USER MOD reduce.3.24.130724 H: found=0, std=0, add=758, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 761 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 295 CYS SG : rot 24:sc= -0.536 USER MOD Set 1.2: A 346 SER OG : rot -24:sc= 1.93 USER MOD Set 2.1: A 274 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 291 HIS : no HE2:sc= 0.826 K(o=0.83,f=-4.8!) USER MOD Single : A 247 LYS NZ :NH3+ 157:sc= 1.28 (180deg=1.22) USER MOD Single : A 248 GLN : amide:sc= -1.48 K(o=-1.5,f=-2) USER MOD Single : A 250 CYS SG : rot 180:sc= 0.0136 USER MOD Single : A 253 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0557) USER MOD Single : A 254 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 262 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 265 LYS NZ :NH3+ 166:sc= -0.0178 (180deg=-0.21) USER MOD Single : A 276 HIS : no HE2:sc= -1.27 K(o=-1.3,f=-5.5!) USER MOD Single : A 277 TYR OH : rot 180:sc= 0 USER MOD Single : A 278 TYR OH : rot 180:sc= 0 USER MOD Single : A 298 THR OG1 : rot 180:sc= 0 USER MOD Single : A 299 SER OG : rot 46:sc= 0.223 USER MOD Single : A 313 ASN : amide:sc= 0.169 K(o=0.17,f=-4.1!) USER MOD Single : A 319 THR OG1 : rot 180:sc= 0 USER MOD Single : A 324 HIS : no HD1:sc= -0.945 K(o=-0.95,f=-5.6!) USER MOD Single : A 325 TYR OH : rot 180:sc= 0 USER MOD Single : A 328 GLN :FLIP amide:sc= -4.77! C(o=-5.3!,f=-4.8!) USER MOD Single : A 331 THR OG1 : rot 180:sc= -0.0587 USER MOD Single : A 333 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 336 THR OG1 : rot 180:sc= 0.0691 USER MOD Single : A 340 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 343 GLN : amide:sc= -0.333 K(o=-0.33,f=-2.5!) USER MOD Single : A 344 MET CE :methyl -149:sc= -0.285 (180deg=-1.1) USER MOD ----------------------------------------------------------------- ATOM 89 N GLU A 239 16.266 7.251 -1.071 1.00 0.00 N ATOM 90 CA GLU A 239 16.258 5.832 -0.749 1.00 0.00 C ATOM 91 C GLU A 239 14.921 5.200 -1.101 1.00 0.00 C ATOM 92 O GLU A 239 14.853 4.023 -1.455 1.00 0.00 O ATOM 93 CB GLU A 239 16.568 5.640 0.737 1.00 0.00 C ATOM 94 CG GLU A 239 16.564 4.190 1.191 1.00 0.00 C ATOM 95 CD GLU A 239 17.006 4.031 2.629 1.00 0.00 C ATOM 96 OE1 GLU A 239 18.225 3.896 2.859 1.00 0.00 O ATOM 97 OE2 GLU A 239 16.141 4.047 3.530 1.00 0.00 O ATOM 0 HA GLU A 239 17.026 5.336 -1.342 1.00 0.00 H new ATOM 0 HB2 GLU A 239 17.545 6.074 0.952 1.00 0.00 H new ATOM 0 HB3 GLU A 239 15.836 6.195 1.324 1.00 0.00 H new ATOM 0 HG2 GLU A 239 15.561 3.779 1.075 1.00 0.00 H new ATOM 0 HG3 GLU A 239 17.223 3.609 0.546 1.00 0.00 H new ATOM 104 N GLU A 240 13.865 6.000 -1.026 1.00 0.00 N ATOM 105 CA GLU A 240 12.518 5.530 -1.319 1.00 0.00 C ATOM 106 C GLU A 240 12.411 5.030 -2.756 1.00 