.672 1.00 0.00 H new ATOM 0 HB3 HIS A 155 30.652 -7.304 -15.003 1.00 0.00 H new ATOM 0 HD2 HIS A 155 32.272 -9.134 -17.946 1.00 0.00 H new ATOM 0 HE1 HIS A 155 31.475 -12.070 -14.988 1.00 0.00 H new ATOM 0 HE2 HIS A 155 32.683 -11.592 -17.178 1.00 0.00 H new ATOM 490 N ARG A 156 28.053 -5.701 -15.234 1.00 0.00 N ATOM 491 CA ARG A 156 27.306 -5.034 -14.175 1.00 0.00 C ATOM 492 C ARG A 156 26.013 -4.432 -14.718 1.00 0.00 C ATOM 493 O ARG A 156 25.364 -3.625 -14.052 1.00 0.00 O ATOM 494 CB ARG A 156 28.159 -3.939 -13.532 1.00 0.00 C ATOM 495 CG ARG A 156 28.482 -4.199 -12.070 1.00 0.00 C ATOM 496 CD ARG A 156 29.437 -5.372 -11.910 1.00 0.00 C ATOM 497 NE ARG A 156 30.801 -5.025 -12.302 1.00 0.00 N ATOM 498 CZ ARG A 156 31.595 -4.241 -11.581 1.00 0.00 C ATOM 499 NH1 ARG A 156 31.164 -3.727 -10.437 1.00 0.00 N ATOM 500 NH2 ARG A 156 32.824 -3.971 -12.004 1.00 0.00 N ATOM 0 H ARG A 156 28.408 -5.076 -15.958 1.00 0.00 H new ATOM 0 HA ARG A 156 27.052 -5.778 -13.420 1.00 0.00 H new ATOM 0 HB2 ARG A 156 29.091 -3.841 -14.089 1.00 0.00 H new ATOM 0 HB3 ARG A 156 27.636 -2.986 -13.616 1.00 0.00 H new ATOM 0 HG2 ARG A 156 28.925 -3.306 -11.630 1.00 0.00 H new ATOM 0 HG3 ARG A 156 27.561 -4.401 -11.523 1.00 0.00 H new ATOM 0 HD2 ARG A 156 29.432 -5.705 -10.872 1.00 0.00 H new ATOM 0 HD3 ARG A 156 29.088 -6.209 -12.515 1.00 0.00 H new ATOM 0 HE ARG A 156 31.163 -5.405 -13.176 1.00 0.00 H new ATOM 0 HH11 ARG A 156 30.221 -3.933 -10.109 1.00 0.00 H new ATOM 0 HH12 ARG A 156 31.776 -3.125 -9.886 1.00 0.00 H new ATOM 0 HH21 ARG A 156 33.159 -4.366 -12.883 1.00 0.00 H new ATOM 0 HH22 ARG A 156 33.433 -3.369 -11.450 1.00 0.00 H new ATOM 514 N TYR A 157 25.645 -4.831 -15.931 1.00 0.00 N ATOM 515 CA TYR A 157 24.431 -4.329 -16.564 1.00 0.00 C ATOM 516 C TYR A 157 23.229 -4.480 -15.637 1.00 0.00 C ATOM 517 O TYR A 157 23.197 -5.341 -14.757 1.00 0.00 O ATOM 518 CB TYR A 157 24.173 -5.070 -17.877 1.00 0.00 C ATOM 519 CG TYR A 157 23.513 -6.418 -17.692 1.00 0.00 C ATOM 520 CD1 TYR A 157 24.071 -7.377 -16.857 1.00 0.00 C ATOM 521 CD2 TYR A 157 22.332 -6.732 -18.353 1.00 0.00 C ATOM 522 CE1 TYR A 157 23.473 -8.610 -16.685 1.00 0.00 C ATOM 523 CE2 TYR A 157 21.725 -7.962 -18.186 1.00 0.00 C ATOM 524 CZ TYR A 157 22.300 -8.898 -17.351 1.00 0.00 C ATOM 525 OH TYR A 157 21.699 -10.124 -17.184 1.00 0.00 O ATOM 0 H TYR A 157 26.170 -5.500 -16.495 1.00 0.00 H new ATOM 0 HA TYR A 157 24.573 -3.269 -16.774 1.00 0.00 H new ATOM 0 HB2 TYR A 157 23.543 -4.451 -18.516 1.00 0.00 H new ATOM 0 HB3 TYR A 157 25.120 -5.207 -18.399 1.00 0.00 H new ATOM 0 HD1 TYR A 157 24.989 -7.155 -16.333 1.00 0.00 H new ATOM 0 HD2 TYR A 157 21.881 -6.002 -19.009 1.00 0.00 H new ATOM 0 HE1 TYR A 157 23.921 -9.345 -16.033 1.00 0.00 H new ATOM 0 HE2 TYR A 157 20.806 -8.189 -18.706 1.00 0.00 H new ATOM 0 HH TYR A 157 21.261 -10.157 -16.308 1.00 0.00 H new ATOM 535 N PRO A 158 22.217 -3.624 -15.838 1.00 0.00 N ATOM 536 CA PRO A 158 20.993 -3.643 -15.031 1.00 0.00 C ATOM 537 C PRO A 158 20.136 -4.874 -15.305 1.00 0.00 C ATOM 538 O PRO A 158 19.912 -5.242 -16.457 1.00 0.00 O ATOM 539 CB PRO A 158 20.260 -2.373 -15.470 1.00 0.00 C ATOM 540 CG PRO A 158 20.759 -2.104 -16.847 1.00 0.00 C ATOM 541 CD PRO A 158 22.188 -2.573 -16.869 1.00 0.00 C ATOM 0 HA PRO A 158 21.209 -3.680 -13.963 1.00 0.00 H new ATOM 0 HB2 PRO A 158 19.180 -2.517 -15.462 1.00 0.00 H new ATOM 0 HB3 PRO A 158 20.476 -1.540 -14.801 1.00 0.00 H new ATOM 0 HG2 PRO A 158 20.163 -2.635 -17.589 1.00 0.00 H new ATOM 0 HG3 PRO A 158 20.693 -1.042 -17.086 1.00 0.00 H new ATOM 0 HD2 PRO A 158 22.468 -2.962 -17.848 1.00 0.00 H new ATOM 0 HD3 PRO A 158 22.880 -1.764 -16.638 1.00 0.00 H new ATOM 549 N ASN A 159 19.659 -5.507 -14.238 1.00 0.00 N ATOM 550 CA ASN A 159 18.826 -6.697 -14.364 1.00 0.00 C ATOM 551 C ASN A 159 17.407 -6.422 -13.879 1.00 0.00 C ATOM 552 O ASN A 159 16.713 -7.327 -13.415 1.00 0.00 O ATOM 553 CB ASN A 159 19.434 -7.856 -13.571 1.00 0.00 C ATOM 554 CG ASN A 159 19.448 -9.152 -14.359 1.00 0.00 C ATOM 555 OD1 ASN A 159 20.455 -9.859 -14.393 1.00 0.00 O ATOM 556 ND2 ASN A 159 18.327 -9.468 -14.997 1.00 0.00 N ATOM 0 H ASN A 159 19.835 -5.216 -13.277 1.00 0.00 H new ATOM 0 HA ASN A 159 18.783 -6.970 -15.418 1.00 0.00 H new ATOM 0 HB2 ASN A 159 20.453 -7.599 -13.281 1.00 0.00 H new ATOM 0 HB3 ASN A 159 18.868 -8.000 -12.651 1.00 0.00 H new ATOM 0 HD21 ASN A 159 18.276 -10.328 -15.544 1.00 0.00 H new ATOM 0 HD22 ASN A 159 17.517 -8.851 -14.940 1.00 0.00 H new ATOM 563 N GLN A 160 16.982 -5.168 -13.989 1.00 0.00 N ATOM 564 CA GLN A 160 15.645 -4.774 -13.561 1.00 0.00 C ATOM 565 C GLN A 160 15.400 -3.294 -13.833 1.00 0.00 C ATOM 566 O GLN A 160 16.332 -2.542 -14.121 1.00 0.00 O ATOM 567 CB GLN A 160 15.455 -5.070 -12.072 1.00 0.00 C ATOM 568 CG GLN A 160 14.163 -5.805 -11.757 1.00 0.00 C ATOM 569 CD GLN A 160 14.269 -7.299 -11.993 1.00 0.00 C ATOM 570 OE1 GLN A 160 15.111 -7.974 -11.400 1.00 0.00 O ATOM 571 NE2 GLN A 160 13.413 -7.824 -12.861 1.00 0.00 N ATOM 0 H GLN A 160 17.544 -4.407 -14.371 1.00 0.00 H new ATOM 0 HA GLN A 160 14.922 -5.354 -14.134 1.00 0.00 H new ATOM 0 HB2 GLN A 160 16.297 -5.665 -11.718 1.00 0.00 H new ATOM 0 HB3 GLN A 160 15.473 -4.131 -11.518 1.00 0.00 H new ATOM 0 HG2 GLN A 160 13.891 -5.624 -10.717 1.00 0.00 H new ATOM 0 HG3 GLN A 160 13.360 -5.400 -12.372 1.00 0.00 H new ATOM 0 HE21 GLN A 160 12.732 -7.227 -13.330 1.00 0.00 H new ATOM 0 HE22 GLN A 160 13.437 -8.824 -13.059 1.00 0.00 H new ATOM 580 N VAL A 161 14.140 -2.880 -13.739 1.00 0.00 N ATOM 581 CA VAL A 161 13.772 -1.489 -13.975 1.00 0.00 C ATOM 582 C VAL A 161 12.958 -0.932 -12.812 1.00 0.00 C ATOM 583 O VAL A 161 11.937 -1.501 -12.427 1.00 0.00 O ATOM 584 CB VAL A 161 12.962 -1.335 -15.275 1.00 0.00 C ATOM 585 CG1 VAL A 161 13.865 -1.496 -16.489 1.00 0.00 C ATOM 586 CG2 VAL A 161 11.820 -2.339 -15.313 1.00 0.00 C ATOM 0 H VAL A 161 13.357 -3.489 -13.501 1.00 0.00 H new ATOM 0 HA VAL A 161 14.701 -0.927 -14.067 1.00 0.00 H new ATOM 0 HB VAL A 161 12.535 -0.332 -15.300 1.00 0.00 H new ATOM 0 HG11 VAL A 161 13.275 -1.384 -17.399 1.00 0.00 H new ATOM 0 HG12 VAL A 161 