0.00 C ATOM 107 O GLU A 240 11.589 4.164 -3.059 1.00 0.00 O ATOM 108 CB GLU A 240 11.479 6.639 -1.108 1.00 0.00 C ATOM 109 CG GLU A 240 11.673 7.467 0.150 1.00 0.00 C ATOM 110 CD GLU A 240 12.660 8.596 -0.053 1.00 0.00 C ATOM 111 OE1 GLU A 240 12.257 9.645 -0.597 1.00 0.00 O ATOM 112 OE2 GLU A 240 13.844 8.429 0.308 1.00 0.00 O ATOM 0 H GLU A 240 13.917 6.984 -0.763 1.00 0.00 H new ATOM 0 HA GLU A 240 12.315 4.710 -0.630 1.00 0.00 H new ATOM 0 HB2 GLU A 240 11.500 7.305 -1.971 1.00 0.00 H new ATOM 0 HB3 GLU A 240 10.488 6.187 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 240 10.713 7.878 0.463 1.00 0.00 H new ATOM 0 HG3 GLU A 240 12.022 6.822 0.957 1.00 0.00 H new ATOM 119 N PHE A 241 13.233 5.580 -3.642 1.00 0.00 N ATOM 120 CA PHE A 241 13.148 5.249 -5.059 1.00 0.00 C ATOM 121 C PHE A 241 14.276 4.318 -5.472 1.00 0.00 C ATOM 122 O PHE A 241 14.315 3.847 -6.607 1.00 0.00 O ATOM 123 CB PHE A 241 13.190 6.514 -5.909 1.00 0.00 C ATOM 124 CG PHE A 241 12.269 7.590 -5.420 1.00 0.00 C ATOM 125 CD1 PHE A 241 10.895 7.428 -5.470 1.00 0.00 C ATOM 126 CD2 PHE A 241 12.786 8.761 -4.901 1.00 0.00 C ATOM 127 CE1 PHE A 241 10.052 8.418 -5.006 1.00 0.00 C ATOM 128 CE2 PHE A 241 11.947 9.758 -4.437 1.00 0.00 C ATOM 129 CZ PHE A 241 10.579 9.585 -4.488 1.00 0.00 C ATOM 0 H PHE A 241 13.962 6.253 -3.406 1.00 0.00 H new ATOM 0 HA PHE A 241 12.198 4.740 -5.223 1.00 0.00 H new ATOM 0 HB2 PHE A 241 14.210 6.898 -5.925 1.00 0.00 H new ATOM 0 HB3 PHE A 241 12.928 6.261 -6.937 1.00 0.00 H new ATOM 0 HD1 PHE A 241 10.478 6.518 -5.876 1.00 0.00 H new ATOM 0 HD2 PHE A 241 13.856 8.900 -4.857 1.00 0.00 H new ATOM 0 HE1 PHE A 241 8.982 8.280 -5.048 1.00 0.00 H new ATOM 0 HE2 PHE A 241 12.362 10.671 -4.035 1.00 0.00 H new ATOM 0 HZ PHE A 241 9.922 10.361 -4.124 1.00 0.00 H new ATOM 139 N ARG A 242 15.197 4.053 -4.552 1.00 0.00 N ATOM 140 CA ARG A 242 16.283 3.117 -4.825 1.00 0.00 C ATOM 141 C ARG A 242 15.734 1.707 -5.035 1.00 0.00 C ATOM 142 O ARG A 242 16.376 0.864 -5.662 1.00 0.00 O ATOM 143 CB ARG A 242 17.312 3.126 -3.691 1.00 0.00 C ATOM 144 CG ARG A 242 18.161 4.387 -3.656 1.00 0.00 C ATOM 145 CD ARG A 242 19.149 4.371 -2.500 1.00 0.00 C ATOM 146 NE ARG A 242 20.035 3.208 -2.540 1.00 0.00 N ATOM 147 CZ ARG A 242 21.253 3.178 -2.000 1.00 0.00 C ATOM 148 NH1 ARG A 242 21.755 4.265 -1.424 1.00 0.00 N ATOM 149 NH2 ARG A 242 21.961 2.057 -2.033 1.00 0.00 N ATOM 0 H ARG A 242 15.215 4.468 -3.620 1.00 0.00 H new ATOM 0 HA ARG A 242 16.783 3.436 -5.740 1.00 0.00 H new ATOM 0 HB2 ARG A 242 16.793 3.020 -2.738 1.00 0.00 H new ATOM 0 HB3 ARG A 242 17.965 2.260 -3.796 1.00 0.00 H new ATOM 0 HG2 ARG A 242 18.703 4.486 -4.596 1.00 0.00 H new ATOM 0 HG3 ARG A 242 17.513 5.259 -3.568 1.00 0.00 H new ATOM 0 HD2 ARG A 242 19.748 5.282 -2.525 1.00 0.00 H new ATOM 0 HD3 ARG A 242 18.601 4.375 -1.558 1.00 0.00 H new ATOM 0 HE ARG A 242 19.700 2.367 -3.011 1.00 0.00 H new ATOM 0 HH11 ARG A 242 21.208 5.125 -1.394 1.00 0.00 H new ATOM 0 HH12 ARG A 242 22.688 4.239 -1.011 1.00 0.00 H new ATOM 0 HH21 ARG A 242 21.573 1.221 -2.471 1.00 0.00 H new ATOM 0 HH22 ARG A 242 22.894 2.030 -1.621 1.00 0.00 H new ATOM 163 N GLY A 243 14.533 1.468 -4.526 1.00 0.00 N ATOM 164 CA GLY A 243 13.896 0.180 -4.692 1.00 0.00 C ATOM 165 C GLY A 243 13.142 0.073 -6.006 1.00 0.00 C ATOM 166 O GLY A 243 12.681 1.081 -6.546 1.00 0.00 O ATOM 0 H GLY A 243 13.987 2.149 -3.998 1.00 0.00 H new ATOM 0 HA2 GLY A 243 14.651 -0.605 -4.644 1.00 0.00 H new ATOM 0 HA3 GLY A 243 13.206 0.009 -3.865 1.00 0.00 H new ATOM 170 N VAL A 244 13.014 -1.147 -6.515 1.00 0.00 N ATOM 171 CA VAL A 244 12.345 -1.397 -7.779 1.00 0.00 C ATOM 172 C VAL A 244 10.835 -1.508 -7.577 1.00 0.00 C ATOM 173 O VAL A 244 10.375 -1.997 -6.547 1.00 0.00 O ATOM 174 CB VAL A 244 12.902 -2.685 -8.425 1.00 0.00 C ATOM 175 CG1 VAL A 244 12.036 -3.152 -9.577 1.00 0.00 C ATOM 176 CG2 VAL A 244 14.326 -2.453 -8.898 1.00 0.00 C ATOM 0 H VAL A 244 13.372 -1.987 -6.061 1.00 0.00 H new ATOM 0 HA VAL A 244 12.536 -0.558 -8.448 1.00 0.00 H new ATOM 0 HB VAL A 244 12.895 -3.470 -7.669 1.00 0.00 H new ATOM 0 HG11 VAL A 244 12.460 -4.060 -10.006 1.00 0.00 H new ATOM 0 HG12 VAL A 244 11.029 -3.357 -9.215 1.00 0.00 H new ATOM 0 HG13 VAL A 244 11.996 -2.375 -10.340 1.00 0.00 H new ATOM 0 HG21 VAL A 244 14.712 -3.366 -9.352 1.00 0.00 H new ATOM 0 HG22 VAL A 244 14.339 -1.648 -9.633 1.00 0.00 H new ATOM 0 HG23 VAL A 244 14.951 -2.178 -8.049 1.00 0.00 H new ATOM 186 N ILE A 245 10.077 -1.035 -8.559 1.00 0.00 N ATOM 187 CA ILE A 245 8.621 -1.023 -8.469 1.00 0.00 C ATOM 188 C ILE A 245 8.046 -2.437 -8.540 1.00 0.00 C ATOM 189 O ILE A 245 8.152 -3.115 -9.562 1.00 0.00 O ATOM 190 CB ILE A 245 7.974 -0.167 -9.579 1.00 0.00 C ATOM 191 CG1 ILE A 245 8.509 1.264 -9.541 1.00 0.00 C ATOM 192 CG2 ILE A 245 6.460 -0.161 -9.432 1.00 0.00 C ATOM 193 CD1 ILE A 245 9.421 1.600 -10.697 1.00 0.00 C ATOM 0 H ILE A 245 10.447 -0.654 -9.429 1.00 0.00 H new ATOM 0 HA ILE A 245 8.384 -0.580 -7.502 1.00 0.00 H new ATOM 0 HB ILE A 245 8.233 -0.609 -10.541 1.00 0.00 H new ATOM 0 HG12 ILE A 245 7.668 1.957 -9.539 1.00 0.00 H new ATOM 0 HG13 ILE A 245 9.049 1.416 -8.607 1.00 0.00 H new ATOM 0 HG21 ILE A 245 6.020 0.447 -10.222 1.00 0.00 H new ATOM 0 HG22 ILE A 245 6.083 -1.181 -9.507 1.00 0.00 H new ATOM 0 HG23 ILE A 245 6.190 0.255 -8.461 1.00 0.00 H new ATOM 0 HD11 ILE A 245 9.762 2.631 -10.604 1.00 0.00 H new ATOM 0 HD12 ILE A 245 10.282 0.931 -10.688 1.00 