14.645 -0.735 -16.466 1.00 0.00 H new ATOM 0 HG13 VAL A 161 14.323 -2.485 -16.473 1.00 0.00 H new ATOM 0 HG21 VAL A 161 11.258 -2.216 -16.239 1.00 0.00 H new ATOM 0 HG22 VAL A 161 12.223 -3.351 -15.265 1.00 0.00 H new ATOM 0 HG23 VAL A 161 11.159 -2.171 -14.462 1.00 0.00 H new ATOM 596 N TYR A 162 13.416 0.185 -12.259 1.00 0.00 N ATOM 597 CA TYR A 162 12.731 0.819 -11.138 1.00 0.00 C ATOM 598 C TYR A 162 11.652 1.778 -11.632 1.00 0.00 C ATOM 599 O TYR A 162 11.864 2.536 -12.579 1.00 0.00 O ATOM 600 CB TYR A 162 13.733 1.570 -10.260 1.00 0.00 C ATOM 601 CG TYR A 162 13.085 2.391 -9.168 1.00 0.00 C ATOM 602 CD1 TYR A 162 12.082 1.854 -8.370 1.00 0.00 C ATOM 603 CD2 TYR A 162 13.476 3.703 -8.933 1.00 0.00 C ATOM 604 CE1 TYR A 162 11.486 2.600 -7.372 1.00 0.00 C ATOM 605 CE2 TYR A 162 12.888 4.457 -7.936 1.00 0.00 C ATOM 606 CZ TYR A 162 11.893 3.901 -7.158 1.00 0.00 C ATOM 607 OH TYR A 162 11.303 4.648 -6.164 1.00 0.00 O ATOM 0 H TYR A 162 14.258 0.670 -12.568 1.00 0.00 H new ATOM 0 HA TYR A 162 12.254 0.037 -10.547 1.00 0.00 H new ATOM 0 HB2 TYR A 162 14.416 0.852 -9.806 1.00 0.00 H new ATOM 0 HB3 TYR A 162 14.334 2.227 -10.889 1.00 0.00 H new ATOM 0 HD1 TYR A 162 11.763 0.835 -8.533 1.00 0.00 H new ATOM 0 HD2 TYR A 162 14.254 4.141 -9.541 1.00 0.00 H new ATOM 0 HE1 TYR A 162 10.706 2.168 -6.763 1.00 0.00 H new ATOM 0 HE2 TYR A 162 13.205 5.475 -7.766 1.00 0.00 H new ATOM 0 HH TYR A 162 11.705 5.542 -6.144 1.00 0.00 H new ATOM 797 N ASN A 174 6.012 9.664 -24.343 1.00 0.00 N ATOM 798 CA ASN A 174 6.935 10.238 -23.370 1.00 0.00 C ATOM 799 C ASN A 174 6.960 9.409 -22.090 1.00 0.00 C ATOM 800 O ASN A 174 7.960 9.386 -21.372 1.00 0.00 O ATOM 801 CB ASN A 174 6.538 11.681 -23.049 1.00 0.00 C ATOM 802 CG ASN A 174 7.414 12.296 -21.975 1.00 0.00 C ATOM 803 OD1 ASN A 174 7.046 12.327 -20.801 1.00 0.00 O ATOM 804 ND2 ASN A 174 8.581 12.789 -22.375 1.00 0.00 N ATOM 0 HA ASN A 174 7.934 10.231 -23.806 1.00 0.00 H new ATOM 0 HB2 ASN A 174 6.602 12.283 -23.955 1.00 0.00 H new ATOM 0 HB3 ASN A 174 5.498 11.705 -22.724 1.00 0.00 H new ATOM 0 HD21 ASN A 174 9.214 13.215 -21.698 1.00 0.00 H new ATOM 0 HD22 ASN A 174 8.844 12.741 -23.359 1.00 0.00 H new ATOM 811 N PHE A 175 5.853 8.729 -21.810 1.00 0.00 N ATOM 812 CA PHE A 175 5.748 7.899 -20.616 1.00 0.00 C ATOM 813 C PHE A 175 6.858 6.852 -20.581 1.00 0.00 C ATOM 814 O PHE A 175 7.489 6.634 -19.547 1.00 0.00 O ATOM 815 CB PHE A 175 4.381 7.211 -20.566 1.00 0.00 C ATOM 816 CG PHE A 175 4.199 6.327 -19.366 1.00 0.00 C ATOM 817 CD1 PHE A 175 4.517 6.783 -18.097 1.00 0.00 C ATOM 818 CD2 PHE A 175 3.709 5.038 -19.507 1.00 0.00 C ATOM 819 CE1 PHE A 175 4.350 5.972 -16.991 1.00 0.00 C ATOM 820 CE2 PHE A 175 3.540 4.222 -18.404 1.00 0.00 C ATOM 821 CZ PHE A 175 3.862 4.689 -17.144 1.00 0.00 C ATOM 0 H PHE A 175 5.016 8.737 -22.394 1.00 0.00 H new ATOM 0 HA PHE A 175 5.855 8.545 -19.745 1.00 0.00 H new ATOM 0 HB2 PHE A 175 3.600 7.971 -20.569 1.00 0.00 H new ATOM 0 HB3 PHE A 175 4.250 6.615 -21.469 1.00 0.00 H new ATOM 0 HD1 PHE A 175 4.900 7.785 -17.971 1.00 0.00 H new ATOM 0 HD2 PHE A 175 3.456 4.667 -20.489 1.00 0.00 H new ATOM 0 HE1 PHE A 175 4.601 6.341 -16.007 1.00 0.00 H new ATOM 0 HE2 PHE A 175 3.156 3.220 -18.527 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.732 4.052 -16.281 1.00 0.00 H new ATOM 831 N VAL A 176 7.090 6.206 -21.720 1.00 0.00 N ATOM 832 CA VAL A 176 8.123 5.183 -21.821 1.00 0.00 C ATOM 833 C VAL A 176 9.503 5.764 -21.535 1.00 0.00 C ATOM 834 O VAL A 176 10.242 5.253 -20.693 1.00 0.00 O ATOM 835 CB VAL A 176 8.132 4.531 -23.217 1.00 0.00 C ATOM 836 CG1 VAL A 176 9.209 3.460 -23.299 1.00 0.00 C ATOM 837 CG2 VAL A 176 6.764 3.949 -23.541 1.00 0.00 C ATOM 0 H VAL A 176 6.576 6.374 -22.585 1.00 0.00 H new ATOM 0 HA VAL A 176 7.890 4.424 -21.074 1.00 0.00 H new ATOM 0 HB VAL A 176 8.360 5.299 -23.957 1.00 0.00 H new ATOM 0 HG11 VAL A 176 9.200 3.011 -24.292 1.00 0.00 H new ATOM 0 HG12 VAL A 176 10.184 3.910 -23.113 1.00 0.00 H new ATOM 0 HG13 VAL A 176 9.015 2.691 -22.551 1.00 0.00 H new ATOM 0 HG21 VAL A 176 6.788 3.492 -24.530 1.00 0.00 H new ATOM 0 HG22 VAL A 176 6.505 3.194 -22.799 1.00 0.00 H new ATOM 0 HG23 VAL A 176 6.018 4.743 -23.526 1.00 0.00 H new ATOM 847 N HIS A 177 9.844 6.838 -22.241 1.00 0.00 N ATOM 848 CA HIS A 177 11.136 7.491 -22.063 1.00 0.00 C ATOM 849 C HIS A 177 11.338 7.906 -20.609 1.00 0.00 C ATOM 850 O HIS A 177 12.402 7.686 -20.032 1.00 0.00 O ATOM 851 CB HIS A 177 11.244 8.713 -22.974 1.00 0.00 C ATOM 852 CG HIS A 177 11.149 8.383 -24.432 1.00 0.00 C ATOM 853 ND1 HIS A 177 11.377 7.119 -24.934 1.00 0.00 N ATOM 854 CD2 HIS A 177 10.847 9.161 -25.498 1.00 0.00 C ATOM 855 CE1 HIS A 177 11.221 7.134 -26.246 1.00 0.00 C ATOM 856 NE2 HIS A 177 10.899 8.361 -26.613 1.00 0.00 N ATOM 0 H HIS A 177 9.244 7.274 -22.941 1.00 0.00 H new ATOM 0 HA HIS A 177 11.916 6.778 -22.331 1.00 0.00 H new ATOM 0 HB2 HIS A 177 10.454 9.418 -22.717 1.00 0.00 H new ATOM 0 HB3 HIS A 177 12.193 9.215 -22.784 1.00 0.00 H new ATOM 0 HD2 HIS A 177 10.609 10.214 -25.476 1.00 0.00 H new ATOM 0 HE1 HIS A 177 11.337 6.287 -26.906 1.00 0.00 H new ATOM 0 HE2 HIS A 177 10.718 8.665 -27.570 1.00 0.00 H new ATOM 864 N ASN A 178 10.310 8.510 -20.022 1.00 0.00 N ATOM 865 CA ASN A 178 10.375 8.958 -18.636 1.00 0.00 C ATOM 866 C ASN A 178 10.584 7.777 -17.692 1.00 0.00 C ATOM 867 O ASN A 178 11.359 7.860 -16.739 1.00 0.00 O ATOM 868 CB ASN A 178 9.095 9.706 -18.259 1.00 0.00 C ATOM 869 CG ASN A 178 9.274 11.212 -18.292 1.00 0.00 C ATOM 870 OD1 ASN A 178 10.098 11.734 -19.043 1.00 0.00 O ATOM 871 ND2 ASN A 178 8.501 11.917 -17.474 1.00 0.00 N ATOM 0 H ASN A 178 9.421 8.701 -20.485 1.00 0.00 H new ATOM 0 HA ASN A 178 11.225 9.634 -18.538 1.00 0.00 H new ATOM 0 HB2 ASN A 178 8.297 9.423 -18.945 1.00 0.00 H new ATOM 0 HB3 ASN A 178 8.780 9.402 -17.261 1.00 0.00 H new ATOM 0 HD21 ASN A 178 8.577 12.934 -17.451 1.00 0.00 H new ATOM 0 HD22 ASN A 178 7.832 11.442 -16.869 1.00 0.00 H new ATOM 878 N CYS A 179 9.887 6.679 -17.964 1.00 0.00 N ATOM 879 CA CYS A 179 9.995 5.481 -17.141 1.00 0.00 C ATOM 880 C CYS A 179 11.452 5.055 -16.989 1.00 0.00 C ATOM 881 O CYS A 179 11.842 4.490 -15.967 1.00 0.00 O ATOM 882 CB CYS A 179 9.180 4.340 -17.754 1.00 0.00 C ATOM 883 SG CYS A 179 8.067 3.506 -16.577 1.00 0.00 S ATOM 0 H CYS A 179 9.241 6.594 -18.749 1.00 0.00 H new ATOM 0 HA CYS A 179 9.597 5.713 -16.153 1.00 0.00 H new ATOM 0 HB2 CYS A 179 8.588 4.734 -18.581 1.00 0.00 H new ATOM 0 HB3 CYS A 179 9.865 3.604 -18.174 1.00 0.00 H new ATOM 0 HG CYS A 179 7.420 2.559 -17.188 1.00 0.00 H new ATOM 888 N VAL A 180 12.253 5.330 -18.014 1.00 0.00 N ATOM 889 CA VAL A 180 13.668 4.977 -17.995 1.00 0.00 C ATOM 890 C VAL A 180 14.450 5.893 -17.060 1.00 0.00 C ATOM 891 O VAL A 180 15.339 5.445 -16.337 1.00 0.00 O ATOM 892 CB VAL A 180 14.284 5.052 -19.404 1.00 0.00 C ATOM 893 CG1 VAL A 180 15.750 4.648 -19.368 1.00 0.00 C ATOM 894 CG2 VAL A 180 13.505 4.175 -20.373 1.00 0.00 C ATOM 0 H VAL A 180 11.946 5.796 -18.868 1.00 0.00 H new ATOM 0 HA VAL A 180 13.734 3.951 -17.633 1.00 0.00 H new ATOM 0 HB VAL A 180 14.224 6.083 -19.753 1.00 0.00 H new ATOM 0 HG11 VAL A 180 16.168 4.707 -20.373 1.00 0.00 H new ATOM 0 HG12 VAL A 180 16.297 5.321 -18.707 1.00 0.00 H new ATOM 0 HG13 VAL A 180 15.837 3.626 -18.998 1.00 0.00 H new ATOM 0 HG21 VAL A 180 13.954 4.240 -21.364 1.00 0.00 H new ATOM 0 HG22 VAL A 180 13.532 3.141 -20.030 1.00 0.00 H new ATOM 0 HG23 VAL A 180 12.470 4.515 -20.420 1.00 0.00 H new ATOM 904 N ASN A 181 14.113 7.178 -17.081 1.00 0.00 N ATOM 905 CA ASN A 181 14.784 8.158 -16.235 1.00 0.00 C ATOM 906 C ASN A 181 14.657 7.784 -14.762 1.00 0.00 C ATOM 907 O ASN A 181 15.504 8.143 -13.944 1.00 0.00 O ATOM 908 CB ASN A 181 14.199 9.552 -16.471 1.00 0.00 C ATOM 909 CG ASN A 181 15.270 10.624 -16.543 1.00 0.00 C ATOM 910 OD1 ASN A 181 16.328 10.502 -15.926 1.00 0.00 O ATOM 911 ND2 ASN A 181 14.998 11.682 -17.297 1.00 0.00 N ATOM 0 H ASN A 181 13.379 7.565 -17.675 1.00 0.00 H new ATOM 0 HA ASN A 181 15.841 8.165 -16.499 1.00 0.00 H new ATOM 0 HB2 ASN A 181 13.627 9.551 -17.399 1.00 0.00 H new ATOM 0 HB3 ASN A 181 13.502 9.792 -15.668 1.00 0.00 H new ATOM 0 HD21 ASN A 181 15.679 12.436 -17.383 1.00 0.00 H new ATOM 0 HD22 ASN A 181 14.108 11.741 -17.791 1.00 0.00 H new ATOM 918 N ILE A 182 13.593 7.060 -14.431 1.00 0.00 N ATOM 919 CA ILE A 182 13.355 6.635 -13.057 1.00 0.00 C ATOM 920 C ILE A 182 14.500 5.768 -12.544 1.00 0.00 C ATOM 921 O ILE A 182 15.099 6.059 -11.509 1.00 0.00 O ATOM 922 CB ILE A 182 12.036 5.851 -12.930 1.00 0.00 C ATOM 923 CG1 ILE A 182 10.865 6.696 -13.436 1.00 0.00 C ATOM 924 CG2 ILE A 182 11.807 5.429 -11.487 1.00 0.00 C ATOM 925 CD1 ILE A 182 10.677 7.988 -12.673 1.00 0.00 C ATOM 0 H ILE A 182 12.882 6.755 -15.096 1.00 0.00 H new ATOM 0 HA ILE A 182 13.289 7.541 -12.454 1.00 0.00 H new ATOM 0 HB ILE A 182 12.104 4.953 -13.544 1.00 0.00 H new ATOM 0 HG12 ILE A 182 11.022 6.926 -14.490 1.00 0.00 H new ATOM 0 HG13 ILE A 182 9.949 6.109 -13.371 1.00 0.00 H new ATOM 0 HG21 ILE A 182 10.871 4.876 -11.414 1.00 0.00 H new ATOM 0 HG22 ILE A 182 12.630 4.794 -11.159 1.00 0.00 H new ATOM 0 HG23 ILE A 182 11.756 6.314 -10.853 1.00 0.00 H new ATOM 0 HD11 ILE A 182 9.830 8.535 -13.087 1.00 0.00 H new ATOM 0 HD12 ILE A 182 10.488 7.766 -11.623 1.00 0.00 H new ATOM 0 HD13 ILE A 182 11.578 8.596 -12.759 1.00 0.00 H new ATOM 937 N THR A 183 14.801 4.700 -13.277 1.00 0.00 N ATOM 938 CA THR A 183 15.874 3.791 -12.897 1.00 0.00 C ATOM 939 C THR A 183 17.208 4.523 -12.803 1.00 0.00 C ATOM 940 O THR A 183 17.950 4.357 -11.834 1.00 0.00 O ATOM 941 CB THR A 183 16.009 2.630 -13.902 1.00 0.00 C ATOM 942 OG1 THR A 183 14.726 2.304 -14.449 1.00 0.00 O ATOM 943 CG2 THR A 183 16.608 1.402 -13.233 1.00 0.00 C ATOM 0 H THR A 183 14.316 4.444 -14.137 1.00 0.00 H new ATOM 0 HA THR A 183 15.614 3.387 -11.918 1.00 0.00 H new ATOM 0 HB THR A 183 16.675 2.948 -14.704 1.00 0.00 H new ATOM 0 HG1 THR A 183 14.820 1.567 -15.088 1.00 0.00 H new ATOM 0 HG21 THR A 183 16.694 0.596 -13.962 1.00 0.00 H new ATOM 0 HG22 THR A 183 17.597 1.646 -12.844 1.00 0.00 H new ATOM 0 HG23 THR A 183 15.964 1.083 -12.414 1.00 0.00 H new ATOM 951 N ILE A 184 17.506 5.332 -13.813 1.00 0.00 N ATOM 952 CA ILE A 184 18.750 6.091 -13.842 1.00 0.00 C ATOM 953 C ILE A 184 18.872 6.993 -12.618 1.00 0.00 C ATOM 954 O ILE A 184 19.974 7.263 -12.139 1.00 0.00 O ATOM 955 CB ILE A 184 18.855 6.953 -15.113 1.00 0.00 C ATOM 956 CG1 ILE A 184 18.707 6.080 -16.361 1.00 0.00 C ATOM 957 CG2 ILE A 184 20.179 7.702 -15.138 1.00 0.00 C ATOM 958 CD1 ILE A 184 19.732 4.971 -16.447 1.00 0.00 C ATOM 0 H ILE A 184 16.903 5.479 -14.622 1.00 0.00 H new ATOM 0 HA ILE A 184 19.563 5.364 -13.838 1.00 0.00 H new ATOM 0 HB ILE A 184 18.047 7.684 -15.106 1.00 0.00 H new ATOM 0 HG12 ILE A 184 17.709 5.643 -16.372 1.00 0.00 H new ATOM 0 HG13 ILE A 184 18.789 6.710 -17.247 1.00 0.00 H new ATOM 0 HG21 ILE A 184 20.238 8.307 -16.043 1.00 0.00 H new ATOM 0 HG22 ILE A 184 20.247 8.349 -14.264 1.00 0.00 H new ATOM 0 HG23 ILE A 184 21.002 6.987 -15.125 1.00 0.00 H new ATOM 0 HD11 ILE A 184 19.567 4.393 -17.356 1.00 0.00 H new ATOM 0 HD12 ILE A 184 20.733 5.402 -16.467 1.00 0.00 H new ATOM 0 HD13 ILE A 184 19.635 4.318 -15.579 1.00 0.00 H new ATOM 970 N LYS A 185 17.733 7.456 -12.115 1.00 0.00 N ATOM 971 CA LYS A 185 17.710 8.326 -10.945 1.00 0.00 C ATOM 972 C LYS A 185 18.487 7.703 -9.789 1.00 0.00 C ATOM 973 O LYS A 185 19.439 8.294 -9.281 1.00 0.00 O ATOM 974 CB LYS A 185 16.267 8.598 -10.515 1.00 0.00 C ATOM 975 CG LYS A 185 16.116 9.829 -9.638 1.00 0.00 C ATOM 976 CD LYS A 185 16.566 9.557 -8.213 1.00 0.00 C ATOM 977 CE LYS A 185 15.966 10.558 -7.238 1.00 0.00 C ATOM 978 NZ LYS A 185 16.962 11.018 -6.231 1.00 0.00 N ATOM 0 H LYS A 185 16.813 7.243 -12.500 1.00 0.00 H new ATOM 0 HA LYS A 185 18.186 9.269 -11.214 1.00 0.00 H new ATOM 0 HB2 LYS A 185 15.648 8.717 -11.404 1.00 0.00 H new ATOM 0 HB3 LYS A 185 15.887 7.730 -9.977 1.00 0.00 H new ATOM 0 HG2 LYS A 185 16.702 10.648 -10.055 1.00 0.00 H new ATOM 0 HG3 LYS A 185 15.074 10.150 -9.637 1.00 0.00 H new ATOM 0 HD2 LYS A 185 16.274 8.547 -7.925 1.00 0.00 H new ATOM 0 HD3 LYS A 185 17.654 9.602 -8.159 1.00 0.00 H new ATOM 0 HE2 LYS A 185 15.584 11.417 -7.789 1.00 0.00 H new ATOM 0 HE3 LYS A 185 15.117 10.103 -6.