0.00 H new ATOM 0 HD13 ILE A 245 8.879 1.481 -11.635 1.00 0.00 H new ATOM 205 N ILE A 246 7.434 -2.865 -7.443 1.00 0.00 N ATOM 206 CA ILE A 246 6.808 -4.179 -7.364 1.00 0.00 C ATOM 207 C ILE A 246 5.446 -4.173 -8.050 1.00 0.00 C ATOM 208 O ILE A 246 5.110 -5.089 -8.803 1.00 0.00 O ATOM 209 CB ILE A 246 6.631 -4.622 -5.886 1.00 0.00 C ATOM 210 CG1 ILE A 246 7.989 -4.872 -5.232 1.00 0.00 C ATOM 211 CG2 ILE A 246 5.761 -5.871 -5.781 1.00 0.00 C ATOM 212 CD1 ILE A 246 8.708 -6.086 -5.777 1.00 0.00 C ATOM 0 H ILE A 246 7.358 -2.315 -6.588 1.00 0.00 H new ATOM 0 HA ILE A 246 7.465 -4.884 -7.873 1.00 0.00 H new ATOM 0 HB ILE A 246 6.128 -3.812 -5.357 1.00 0.00 H new ATOM 0 HG12 ILE A 246 8.618 -3.993 -5.373 1.00 0.00 H new ATOM 0 HG13 ILE A 246 7.849 -4.995 -4.158 1.00 0.00 H new ATOM 0 HG21 ILE A 246 5.657 -6.155 -4.734 1.00 0.00 H new ATOM 0 HG22 ILE A 246 4.776 -5.665 -6.201 1.00 0.00 H new ATOM 0 HG23 ILE A 246 6.227 -6.687 -6.333 1.00 0.00 H new ATOM 0 HD11 ILE A 246 9.664 -6.202 -5.267 1.00 0.00 H new ATOM 0 HD12 ILE A 246 8.099 -6.974 -5.612 1.00 0.00 H new ATOM 0 HD13 ILE A 246 8.880 -5.958 -6.846 1.00 0.00 H new ATOM 224 N LYS A 247 4.678 -3.122 -7.809 1.00 0.00 N ATOM 225 CA LYS A 247 3.284 -3.089 -8.215 1.00 0.00 C ATOM 226 C LYS A 247 2.804 -1.643 -8.314 1.00 0.00 C ATOM 227 O LYS A 247 3.176 -0.807 -7.486 1.00 0.00 O ATOM 228 CB LYS A 247 2.478 -3.876 -7.182 1.00 0.00 C ATOM 229 CG LYS A 247 1.045 -4.179 -7.566 1.00 0.00 C ATOM 230 CD LYS A 247 0.487 -5.268 -6.666 1.00 0.00 C ATOM 231 CE LYS A 247 -1.005 -5.451 -6.835 1.00 0.00 C ATOM 232 NZ LYS A 247 -1.382 -5.814 -8.226 1.00 0.00 N ATOM 0 H LYS A 247 4.999 -2.279 -7.333 1.00 0.00 H new ATOM 0 HA LYS A 247 3.154 -3.541 -9.198 1.00 0.00 H new ATOM 0 HB2 LYS A 247 2.991 -4.818 -6.988 1.00 0.00 H new ATOM 0 HB3 LYS A 247 2.475 -3.316 -6.247 1.00 0.00 H new ATOM 0 HG2 LYS A 247 0.438 -3.278 -7.480 1.00 0.00 H new ATOM 0 HG3 LYS A 247 0.998 -4.497 -8.608 1.00 0.00 H new ATOM 0 HD2 LYS A 247 0.992 -6.209 -6.884 1.00 0.00 H new ATOM 0 HD3 LYS A 247 0.704 -5.023 -5.626 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -1.351 -6.228 -6.154 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -1.515 -4.530 -6.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -2.303 -6.297 -8.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -1.446 -4.952 -8.805 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -0.661 -6.448 -8.627 1.00 0.00 H new ATOM 246 N GLN A 248 2.011 -1.343 -9.339 1.00 0.00 N ATOM 247 CA GLN A 248 1.520 0.016 -9.551 1.00 0.00 C ATOM 248 C GLN A 248 0.002 0.013 -9.695 1.00 0.00 C ATOM 249 O GLN A 248 -0.572 -0.929 -10.243 1.00 0.00 O ATOM 250 CB GLN A 248 2.130 0.662 -10.811 1.00 0.00 C ATOM 251 CG GLN A 248 3.509 0.156 -11.209 1.00 0.00 C ATOM 252 CD GLN A 248 3.476 -1.211 -11.870 1.00 0.00 C ATOM 253 OE1 GLN A 248 2.489 -1.589 -12.499 1.00 0.00 O ATOM 254 NE2 GLN A 248 4.563 -1.951 -11.749 1.00 0.00 N ATOM 0 H GLN A 248 1.695 -2.020 -10.034 1.00 0.00 H new ATOM 0 HA GLN A 248 1.820 0.599 -8.680 1.00 0.00 H new ATOM 0 HB2 GLN A 248 1.449 0.500 -11.646 1.00 0.00 H new ATOM 0 HB3 GLN A 248 2.190 1.739 -10.652 1.00 0.00 H new ATOM 0 HG2 GLN A 248 3.969 0.871 -11.891 1.00 0.00 H new ATOM 0 HG3 GLN A 248 4.142 0.109 -10.323 1.00 0.00 H new ATOM 0 HE21 GLN A 248 5.361 -1.602 -11.219 1.00 0.00 H new ATOM 0 HE22 GLN A 248 4.604 -2.872 -12.186 1.00 0.00 H new ATOM 263 N GLY A 249 -0.640 1.062 -9.201 1.00 0.00 N ATOM 264 CA GLY A 249 -2.075 1.200 -9.360 1.00 0.00 C ATOM 265 C GLY A 249 -2.654 2.262 -8.448 1.00 0.00 C ATOM 266 O GLY A 249 -2.176 2.448 -7.332 1.00 0.00 O ATOM 0 H GLY A 249 -0.192 1.823 -8.691 1.00 0.00 H new ATOM 0 HA2 GLY A 249 -2.301 1.451 -10.396 1.00 0.00 H new ATOM 0 HA3 GLY A 249 -2.555 0.244 -9.152 1.00 0.00 H new ATOM 270 N CYS A 250 -3.668 2.977 -8.919 1.00 0.00 N ATOM 271 CA CYS A 250 -4.314 3.991 -8.097 1.00 0.00 C ATOM 272 C CYS A 250 -5.148 3.315 -7.020 1.00 0.00 C ATOM 273 O CYS A 250 -5.841 2.334 -7.293 1.00 0.00 O ATOM 274 CB CYS A 250 -5.198 4.911 -8.947 1.00 0.00 C ATOM 275 SG CYS A 250 -4.416 5.472 -10.479 1.00 0.00 S ATOM 0 H CYS A 250 -4.057 2.875 -9.856 1.00 0.00 H new ATOM 0 HA CYS A 250 -3.542 4.604 -7.632 1.00 0.00 H new ATOM 0 HB2 CYS A 250 -6.121 4.386 -9.193 1.00 0.00 H new ATOM 0 HB3 CYS A 250 -5.476 5.782 -8.353 1.00 0.00 H new ATOM 0 HG CYS A 250 -5.238 6.241 -11.130 1.00 0.00 H new ATOM 281 N LEU A 251 -5.090 3.833 -5.804 1.00 0.00 N ATOM 282 CA LEU A 251 -5.806 3.247 -4.688 1.00 0.00 C ATOM 283 C LEU A 251 -6.519 4.352 -3.923 1.00 0.00 C ATOM 284 O LEU A 251 -6.208 5.533 -4.097 1.00 0.00 O ATOM 285 CB LEU A 251 -4.837 2.522 -3.744 1.00 0.00 C ATOM 286 CG LEU A 251 -4.160 1.261 -4.299 1.00 0.00 C ATOM 287 CD1 LEU A 251 -3.099 0.769 -3.329 1.00 0.00 C ATOM 288 CD2 LEU A 251 -5.187 0.169 -4.553 1.00 0.00 C ATOM 0 H LEU A 251 -4.549 4.665 -5.566 1.00 0.00 H new ATOM 0 HA LEU A 251 -6.527 2.524 -5.070 1.00 0.00 H new ATOM 0 HB2 LEU A 251 -4.059 3.225 -3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 251 -5.381 2.248 -2.840 1.00 0.00 H new ATOM 0 HG LEU A 251 -3.684 1.512 -5.247 1.00 0.00 H new ATOM 0 HD11 LEU A 251 -2.625 -0.126 -3.732 1.00 0.00 H new ATOM 0 HD12 LEU A 251 -2.347 1.546 -3.187 1.00 0.00 H new ATOM 0 HD13 LEU A 251 -3.563 0.534 -2.371 1.00 0.00 H new ATOM 0 HD21 LEU A 251 -4.687 -0.716 -4.946 1.00 0.00 H new ATOM 0 HD22 LEU A 251 -5.689 -0.083 -3.619 1.00 0.00 H new ATOM 0 HD23 LEU A 251 -5.922 0.522 -5.276 1.00 0.00 H new ATOM 300 N LEU A 252 -7.479 3.971 -3.098 1.00 0.00 N ATOM 301 CA LEU A 252 -8.170 4.920 -2.239 1.00 0.00 C ATOM 302 C LEU A 252 -7.455 5.021 -0.900 1.00 0.00 C ATOM 303 O LEU A 252 -7.250 4.015 -0.226 1.00 0.00 O ATOM 304 CB LEU A 252 -9.633 4.508 -2.025 1.00 0.00 C ATOM 305 CG LEU A 252 -10.639 5.063 -3.042 1.00 0.00 C ATOM 306 CD1 LEU A 252 -10.293 4.617 -4.449 1.00 0.00 C ATOM 307 CD2 LEU A 252 -12.053 4.635 -2.678 1.00 0.00 C ATOM 0 H LEU A 252 -7.799 3.007 -3.004 1.00 0.00 H new ATOM 0 HA LEU A 252 -8.161 5.894 -2.728 1.00 0.00 H new ATOM 0 HB2 LEU A 252 -9.690 3.420 -2.042 1.00 0.00 H new ATOM 0 HB3 LEU A 252 -9.939 4.827 -1.029 1.00 0.00 H new ATOM 0 HG LEU A 252 -10.586 6.151 -3.012 1.00 0.00 H new ATOM 0 HD11 LEU A 252 -11.022 5.024 -5.149 1.00 0.00 H new ATOM 0 HD12 LEU A 252 -9.298 4.977 -4.710 1.00 0.00 H new ATOM 0 HD13 LEU A 252 -10.310 3.528 -4.500 1.00 0.00 H new ATOM 0 HD21 LEU A 252 -12.754 5.037 -3.409 1.00 0.00 H new ATOM 0 HD22 LEU A 252 -12.115 3.547 -2.676 1.00 0.00 H new ATOM 0 HD23 LEU A 252 -12.304 5.014 -1.688 1.00 0.00 H new ATOM 319 N LYS A 253 -7.062 6.231 -0.533 1.00 0.00 N ATOM 320 CA LYS A 253 -6.378 6.463 0.732 1.00 0.00 C ATOM 321 C LYS A 253 -7.265 7.245 1.691 1.00 0.00 C ATOM 322 O LYS A 253 -7.655 8.376 1.397 1.00 0.00 O ATOM 323 CB LYS A 253 -5.074 7.232 0.496 1.00 0.00 C ATOM 324 CG LYS A 253 -4.227 7.414 1.750 1.00 0.00 C ATOM 325 CD LYS A 253 -2.975 8.226 1.461 1.00 0.00 C ATOM 326 CE LYS A 253 -2.058 8.306 2.674 1.00 0.00 C ATOM 327 NZ LYS A 253 -2.712 8.942 3.852 1.00 0.00 N ATOM 0 H LYS A 253 -7.205 7.071 -1.094 1.00 0.00 H new ATOM 0 HA LYS A 253 -6.150 5.494 1.176 1.00 0.00 H new ATOM 0 HB2 LYS A 253 -4.485 6.706 -0.255 1.00 0.00 H new ATOM 0 HB3 LYS A 253 -5.312 8.213 0.085 1.00 0.00 H new ATOM 0 HG2 LYS A 253 -4.816 7.913 2.520 1.00 0.00 H new ATOM 0 HG3 LYS A 253 -3.946 6.438 2.146 1.00 0.00 H new ATOM 0 HD2 LYS A 253 -2.436 7.777 0.627 1.00 0.00 H new ATOM 0 HD3 LYS A 253 -3.258 9.232 1.153 1.00 0.00 H new ATOM 0 HE2 LYS A 253 -1.732 7.302 2.944 1.00 0.00 H new ATOM 0 HE3 LYS A 253 -1.164 8.872 2.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 253 -2.018 9.047 4.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 253 -3.076 9.879 3.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 253 -3.499 8.345 4.176 1.00 0.00 H new ATOM 341 N GLN A 254 -7.602 6.624 2.814 1.00 0.00 N ATOM 342 CA GLN A 254 -8.329 7.310 3.878 1.00 0.00 C ATOM 343 C GLN A 254 -7.484 8.459 4.417 1.00 0.00 C ATOM 344 O GLN A 254 -6.512 8.246 5.148 1.00 0.00 O ATOM 345 CB GLN A 254 -8.703 6.339 5.004 1.00 0.00 C ATOM 346 CG GLN A 254 -9.307 7.013 6.230 1.00 0.00 C ATOM 347 CD GLN A 254 -10.581 