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 185 16.514 11.699 -5.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 185 17.308 10.202 -5.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 185 17.760 11.475 -6.716 1.00 0.00 H new ATOM 992 N GLN A 186 18.074 6.508 -9.381 1.00 0.00 N ATOM 993 CA GLN A 186 18.733 5.806 -8.285 1.00 0.00 C ATOM 994 C GLN A 186 20.112 5.310 -8.708 1.00 0.00 C ATOM 995 O GLN A 186 20.996 5.116 -7.873 1.00 0.00 O ATOM 996 CB GLN A 186 17.876 4.629 -7.817 1.00 0.00 C ATOM 997 CG GLN A 186 17.302 4.812 -6.421 1.00 0.00 C ATOM 998 CD GLN A 186 16.557 6.123 -6.264 1.00 0.00 C ATOM 999 OE1 GLN A 186 15.571 6.351 -7.124 1.00 0.00 O flip ATOM 1000 NE2 GLN A 186 16.864 6.923 -5.379 1.00 0.00 N flip ATOM 0 H GLN A 186 17.287 6.006 -9.792 1.00 0.00 H new ATOM 0 HA GLN A 186 18.856 6.507 -7.460 1.00 0.00 H new ATOM 0 HB2 GLN A 186 17.057 4.484 -8.521 1.00 0.00 H new ATOM 0 HB3 GLN A 186 18.479 3.721 -7.837 1.00 0.00 H new ATOM 0 HG2 GLN A 186 16.627 3.986 -6.199 1.00 0.00 H new ATOM 0 HG3 GLN A 186 18.110 4.768 -5.691 1.00 0.00 H new ATOM 0 HE21 GLN A 186 17.629 6.707 -4.739 1.00 0.00 H new ATOM 0 HE22 GLN A 186 16.353 7.801 -5.286 1.00 0.00 H new ATOM 1009 N HIS A 187 20.289 5.105 -10.010 1.00 0.00 N ATOM 1010 CA HIS A 187 21.561 4.631 -10.543 1.00 0.00 C ATOM 1011 C HIS A 187 22.690 5.594 -10.191 1.00 0.00 C ATOM 1012 O HIS A 187 23.698 5.199 -9.603 1.00 0.00 O ATOM 1013 CB HIS A 187 21.471 4.465 -12.060 1.00 0.00 C ATOM 1014 CG HIS A 187 22.431 3.455 -12.610 1.00 0.00 C ATOM 1015 ND1 HIS A 187 23.781 3.469 -12.328 1.00 0.00 N ATOM 1016 CD2 HIS A 187 22.230 2.395 -13.428 1.00 0.00 C ATOM 1017 CE1 HIS A 187 24.369 2.463 -12.951 1.00 0.00 C ATOM 1018 NE2 HIS A 187 23.449 1.795 -13.624 1.00 0.00 N ATOM 0 H HIS A 187 19.568 5.260 -10.715 1.00 0.00 H new ATOM 0 HA HIS A 187 21.779 3.663 -10.091 1.00 0.00 H new ATOM 0 HB2 HIS A 187 20.455 4.171 -12.325 1.00 0.00 H new ATOM 0 HB3 HIS A 187 21.658 5.428 -12.534 1.00 0.00 H new ATOM 0 HD2 HIS A 187 21.286 2.080 -13.848 1.00 0.00 H new ATOM 0 HE1 HIS A 187 25.422 2.227 -12.916 1.00 0.00 H new ATOM 0 HE2 HIS A 187 23.617 0.968 -14.196 1.00 0.00 H new ATOM 1026 N THR A 188 22.517 6.861 -10.555 1.00 0.00 N ATOM 1027 CA THR A 188 23.522 7.880 -10.280 1.00 0.00 C ATOM 1028 C THR A 188 23.758 8.028 -8.781 1.00 0.00 C ATOM 1029 O THR A 188 24.826 8.465 -8.351 1.00 0.00 O ATOM 1030 CB THR A 188 23.110 9.246 -10.860 1.00 0.00 C ATOM 1031 OG1 THR A 188 24.108 10.228 -10.558 1.00 0.00 O ATOM 1032 CG2 THR A 188 21.768 9.691 -10.299 1.00 0.00 C ATOM 0 H THR A 188 21.689 7.206 -11.041 1.00 0.00 H new ATOM 0 HA THR A 188 24.444 7.553 -10.760 1.00 0.00 H new ATOM 0 HB THR A 188 23.017 9.143 -11.941 1.00 0.00 H new ATOM 0 HG1 THR A 188 23.839 11.093 -10.932 1.00 0.00 H new ATOM 0 HG21 THR A 188 21.499 10.658 -10.724 1.00 0.00 H new ATOM 0 HG22 THR A 188 21.005 8.957 -10.556 1.00 0.00 H new ATOM 0 HG23 THR A 188 21.838 9.778 -9.215 1.00 0.00 H new ATOM 1040 N VAL A 189 22.756 7.661 -7.989 1.00 0.00 N ATOM 1041 CA VAL A 189 22.856 7.751 -6.537 1.00 0.00 C ATOM 1042 C VAL A 189 23.778 6.671 -5.982 1.00 0.00 C ATOM 1043 O VAL A 189 24.371 6.833 -4.915 1.00 0.00 O ATOM 1044 CB VAL A 189 21.474 7.623 -5.870 1.00 0.00 C ATOM 1045 CG1 VAL A 189 21.604 7.682 -4.356 1.00 0.00 C ATOM 1046 CG2 VAL A 189 20.536 8.709 -6.376 1.00 0.00 C ATOM 0 H VAL A 189 21.865 7.298 -8.328 1.00 0.00 H new ATOM 0 HA VAL A 189 23.272 8.732 -6.309 1.00 0.00 H new ATOM 0 HB VAL A 189 21.049 6.655 -6.136 1.00 0.00 H new ATOM 0 HG11 VAL A 189 20.617 7.590 -3.902 1.00 0.00 H new ATOM 0 HG12 VAL A 189 22.239 6.865 -4.013 1.00 0.00 H new ATOM 0 HG13 VAL A 189 22.049 8.634 -4.066 1.00 0.00 H new ATOM 0 HG21 VAL A 189 19.564 8.604 -5.894 1.00 0.00 H new ATOM 0 HG22 VAL A 189 20.953 9.688 -6.141 1.00 0.00 H new ATOM 0 HG23 VAL A 189 20.418 8.614 -7.455 1.00 0.00 H new ATOM 1056 N THR A 190 23.895 5.567 -6.713 1.00 0.00 N ATOM 1057 CA THR A 190 24.744 4.459 -6.294 1.00 0.00 C ATOM 1058 C THR A 190 26.189 4.912 -6.112 1.00 0.00 C ATOM 1059 O THR A 190 26.950 4.307 -5.356 1.00 0.00 O ATOM 1060 CB THR A 190 24.704 3.304 -7.313 1.00 0.00 C ATOM 1061 OG1 THR A 190 23.366 2.812 -7.442 1.00 0.00 O ATOM 1062 CG2 THR A 190 25.627 2.173 -6.884 1.00 0.00 C ATOM 0 H THR A 190 23.412 5.416 -7.599 1.00 0.00 H new ATOM 0 HA THR A 190 24.354 4.105 -5.340 1.00 0.00 H new ATOM 0 HB THR A 190 25.045 3.685 -8.276 1.00 0.00 H new ATOM 0 HG1 THR A 190 23.348 2.079 -8.093 1.00 0.00 H new ATOM 0 HG21 THR A 190 25.582 1.369 -7.618 1.00 0.00 H new ATOM 0 HG22 THR A 190 26.649 2.544 -6.814 1.00 0.00 H new ATOM 0 HG23 THR A 190 25.311 1.795 -5.912 1.00 0.00 H new ATOM 1070 N THR A 191 26.561 5.980 -6.810 1.00 0.00 N ATOM 1071 CA THR A 191 27.915 6.514 -6.726 1.00 0.00 C ATOM 1072 C THR A 191 28.297 6.819 -5.282 1.00 0.00 C ATOM 1073 O THR A 191 29.476 6.811 -4.925 1.00 0.00 O ATOM 1074 CB THR A 191 28.067 7.795 -7.567 1.00 0.00 C ATOM 1075 OG1 THR A 191 27.115 8.777 -7.140 1.00 0.00 O ATOM 1076 CG2 THR A 191 27.869 7.499 -9.046 1.00 0.00 C ATOM 0 H THR A 191 25.944 6.492 -7.440 1.00 0.00 H new ATOM 0 HA THR A 191 28.582 5.748 -7.121 1.00 0.00 H new ATOM 0 HB THR A 191 29.076 8.180 -7.422 1.00 0.00 H new ATOM 0 HG1 THR A 191 26.277 8.657 -7.634 1.00 0.00 H new ATOM 0 HG21 THR A 191 27.981 8.419 -9.619 1.00 0.00 H new ATOM 0 HG22 THR A 191 28.613 6.774 -9.375 1.00 0.00 H new ATOM 0 HG23 THR A 191 26.871 7.092 -9.205 1.00 0.00 H new ATOM 1084 N THR A 192 27.293 7.087 -4.453 1.00 0.00 N ATOM 1085 CA THR A 192 27.524 7.395 -3.047 1.00 0.00 C ATOM 1086 C THR A 192 27.928 6.147 -2.270 1.00 0.00 C ATOM 1087 O THR A 192 28.631 6.231 -1.262 1.00 0.00 O ATOM 1088 CB THR A 192 26.271 8.009 -2.394 1.00 0.00 C ATOM 1089 OG1 THR A 192 25.764 9.071 -3.210 1.00 0.00 O ATOM 1090 CG2 THR A 192 26.591 8.539 -1.004 1.00 0.00 C ATOM 0 H THR A 192 26.312 7.097 -4.731 1.00 0.00 H new ATOM 0 HA THR A 192 28.337 8.121 -3.011 1.00 0.00 H new ATOM 0 HB THR A 192 25.515 7.229 -2.303 1.00 0.00 H new ATOM 