7.779 5.922 1.00 0.00 C ATOM 348 OE1 GLN A 254 -10.539 8.956 5.564 1.00 0.00 O ATOM 349 NE2 GLN A 254 -11.721 7.127 6.084 1.00 0.00 N ATOM 0 H GLN A 254 -7.385 5.648 3.013 1.00 0.00 H new ATOM 0 HA GLN A 254 -9.255 7.711 3.466 1.00 0.00 H new ATOM 0 HB2 GLN A 254 -9.413 5.607 4.618 1.00 0.00 H new ATOM 0 HB3 GLN A 254 -7.812 5.789 5.307 1.00 0.00 H new ATOM 0 HG2 GLN A 254 -9.519 6.257 6.986 1.00 0.00 H new ATOM 0 HG3 GLN A 254 -8.574 7.696 6.660 1.00 0.00 H new ATOM 0 HE21 GLN A 254 -11.713 6.152 6.382 1.00 0.00 H new ATOM 0 HE22 GLN A 254 -12.608 7.600 5.911 1.00 0.00 H new ATOM 467 N TRP A 261 -11.850 9.313 1.229 1.00 0.00 N ATOM 468 CA TRP A 261 -10.866 8.539 0.493 1.00 0.00 C ATOM 469 C TRP A 261 -10.304 9.320 -0.688 1.00 0.00 C ATOM 470 O TRP A 261 -11.040 9.969 -1.434 1.00 0.00 O ATOM 471 CB TRP A 261 -11.488 7.222 0.022 1.00 0.00 C ATOM 472 CG TRP A 261 -11.906 6.343 1.166 1.00 0.00 C ATOM 473 CD1 TRP A 261 -13.090 6.380 1.853 1.00 0.00 C ATOM 474 CD2 TRP A 261 -11.132 5.300 1.760 1.00 0.00 C ATOM 475 NE1 TRP A 261 -13.085 5.429 2.847 1.00 0.00 N ATOM 476 CE2 TRP A 261 -11.896 4.753 2.805 1.00 0.00 C ATOM 477 CE3 TRP A 261 -9.867 4.773 1.506 1.00 0.00 C ATOM 478 CZ2 TRP A 261 -11.426 3.711 3.600 1.00 0.00 C ATOM 479 CZ3 TRP A 261 -9.407 3.736 2.290 1.00 0.00 C ATOM 480 CH2 TRP A 261 -10.184 3.215 3.325 1.00 0.00 C ATOM 0 HA TRP A 261 -10.034 8.323 1.163 1.00 0.00 H new ATOM 0 HB2 TRP A 261 -12.355 7.436 -0.603 1.00 0.00 H new ATOM 0 HB3 TRP A 261 -10.771 6.687 -0.600 1.00 0.00 H new ATOM 0 HD1 TRP A 261 -13.907 7.056 1.645 1.00 0.00 H new ATOM 0 HE1 TRP A 261 -13.843 5.256 3.507 1.00 0.00 H new ATOM 0 HE3 TRP A 261 -9.257 5.170 0.708 1.00 0.00 H new ATOM 0 HZ2 TRP A 261 -12.023 3.309 4.406 1.00 0.00 H new ATOM 0 HZ3 TRP A 261 -8.429 3.320 2.100 1.00 0.00 H new ATOM 0 HH2 TRP A 261 -9.795 2.403 3.921 1.00 0.00 H new ATOM 491 N LYS A 262 -8.988 9.265 -0.833 1.00 0.00 N ATOM 492 CA LYS A 262 -8.301 9.934 -1.926 1.00 0.00 C ATOM 493 C LYS A 262 -7.939 8.950 -3.034 1.00 0.00 C ATOM 494 O LYS A 262 -7.304 7.926 -2.786 1.00 0.00 O ATOM 495 CB LYS A 262 -7.035 10.631 -1.414 1.00 0.00 C ATOM 496 CG LYS A 262 -7.308 11.860 -0.557 1.00 0.00 C ATOM 497 CD LYS A 262 -7.937 12.974 -1.378 1.00 0.00 C ATOM 498 CE LYS A 262 -8.212 14.214 -0.538 1.00 0.00 C ATOM 499 NZ LYS A 262 -8.806 15.308 -1.352 1.00 0.00 N ATOM 0 H LYS A 262 -8.370 8.758 -0.200 1.00 0.00 H new ATOM 0 HA LYS A 262 -8.979 10.681 -2.339 1.00 0.00 H new ATOM 0 HB2 LYS A 262 -6.450 9.918 -0.833 1.00 0.00 H new ATOM 0 HB3 LYS A 262 -6.424 10.924 -2.267 1.00 0.00 H new ATOM 0 HG2 LYS A 262 -7.971 11.593 0.266 1.00 0.00 H new ATOM 0 HG3 LYS A 262 -6.376 12.212 -0.115 1.00 0.00 H new ATOM 0 HD2 LYS A 262 -7.275 13.235 -2.204 1.00 0.00 H new ATOM 0 HD3 LYS A 262 -8.869 12.619 -1.817 1.00 0.00 H new ATOM 0 HE2 LYS A 262 -8.888 13.959 0.278 1.00 0.00 H new ATOM 0 HE3 LYS A 262 -7.283 14.560 -0.