0 HG1 THR A 192 25.245 8.695 -3.951 1.00 0.00 H new ATOM 0 HG21 THR A 192 25.692 8.968 -0.562 1.00 0.00 H new ATOM 0 HG22 THR A 192 26.950 7.723 -0.377 1.00 0.00 H new ATOM 0 HG23 THR A 192 27.361 9.307 -1.076 1.00 0.00 H new ATOM 1098 N THR A 193 27.481 4.989 -2.745 1.00 0.00 N ATOM 1099 CA THR A 193 27.796 3.723 -2.095 1.00 0.00 C ATOM 1100 C THR A 193 29.032 3.080 -2.713 1.00 0.00 C ATOM 1101 O THR A 193 29.856 2.493 -2.012 1.00 0.00 O ATOM 1102 CB THR A 193 26.618 2.736 -2.186 1.00 0.00 C ATOM 1103 OG1 THR A 193 25.377 3.447 -2.114 1.00 0.00 O ATOM 1104 CG2 THR A 193 26.685 1.709 -1.066 1.00 0.00 C ATOM 0 H THR A 193 26.899 4.902 -3.578 1.00 0.00 H new ATOM 0 HA THR A 193 27.992 3.947 -1.046 1.00 0.00 H new ATOM 0 HB THR A 193 26.683 2.214 -3.141 1.00 0.00 H new ATOM 0 HG1 THR A 193 24.633 2.813 -2.174 1.00 0.00 H new ATOM 0 HG21 THR A 193 25.843 1.023 -1.151 1.00 0.00 H new ATOM 0 HG22 THR A 193 27.618 1.150 -1.140 1.00 0.00 H new ATOM 0 HG23 THR A 193 26.643 2.218 -0.103 1.00 0.00 H new ATOM 1112 N LYS A 194 29.156 3.194 -4.031 1.00 0.00 N ATOM 1113 CA LYS A 194 30.293 2.626 -4.745 1.00 0.00 C ATOM 1114 C LYS A 194 31.503 3.552 -4.668 1.00 0.00 C ATOM 1115 O LYS A 194 32.621 3.157 -4.993 1.00 0.00 O ATOM 1116 CB LYS A 194 29.926 2.369 -6.209 1.00 0.00 C ATOM 1117 CG LYS A 194 29.254 1.027 -6.441 1.00 0.00 C ATOM 1118 CD LYS A 194 28.735 0.902 -7.864 1.00 0.00 C ATOM 1119 CE LYS A 194 29.865 0.637 -8.848 1.00 0.00 C ATOM 1120 NZ LYS A 194 29.715 1.440 -10.093 1.00 0.00 N ATOM 0 H LYS A 194 28.482 3.675 -4.627 1.00 0.00 H new ATOM 0 HA LYS A 194 30.552 1.680 -4.270 1.00 0.00 H new ATOM 0 HB2 LYS A 194 29.263 3.162 -6.553 1.00 0.00 H new ATOM 0 HB3 LYS A 194 30.830 2.423 -6.816 1.00 0.00 H new ATOM 0 HG2 LYS A 194 29.963 0.224 -6.240 1.00 0.00 H new ATOM 0 HG3 LYS A 194 28.428 0.906 -5.740 1.00 0.00 H new ATOM 0 HD2 LYS A 194 28.007 0.092 -7.917 1.00 0.00 H new ATOM 0 HD3 LYS A 194 28.214 1.818 -8.144 1.00 0.00 H new ATOM 0 HE2 LYS A 194 30.819 0.872 -8.377 1.00 0.00 H new ATOM 0 HE3 LYS A 194 29.886 -0.423 -9.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 194 30.504 1.231 -10.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 194 28.816 1.198 -10.556 1.00 0.00 H new ATOM 0 HZ3 LYS A 194 29.720 2.453 -9.856 1.00 0.00 H new ATOM 1134 N GLY A 195 31.270 4.787 -4.235 1.00 0.00 N ATOM 1135 CA GLY A 195 32.350 5.750 -4.122 1.00 0.00 C ATOM 1136 C GLY A 195 33.070 5.970 -5.437 1.00 0.00 C ATOM 1137 O GLY A 195 34.260 6.285 -5.455 1.00 0.00 O ATOM 0 H GLY A 195 30.353 5.138 -3.960 1.00 0.00 H new ATOM 0 HA2 GLY A 195 31.950 6.700 -3.767 1.00 0.00 H new ATOM 0 HA3 GLY A 195 33.064 5.405 -3.374 1.00 0.00 H new ATOM 1141 N GLU A 196 32.348 5.802 -6.541 1.00 0.00 N ATOM 1142 CA GLU A 196 32.928 5.982 -7.867 1.00 0.00 C ATOM 1143 C GLU A 196 32.176 7.056 -8.648 1.00 0.00 C ATOM 1144 O GLU A 196 31.166 7.583 -8.184 1.00 0.00 O ATOM 1145 CB GLU A 196 32.905 4.663 -8.641 1.00 0.00 C ATOM 1146 CG GLU A 196 34.287 4.145 -9.002 1.00 0.00 C ATOM 1147 CD GLU A 196 34.237 2.941 -9.922 1.00 0.00 C ATOM 1148 OE1 GLU A 196 33.938 3.122 -11.121 1.00 0.00 O ATOM 1149 OE2 GLU A 196 34.497 1.817 -9.443 1.00 0.00 O ATOM 0 H GLU A 196 31.362 5.542 -6.543 1.00 0.00 H new ATOM 0 HA GLU A 196 33.962 6.304 -7.743 1.00 0.00 H new ATOM 0 HB2 GLU A 196 32.389 3.911 -8.045 1.00 0.00 H new ATOM 0 HB3 GLU A 196 32.327 4.798 -9.555 1.00 0.00 H new ATOM 0 HG2 GLU A 196 34.855 4.941 -9.483 1.00 0.00 H new ATOM 0 HG3 GLU A 196 34.821 3.878 -8.090 1.00 0.00 H new ATOM 1156 N ASN A 197 32.677 7.375 -9.836 1.00 0.00 N ATOM 1157 CA ASN A 197 32.055 8.387 -10.682 1.00 0.00 C ATOM 1158 C ASN A 197 31.619 7.788 -12.016 1.00 0.00 C ATOM 1159 O ASN A 197 32.083 6.718 -12.409 1.00 0.00 O ATOM 1160 CB ASN A 197 33.023 9.547 -10.923 1.00 0.00 C ATOM 1161 CG ASN A 197 33.563 10.127 -9.630 1.00 0.00 C ATOM 1162 OD1 ASN A 197 34.772 10.140 -9.400 1.00 0.00 O ATOM 1163 ND2 ASN A 197 32.666 10.611 -8.779 1.00 0.00 N ATOM 0 H ASN A 197 33.512 6.947 -10.235 1.00 0.00 H new ATOM 0 HA ASN A 197 31.171 8.762 -10.166 1.00 0.00 H new ATOM 0 HB2 ASN A 197 33.854 9.202 -11.538 1.00 0.00 H new ATOM 0 HB3 ASN A 197 32.514 10.330 -11.485 1.00 0.00 H new ATOM 0 HD21 ASN A 197 32.970 11.015 -7.893 1.00 0.00 H new ATOM 0 HD22 ASN A 197 31.673 10.579 -9.012 1.00 0.00 H new ATOM 1170 N PHE A 198 30.725 8.486 -12.708 1.00 0.00 N ATOM 1171 CA PHE A 198 30.226 8.024 -13.998 1.00 0.00 C ATOM 1172 C PHE A 198 30.466 9.071 -15.081 1.00 0.00 C ATOM 1173 O PHE A 198 30.373 10.273 -14.831 1.00 0.00 O ATOM 1174 CB PHE A 198 28.733 7.702 -13.905 1.00 0.00 C ATOM 1175 CG PHE A 198 28.447 6.331 -13.363 1.00 0.00 C ATOM 1176 CD1 PHE A 198 28.979 5.206 -13.971 1.00 0.00 C ATOM 1177 CD2 PHE A 198 27.647 6.168 -12.243 1.00 0.00 C ATOM 1178 CE1 PHE A 198 28.717 3.943 -13.474 1.00 0.00 C ATOM 1179 CE2 PHE A 198 27.382 4.907 -11.741 1.00 0.00 C ATOM 1180 CZ PHE A 198 27.919 3.794 -12.357 1.00 0.00 C ATOM 0 H PHE A 198 30.331 9.374 -12.397 1.00 0.00 H new ATOM 0 HA PHE A 198 30.770 7.118 -14.267 1.00 0.00 H new ATOM 0 HB2 PHE A 198 28.249 8.443 -13.269 1.00 0.00 H new ATOM 0 HB3 PHE A 198 28.288 7.792 -14.896 1.00 0.00 H new ATOM 0 HD1 PHE A 198 29.606 5.317 -14.843 1.00 0.00 H new ATOM 0 HD2 PHE A 198 27.226 7.036 -11.757 1.00 0.00 H new ATOM 0 HE1 PHE A 198 29.136 3.074 -13.959 1.00 0.00 H new ATOM 0 HE2 PHE A 198 26.756 4.793 -10.868 1.00 0.00 H new ATOM 0 HZ PHE A 198 27.715 2.808 -11.966 1.00 0.00 H new ATOM 1190 N THR A 199 30.777 8.606 -16.287 1.00 0.00 N ATOM 1191 CA THR A 199 31.032 9.500 -17.409 1.00 0.00 C ATOM 1192 C THR A 199 29.797 9.644 -18.290 1.00 0.00 C ATOM 1193 O THR A 199 28.912 8.789 -18.278 1.00 0.00 O ATOM 1194 CB THR A 199 32.208 9.000 -18.270 1.00 0.00 C ATOM 1195 OG1 THR A 199 32.013 7.623 -18.612 1.00 0.00 O ATOM 1196 CG2 THR A 199 33.527 9.163 -17.531 1.00 0.00 C ATOM 0 H THR A 199 30.858 7.614 -16.511 1.00 0.00 H new ATOM 0 HA THR A 199 31.288 10.472 -16.986 1.00 0.00 H new ATOM 0 HB THR A 199 32.244 9.598 -19.180 1.00 0.00 H new ATOM 0 HG1 THR A 199 32.763 7.313 -19.161 1.00 0.00 H new ATOM 0 HG21 THR A 199 34.342 8.803 -18.158 1.00 0.00 H new ATOM 0 HG22 THR A 199 33.686 10.216 -17.298 1.00 0.00 H new ATOM 0 HG23 THR A 199 33.500 8.587 -16.606 1.00 0.00 H new ATOM 1204 N GLU A 200 29.744 10.730 -19.055 1.00 0.00 N ATOM 1205 CA GLU A 200 28.616 10.985 -19.943 1.00 0.00 C ATOM 1206 C GLU A 200 28.506 9.898 -21.009 1.00 0.00 C ATOM 1207 O GLU A 200 27.423 9.627 -21.528 1.00 0.00 O ATOM 1208 CB GLU A 200 28.760 12.355 -20.608 1.00 0.00 C ATOM 1209 CG GLU A 200 30.052 12.518 -21.391 1.00 0.00 C ATOM 1210 CD GLU A 200 29.960 13.598 -22.451 1.00 0.00 C ATOM 1211 OE1 GLU A 200 28.954 14.338 -22.458 1.00 0.00 O ATOM 1212 OE2 GLU A 200 30.894 13.704 -23.273 1.00 0.00 O ATOM 0 H GLU A 200 30.469 11.447 -19.078 1.00 0.00 H new ATOM 0 HA GLU A 200 27.706 10.975 -19.343 1.00 0.00 H new ATOM 0 HB2 GLU A 200 27.916 12.515 -21.279 1.00 0.00 H new ATOM 0 HB3 GLU A 200 28.709 13.129 -19.842 1.00 0.00 H new ATOM 0 HG2 GLU A 200 30.862 12.758 -20.702 1.00 0.00 H new ATOM 0 HG3 GLU A 200 30.307 11.570 -21.865 1.00 0.00 H new ATOM 1219 N THR A 201 29.637 9.279 -21.333 1.00 0.00 N ATOM 1220 CA THR A 201 29.671 8.224 -22.337 1.00 0.00 C ATOM 1221 C THR A 201 29.221 6.891 -21.750 1.00 0.00 C ATOM 1222 O THR A 201 28.432 6.168 -22.358 1.00 0.00 O ATOM 1223 CB THR A 201 31.081 8.060 -22.934 1.00 0.00 C ATOM 1224 OG1 THR A 201 31.632 9.344 -23.248 1.00 0.00 O ATOM 1225 CG2 THR A 201 31.043 7.198 -24.187 1.00 0.00 C ATOM 0 H THR A 201 30.542 9.491 -20.914 1.00 0.00 H new ATOM 0 HA THR A 201 28.983 8.520 -23.129 1.00 0.00 H new ATOM 0 HB THR A 201 31.710 7.566 -22.193 1.00 0.00 H new ATOM 0 HG1 THR A 201 32.529 9.231 -23.626 1.00 0.00 H new ATOM 0 HG21 THR A 201 32.051 7.097 -24.590 1.00 0.00 H new ATOM 0 HG22 THR A 201 30.651 6.212 -23.938 1.00 0.00 H new ATOM 0 HG23 THR A 201 30.400 7.667 -24.932 1.00 0.00 H new ATOM 1233 N ASP A 202 29.728 6.571 -20.564 1.00 0.00 N ATOM 1234 CA ASP A 202 29.378 5.325 -19.893 1.00 0.00 C ATOM 1235 C ASP A 202 27.911 5.328 -19.474 1.00 0.00 C ATOM 1236 O ASP A 202 27.189 4.356 -19.696 1.00 0.00 O ATOM 1237 CB ASP A 202 30.271 5.110 -18.671 1.00 0.00 C ATOM 1238 CG ASP A 202 30.034 3.767 -18.009 1.00 0.00 C ATOM 1239 OD1 ASP A 202 28.957 3.587 -17.402 1.00 0.00 O ATOM 1240 OD2 ASP A 202 30.925 2.896 -18.097 1.00 0.00 O ATOM 0 H ASP A 202 30.383 7.158 -20.048 1.00 0.00 H new ATOM 0 HA ASP A 202 29.535 4.506 -20.595 1.00 0.00 H new ATOM 0 HB2 ASP A 202 31.316 5.184 -18.971 1.00 0.00 H new ATOM 0 HB3 ASP A 202 30.090 5.905 -17.948 1.00 0.00 H new ATOM 1245 N VAL A 203 27.477 6.427 -18.865 1.00 0.00 N ATOM 1246 CA VAL A 203 26.097 6.557 -18.413 1.00 0.00 C ATOM 1247 C VAL A 203 25.122 6.411 -19.577 1.00 0.00 C ATOM 1248 O VAL A 203 24.006 5.920 -19.409 1.00 0.00 O ATOM 1249 CB VAL A 203 25.857 7.913 -17.723 1.00 0.00 C ATOM 1250 CG1 VAL A 203 26.032 9.054 -18.714 1.00 0.00 C ATOM 1251 CG2 VAL A 203 24.474 7.951 -17.092 1.00 0.00 C ATOM 0 H VAL A 203 28.062 7.241 -18.673 1.00 0.00 H new ATOM 0 HA VAL A 203 25.923 5.757 -17.694 1.00 0.00 H new ATOM 0 HB VAL A 203 26.596 8.035 -16.931 1.00 0.00 H new ATOM 0 HG11 VAL A 203 25.859 10.004 -18.209 1.00 0.00 H new ATOM 0 HG12 VAL A 203 27.045 9.036 -19.115 1.00 0.00 H new ATOM 0 HG13 VAL A 203 25.317 8.941 -19.529 1.00 0.00 H new ATOM 0 HG21 VAL A 203 24.321 8.916 -16.609 1.00 0.00 H new ATOM 0 HG22 VAL A 203 23.718 7.808 -17.864 1.00 0.00 H new ATOM 0 HG23 VAL A 203 24.391 7.157 -16.350 1.00 0.00 H new ATOM 1261 N LYS A 204 25.552 6.841 -20.758 1.00 0.00 N ATOM 1262 CA LYS A 204 24.719 6.758 -21.952 1.00 0.00 C ATOM 1263 C LYS A 204 24.422 5.305 -22.308 1.00 0.00 C ATOM 1264 O LYS A 204 23.305 4.968 -22.700 1.00 0.00 O ATOM 1265 CB LYS A 204 25.409 7.451 -23.129 1.00 0.00 C ATOM 1266 CG LYS A 204 24.440 8.063 -24.127 1.00 0.00 C ATOM 1267 CD LYS A 204 25.174 8.754 -25.264 1.00 0.00 C ATOM 1268 CE LYS A 204 25.456 7.793 -26.409 1.00 0.00 C ATOM 1269 NZ LYS A 204 25.356 8.465 -27.735 1.00 0.00 N ATOM 0 H LYS A 204 26.473 7.251 -20.914 1.00 0.00 H new ATOM 0 HA LYS A 204 23.776 7.263 -21.743 1.00 0.00 H new ATOM 0 HB2 LYS A 204 26.065 8.233 -22.746 1.00 0.00 H new ATOM 0 HB3 LYS A 204 26.041 6.729 -23.645 1.00 0.00 H new ATOM 0 HG2 LYS A 204 23.792 7.285 -24.531 1.00 0.00 H new ATOM 0 HG3 LYS A 204 23.797 8.781 -23.618 1.00 0.00 H new ATOM 0 HD2 LYS A 204 24.578 9.591 -25.628 1.00 0.00 H new ATOM 0 HD3 LYS A 204 26.112 9.168 -24.895 1.00 0.00 H new ATOM 0 HE2 LYS A 204 26.454 7.370 -26.291 1.00 0.00 H new ATOM 0 HE3 LYS A 204 24.751 6.963 -26.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 204 25.555 7.777 -28.489 1.00 0.00 H new ATOM 0 HZ2 LYS A 204 24.397 8.847 -27.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 204 26.047 9.241 -27.784 1.00 0.00 H new ATOM 1283 N MET A 205 25.428 4.448 -22.167 1.00 0.00 N ATOM 1284 CA MET A 205 25.272 3.030 -22.471 1.00 0.00 C ATOM 1285 C MET A 205 24.242 2.386 -21.549 1.00 0.00 C ATOM 1286 O MET A 205 23.447 1.552 -21.979 1.00 0.00 O ATOM 1287 CB MET A 205 26.615 2.308 -22.340 1.00 0.00 C ATOM 1288 CG MET A 205 27.667 2.797 -23.322 1.00 0.00 C ATOM 1289 SD MET A 205 28.404 1.456 -24.275 1.00 0.00 S ATOM 1290 CE MET A 205 30.132 1.644 -23.844 1.00 0.00 C ATOM 0 H MET A 205 26.359 4.710 -21.844 1.00 0.00 H new ATOM 0 HA MET A 205 24.919 2.941 -23.498 1.00 0.00 H new ATOM 0 HB2 MET A 205 26.990 2.437 -21.325 1.00 0.00 H new ATOM 0 HB3 MET A 205 26.460 1.239 -22.489 1.00 0.00 H new ATOM 0 HG2 MET A 205 27.215 3.517 -24.004 1.00 0.00 H new ATOM 0 HG3 MET A 205 28.450 3.323 -22.777 1.00 0.00 H new ATOM 0 HE1 MET A 205 30.710 0.841 -24.300 1.00 0.00 H new ATOM 0 HE2 MET A 205 30.495 2.605 -24.208 1.00 0.00 H new ATOM 0 HE3 MET A 205 30.244 1.601 -22.761 1.00 0.00 H new ATOM 1300 N MET A 206 24.264 2.779 -20.279 1.00 0.00 N ATOM 1301 CA MET A 206 23.331 2.239 -19.297 1.00 0.00 C ATOM 1302 C MET A 206 21.888 2.513 -19.710 1.00 0.00 C ATOM 1303 O MET A 206 21.043 1.620 -19.669 1.00 0.00 O ATOM 1304 CB MET A 206 23.603 2.845 -17.918 1.00 0.00 C ATOM 1305 CG MET A 206 24.367 1.917 -16.987 1.00 0.00 C ATOM 1306 SD MET A 206 25.680 2.764 -16.088 1.00 0.00 S ATOM 1307 CE MET A 206 24.829 4.251 -15.567 1.00 0.00 C ATOM 0 H MET A 206 24.917 3.468 -19.907 1.00 0.00 H new ATOM 0 HA MET A 206 23.477 1.160 -19.248 1.00 0.00 H new ATOM 0 HB2 MET A 206 24.168 3.769 -18.041 1.00 0.00 H new ATOM 0 HB3 MET A 206 22.654 3.112 -17.453 1.00 0.00 H new ATOM 0 HG2 MET A 206 23.673 1.471 -16.274 1.00 0.00 H new ATOM 0 HG3 MET A 206 24.797 1.100 -17.567 1.00 0.00 H new ATOM 0 HE1 MET A 206 25.381 4.719 -14.752 1.00 0.00 H new ATOM 0 HE2 MET A 206 24.762 4.944 -16.405 1.00 0.00 H new ATOM 0 HE3 MET A 206 23.826 3.996 -15.226 1.00 0.00 H new ATOM 1317 N GLU A 207 21.616 3.752 -20.107 1.00 0.00 N ATOM 1318 CA GLU A 207 20.274 4.141 -20.526 1.00 0.00 C ATOM 1319 C GLU A 207 19.767 3.232 -21.641 1.00 0.00 C ATOM 1320 O GLU A 207 18.565 2.997 -21.767 1.00 0.00 O ATOM 1321 CB GLU A 207 20.266 5.597 -20.997 1.00 0.00 C ATOM 1322 CG GLU A 207 20.815 6.572 -19.969 1.00 0.00 C ATOM 1323 CD GLU A 207 20.237 7.966 -20.119 1.00 0.00 C ATOM 1324 OE1 GLU A 207 19.074 8.173 -19.714 1.00 0.00 O ATOM 1325 OE2 GLU A 207 20.948 8.850 -20.642 1.00 0.00 O ATOM 0 H GLU A 207 22.305 4.503 -20.147 1.00 0.00 H new ATOM 0 HA GLU A 207 19.609 4.040 -19.668 1.00 0.00 H new ATOM 0 HB2 GLU A 207 20.853 5.677 -21.912 1.00 0.00 H new ATOM 0 HB3 GLU A 207 19.245 5.883 -21.248 1.00 0.00 H new ATOM 0 HG2 GLU A 207 20.598 6.199 -18.968 1.00 0.00 H new ATOM 0 HG3 GLU A 207 21.900 6.621 -20.063 1.00 0.00 H new ATOM 1332 N ARG A 208 20.692 2.723 -22.449 1.00 0.00 N ATOM 1333 CA ARG A 208 20.340 1.841 -23.555 1.00 0.00 C ATOM 1334 C ARG A 208 19.779 0.519 -23.038 1.00 0.00 C ATOM 1335 O ARG A 208 18.721 0.068 -23.477 1.00 0.00 O ATOM 1336 CB ARG A 208 21.563 1.579 -24.435 1.00 0.00 C ATOM 1337 CG ARG A 208 21.218 1.017 -25.805 1.00 0.00 C ATOM 1338 CD ARG A 208 21.283 2.091 -26.880 1.00 0.00 C ATOM 1339 NE ARG A 208 20.539 1.712 -28.078 1.00 0.00 N ATOM 1340 CZ ARG A 208 20.132 2.581 -28.996 1.00 0.00 C ATOM 1341 NH1 ARG A 208 20.396 3.873 -28.854 1.00 0.00 N ATOM 1342 NH2 ARG A 208 19.459 2.159 -30.059 1.00 0.00 N ATOM 0 H ARG A 208 21.691 2.907 -22.358 1.00 0.00 H new ATOM 0 HA ARG A 208 19.572 2.334 -24.150 1.00 0.00 H new ATOM 0 HB2 ARG A 208 22.115 2.510 -24.562 1.00 0.00 H new ATOM 0 HB3 ARG A 208 22.227 0.883 -23.922 1.00 0.00 H new ATOM 0 HG2 ARG A 208 21.908 0.210 -26.053 1.00 0.00 H new ATOM 0 HG3 ARG A 208 20.218 0.585 -25.781 1.00 0.00 H new ATOM 0 HD2 ARG A 208 20.882 3.024 -26.485 1.00 0.00 H new ATOM 0 HD3 ARG A 208 22.324 2.277 -27.144 1.00 0.00 H new ATOM 0 HE ARG A 208 20.320 0.726 -28.217 1.00 0.00 H new ATOM 0 HH11 ARG A 208 20.913 4.201 -28.038 1.00 0.00 H new ATOM 0 HH12 ARG A 208 20.082 4.538 -29.561 1.00 0.00 H new ATOM 0 HH21 ARG A 208 19.254 1.166 -30.172 1.00 0.00 H new ATOM 0 HH22 ARG A 208 19.147 2.827 -30.763 1.00 0.00 H new ATOM 1356 N VAL A 209 20.495 -0.097 -22.104 1.00 0.00 N ATOM 1357 CA VAL A 209 20.069 -1.367 -21.527 1.00 0.00 C ATOM 1358 C VAL A 209 18.791 -1.199 -20.713 1.00 0.00 C ATOM 1359 O VAL A 209 17.946 -2.093 -20.673 1.00 0.00 O ATOM 1360 CB VAL A 209 21.164 -1.970 -20.626 1.00 0.00 C ATOM 1361 CG1 VAL A 209 20.740 -3.337 -20.114 1.00 0.00 C ATOM 1362 CG2 VAL A 209 22.483 -2.058 -21.378 1.00 0.00 C ATOM 0 H VAL A 209 21.373 0.262 -21.730 1.00 0.00 H new ATOM 0 HA VAL A 209 19.880 -2.045 -22.359 1.00 0.00 H new ATOM 0 HB VAL A 209 21.306 -1.315 -19.766 1.00 0.00 H new ATOM 0 HG11 VAL A 209 21.525 -3.748 -19.480 1.00 0.00 H new ATOM 0 HG12 VAL A 209 19.821 -3.240 -19.537 1.00 0.00 H new ATOM 0 HG13 VAL A 209 20.569 -4.005 -20.958 1.00 0.00 H new ATOM 0 HG21 VAL A 209 23.245 -2.486 -20.727 1.00 0.00 H new ATOM 0 HG22 VAL A 209 22.359 -2.691 -22.257 1.00 0.00 H new ATOM 0 HG23 VAL A 209 22.791 -1.060 -21.690 1.00 0.00 H new ATOM 1372 N VAL A 210 18.656 -0.047 -20.064 1.00 0.00 N ATOM 1373 CA VAL A 210 17.480 0.240 -19.251 1.00 0.00 C ATOM 1374 C VAL A 210 16.245 0.437 -20.123 1.00 0.00 C ATOM 1375 O VAL A 210 15.137 0.063 -19.738 1.00 0.00 O ATOM 1376 CB VAL A 210 17.690 1.496 -18.385 1.00 0.00 C ATOM 1377 CG1 VAL A 210 16.442 1.795 -17.567 1.00 0.00 C ATOM 1378 CG2 VAL A 210 18.901 1.324 -17.481 1.00 0.00 C ATOM 0 H VAL A 210 19.347 0.703 -20.085 1.00 0.00 H new ATOM 0 HA VAL A 210 17.327 -0.620 -18.599 1.00 0.00 H new ATOM 0 HB VAL A 210 17.876 2.344 -19.044 1.00 0.00 H new ATOM 0 HG11 VAL A 210 16.609 2.686 -16.961 1.00 0.00 H new ATOM 0 HG12 VAL A 210 15.600 1.965 -18.237 1.00 0.00 H new ATOM 0 HG13 VAL A 210 16.223 0.949 -16.916 1.00 0.00 H new ATOM 0 HG21 VAL A 210 19.034 2.221 -16.876 1.00 0.00 H new ATOM 0 HG22 VAL A 210 18.748 0.465 -16.827 1.00 0.00 H new ATOM 0 HG23 VAL A 210 19.790 1.162 -18.091 1.00 0.00 H new ATOM 1388 N GLU A 211 16.444 1.025 -21.298 1.00 0.00 N ATOM 1389 CA GLU A 211 15.345 1.272 -22.224 1.00 0.00 C ATOM 1390 C GLU A 211 14.815 -0.038 -22.800 1.00 0.00 C ATOM 1391 O GLU A 211 13.618 -0.316 -22.736 1.00 0.00 O ATOM 1392 CB GLU A 211 15.800 2.194 -23.357 1.00 0.00 C ATOM 1393 CG GLU A 211 14.743 2.413 -24.426 1.00 0.00 C ATOM 1394 CD GLU A 211 15.152 3.458 -25.446 1.00 0.00 C ATOM 1395 OE1 GLU A 211 16.316 3.425 -25.895 1.00 0.00 O ATOM 1396 OE2 GLU A 211 14.306 4.308 -25.795 1.00 0.00 O ATOM 0 H GLU A 211 17.355 1.339 -21.631 1.00 0.00 H new ATOM 0 HA GLU A 211 14.541 1.758 -21.672 1.00 0.00 H new ATOM 0 HB2 GLU A 211 16.085 3.159 -22.937 1.00 0.00 H new ATOM 0 HB3 GLU A 211 16.692 1.773 -23.821 1.00 0.00 H new ATOM 0 HG2 GLU A 211 14.547 1.470 -24.936 1.00 0.00 H new ATOM 0 HG3 GLU A 211 13.810 2.719 -23.952 1.00 0.00 H new ATOM 1403 N GLN A 212 15.715 -0.837 -23.363 1.00 0.00 N ATOM 1404 CA GLN A 212 15.339 -2.116 -23.952 1.00 0.00 C ATOM 1405 C GLN A 212 14.554 -2.964 -22.956 1.00 0.00 C ATOM 1406 O GLN A 212 13.610 -3.660 -23.328 1.00 0.00 O ATOM 1407 CB GLN A 212 16.583 -2.875 -24.416 1.00 0.00 C ATOM 1408 CG GLN A 212 16.566 -3.225 -25.895 1.00 0.00 C ATOM 1409 CD GLN A 212 16.523 -1.999 -26.785 1.00 0.00 C ATOM 1410 OE1 GLN A 212 17.421 -1.053 -26.534 1.00 0.00 O flip ATOM 1411 NE2 GLN A 212 15.692 -1.902 -27.689 1.00 0.00 N flip ATOM 0 H GLN A 212 16.710 -0.621 -23.424 1.00 0.00 H new ATOM 0 HA GLN A 212 14.702 -1.916 -24.814 1.00 0.00 H new ATOM 0 HB2 GLN A 212 17.466 -2.272 -24.204 1.00 0.00 H new ATOM 0 HB3 GLN A 212 16.676 -3.793 -23.835 1.00 0.00 H new ATOM 0 HG2 GLN A 212 17.452 -3.813 -26.135 1.00 0.00 H new ATOM 0 HG3 GLN A 212 15.700 -3.853 -26.106 1.00 0.00 H new ATOM 0 HE21 GLN A 212 15.020 -2.653 -27.847 1.00 0.00 H new ATOM 0 HE22 GLN A 212 15.676 -1.071 -28.280 1.00 0.00 H new ATOM 1420 N MET A 213 14.952 -2.900 -21.690 1.00 0.00 N ATOM 1421 CA MET A 213 14.285 -3.662 -20.640 1.00 0.00 C ATOM 1422 C MET A 213 12.860 -3.162 -20.428 1.00 0.00 C ATOM 1423 O MET A 213 11.953 -3.944 -20.144 1.00 0.00 O ATOM 1424 CB MET A 213 15.072 -3.565 -19.332 1.00 0.00 C ATOM 1425 CG MET A 213 15.748 -4.867 -18.932 1.00 0.00 C ATOM 1426 SD MET A 213 17.517 -4.670 -18.641 1.00 0.00 S ATOM 1427 CE MET A 213 17.511 -3.440 -17.338 1.00 0.00 C ATOM 0 H MET A 213 15.733 -2.329 -21.366 1.00 0.00 H new ATOM 0 HA MET A 213 14.242 -4.705 -20.953 1.00 0.00 H new ATOM 0 HB2 MET A 213 15.829 -2.787 -19.430 1.00 0.00 H new ATOM 0 HB3 MET A 213 14.398 -3.255 -18.534 1.00 0.00 H new ATOM 0 HG2 MET A 213 15.276 -5.254 -18.029 1.00 0.00 H new ATOM 0 HG3 MET A 213 15.593 -5.608 -19.716 1.00 0.00 H new ATOM 0 HE1 MET A 213 18.140 -2.599 -17.629 1.00 0.00 H new ATOM 0 HE2 MET A 213 16.492 -3.091 -17.172 1.00 0.00 H new ATOM 0 HE3 MET A 213 17.898 -3.881 -16.419 1.00 0.00 H new ATOM 1437 N CYS A 214 12.669 -1.854 -20.567 1.00 0.00 N ATOM 1438 CA CYS A 214 11.355 -1.249 -20.390 1.00 0.00 C ATOM 1439 C CYS A 214 10.397 -1.698 -21.491 1.00 0.00 C ATOM 1440 O CYS A 214 9.223 -1.965 -21.234 1.00 0.00 O ATOM 1441 CB CYS A 214 11.469 0.277 -20.389 1.00 0.00 C ATOM 1442 SG CYS A 214 11.453 1.022 -18.727 1.00 0.00 S ATOM 0 H CYS A 214 13.409 -1.192 -20.802 1.00 0.00 H new ATOM 0 HA CYS A 214 10.957 -1.578 -19.430 1.00 0.00 H new ATOM 0 HB2 CYS A 214 12.392 0.562 -20.895 1.00 0.00 H new ATOM 0 HB3 CYS A 214 10.646 0.693 -20.970 1.00 0.00 H new ATOM 0 HG CYS A 214 11.556 2.314 -18.830 1.00 0.00 H new ATOM 1447 N ILE A 215 10.907 -1.777 -22.715 1.00 0.00 N ATOM 1448 CA ILE A 215 10.098 -2.195 -23.853 1.00 0.00 C ATOM 1449 C ILE A 215 9.521 -3.589 -23.636 1.00 0.00 C ATOM 1450 O ILE A 215 8.400 -3.882 -24.053 1.00 0.00 O ATOM 1451 CB ILE A 215 10.916 -2.188 -25.158 1.00 0.00 C ATOM 1452 CG1 ILE A 215 11.535 -0.808 -25.390 1.00 0.00 C ATOM 1453 CG2 ILE A 215 10.038 -2.586 -26.335 1.00 0.00 C ATOM 1454 CD1 ILE A 215 10.511 0.286 -25.602 1.00 0.00 C ATOM 0 H ILE A 215 11.876 -1.557 -22.944 1.00 0.00 H new ATOM 0 HA ILE A 215 9.283 -1.477 -23.940 1.00 0.00 H new ATOM 0 HB ILE A 215 11.722 -2.916 -25.069 1.00 0.00 H new ATOM 0 HG12 ILE A 215 12.159 -0.550 -24.534 1.00 0.00 H new ATOM 0 HG13 ILE A 215 12.191 -0.854 -26.260 1.00 0.00 H new ATOM 0 HG21 ILE A 215 10.630 -2.576 -27.250 1.00 0.00 H new ATOM 0 HG22 ILE A 215 9.641 -3.588 -26.170 1.00 0.00 H new ATOM 0 HG23 ILE A 215 9.213 -1.879 -26.429 1.00 0.00 H new ATOM 0 HD11 ILE A 215 11.021 1.236 -25.760 1.00 0.00 H new ATOM 0 HD12 ILE A 215 9.903 0.051 -26.475 1.00 0.00 H new ATOM 0 HD13 ILE A 215 9.870 0.360 -24.723 1.00 0.00 H new ATOM 1466 N THR A 216 10.293 -4.448 -22.977 1.00 0.00 N ATOM 1467 CA THR A 216 9.859 -5.811 -22.703 1.00 0.00 C ATOM 1468 C THR A 216 8.809 -5.842 -21.599 1.00 0.00 C ATOM 1469 O THR A 216 7.862 -6.627 -21.653 1.00 0.00 O ATOM 1470 CB THR A 216 11.044 -6.706 -22.293 1.00 0.00 C ATOM 1471 OG1 THR A 216 12.043 -6.698 -23.320 1.00 0.00 O ATOM 1472 CG2 THR A 216 10.582 -8.133 -22.040 1.00 0.00 C ATOM 0 H THR A 216 11.223 -4.223 -22.623 1.00 0.00 H new ATOM 0 HA THR A 216 9.424 -6.196 -23.626 1.00 0.00 H new ATOM 0 HB THR A 216 11.468 -6.309 -21.371 1.00 0.00 H new ATOM 0 HG1 THR A 216 12.793 -7.268 -23.051 1.00 0.00 H new ATOM 0 HG21 THR A 216 11.436 -8.746 -21.752 1.00 0.00 H new ATOM 0 HG22 THR A 216 9.844 -8.140 -21.238 1.00 0.00 H new ATOM 0 HG23 THR A 216 10.135 -8.537 -22.948 1.00 0.00 H new ATOM 1480 N GLN A 217 8.982 -4.984 -20.599 1.00 0.00 N ATOM 1481 CA GLN A 217 8.047 -4.914 -19.482 1.00 0.00 C ATOM 1482 C GLN A 217 6.617 -4.737 -19.980 1.00 0.00 C ATOM 1483 O GLN A 217 5.665 -5.181 -19.336 1.00 0.00 O ATOM 1484 CB GLN A 217 8.421 -3.762 -18.548 1.00 0.00 C ATOM 1485 CG GLN A 217 8.016 -3.995 -17.101 1.00 0.00 C ATOM 1486 CD GLN A 217 8.857 -5.060 -16.424 1.00 0.00 C ATOM 1487 OE1 GLN A 217 10.084 -5.057 -16.528 1.00 0.00 O ATOM 1488 NE2 GLN A 217 8.200 -5.978 -15.725 1.00 0.00 N ATOM 0 H GLN A 217 9.761 -4.328 -20.539 1.00 0.00 H new ATOM 0 HA GLN A 217 8.107 -5.853 -18.931 1.00 0.00 H new ATOM 0 HB2 GLN A 217 9.498 -3.603 -18.594 1.00 0.00 H new ATOM 0 HB3 GLN A 217 7.949 -2.847 -18.906 1.00 0.00 H new ATOM 0 HG2 GLN A 217 8.106 -3.060 -16.548 1.00 0.00 H new ATOM 0 HG3 GLN A 217 6.967 -4.288 -17.064 1.00 0.00 H new ATOM 0 HE21 GLN A 217 7.182 -5.942 -15.666 1.00 0.00 H new ATOM 0 HE22 GLN A 217 8.713 -6.719 -15.247 1.00 0.00 H new ATOM 1497 N TYR A 218 6.472 -4.087 -21.129 1.00 0.00 N ATOM 1498 CA TYR A 218 5.157 -3.849 -21.712 1.00 0.00 C ATOM 1499 C TYR A 218 5.021 -4.555 -23.057 1.00 0.00 C ATOM 1500 O TYR A 218 5.779 -4.289 -23.989 1.00 0.00 O ATOM 1501 CB TYR A 218 4.916 -2.348 -21.885 1.00 0.00 C ATOM 1502 CG TYR A 218 4.856 -1.590 -20.578 1.00 0.00 C ATOM 1503 CD1 TYR A 218 3.825 -1.807 -19.673 1.00 0.00 C ATOM 1504 CD2 TYR A 218 5.831 -0.656 -20.248 1.00 0.00 C ATOM 1505 CE1 TYR A 218 3.765 -1.116 -18.478 1.00 0.00 C ATOM 1506 CE2 TYR A 218 5.780 0.039 -19.055 1.00 0.00 C ATOM 1507 CZ TYR A 218 4.745 -0.195 -18.174 1.00 0.00 C ATOM 1508 OH TYR A 218 4.691 0.495 -16.984 1.00 0.00 O ATOM 0 H TYR A 218 7.249 -3.715 -21.675 1.00 0.00 H new ATOM 0 HA TYR A 218 4.408 -4.255 -21.032 1.00 0.00 H new ATOM 0 HB2 TYR A 218 5.711 -1.930 -22.502 1.00 0.00 H new ATOM 0 HB3 TYR A 218 3.981 -2.198 -22.425 1.00 0.00 H new ATOM 0 HD1 TYR A 218 3.057 -2.529 -19.908 1.00 0.00 H new ATOM 0 HD2 TYR A 218 6.642 -0.470 -20.936 1.00 0.00 H new ATOM 0 HE1 TYR A 218 2.955 -1.296 -17.786 1.00 0.00 H new ATOM 0 HE2 TYR A 218 6.546 0.761 -18.814 1.00 0.00 H new ATOM 0 HH TYR A 218 5.457 1.104 -16.924 1.00 0.00 H new