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 262 -8.980 16.136 -0.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 262 -8.149 15.569 -2.115 1.00 0.00 H new ATOM 0 HZ3 LYS A 262 -9.705 14.986 -1.764 1.00 0.00 H new ATOM 513 N VAL A 263 -8.355 9.276 -4.247 1.00 0.00 N ATOM 514 CA VAL A 263 -8.017 8.472 -5.415 1.00 0.00 C ATOM 515 C VAL A 263 -6.731 8.982 -6.043 1.00 0.00 C ATOM 516 O VAL A 263 -6.717 10.026 -6.696 1.00 0.00 O ATOM 517 CB VAL A 263 -9.129 8.462 -6.481 1.00 0.00 C ATOM 518 CG1 VAL A 263 -8.708 7.625 -7.685 1.00 0.00 C ATOM 519 CG2 VAL A 263 -10.426 7.940 -5.890 1.00 0.00 C ATOM 0 H VAL A 263 -8.929 10.094 -4.451 1.00 0.00 H new ATOM 0 HA VAL A 263 -7.892 7.448 -5.062 1.00 0.00 H new ATOM 0 HB VAL A 263 -9.295 9.485 -6.818 1.00 0.00 H new ATOM 0 HG11 VAL A 263 -9.506 7.629 -8.428 1.00 0.00 H new ATOM 0 HG12 VAL A 263 -7.803 8.046 -8.122 1.00 0.00 H new ATOM 0 HG13 VAL A 263 -8.514 6.601 -7.366 1.00 0.00 H new ATOM 0 HG21 VAL A 263 -11.201 7.940 -6.657 1.00 0.00 H new ATOM 0 HG22 VAL A 263 -10.276 6.924 -5.525 1.00 0.00 H new ATOM 0 HG23 VAL A 263 -10.733 8.581 -5.064 1.00 0.00 H new ATOM 529 N ARG A 264 -5.651 8.255 -5.822 1.00 0.00 N ATOM 530 CA ARG A 264 -4.356 8.657 -6.345 1.00 0.00 C ATOM 531 C ARG A 264 -3.486 7.455 -6.679 1.00 0.00 C ATOM 532 O ARG A 264 -3.749 6.339 -6.236 1.00 0.00 O ATOM 533 CB ARG A 264 -3.662 9.598 -5.360 1.00 0.00 C ATOM 534 CG ARG A 264 -3.845 9.228 -3.900 1.00 0.00 C ATOM 535 CD ARG A 264 -3.496 10.404 -3.004 1.00 0.00 C ATOM 536 NE ARG A 264 -4.170 11.627 -3.441 1.00 0.00 N ATOM 537 CZ ARG A 264 -4.221 12.754 -2.735 1.00 0.00 C ATOM 538 NH1 ARG A 264 -3.672 12.823 -1.529 1.00 0.00 N ATOM 539 NH2 ARG A 264 -4.831 13.817 -3.242 1.00 0.00 N ATOM 0 H ARG A 264 -5.643 7.387 -5.287 1.00 0.00 H new ATOM 0 HA ARG A 264 -4.517 9.195 -7.279 1.00 0.00 H new ATOM 0 HB2 ARG A 264 -2.596 9.618 -5.586 1.00 0.00 H new ATOM 0 HB3 ARG A 264 -4.039 10.609 -5.516 1.00 0.00 H new ATOM 0 HG2 ARG A 264 -4.876 8.922 -3.723 1.00 0.00 H new ATOM 0 HG3 ARG A 264 -3.213 8.375 -3.653 1.00 0.00 H new ATOM 0 HD2 ARG A 264 -3.780 10.177 -1.976 1.00 0.00 H new ATOM 0 HD3 ARG A 264 -2.417 10.560 -3.009 1.00 0.00 H new ATOM 0 HE ARG A 264 -4.633 11.615 -4.350 1.00 0.00 H new ATOM 0 HH11 ARG A 264 -3.205 12.007 -1.134 1.00 0.00 H new ATOM 0 HH12 ARG A 264 -3.717 13.692 -0.997 1.00 0.00 H new ATOM 0 HH21 ARG A 264 -5.257 13.767 -4.167 1.00 0.00 H new ATOM 0 HH22 ARG A 264 -4.874 14.684 -2.707 1.00 0.00 H new ATOM 553 N LYS A 265 -2.456 7.703 -7.478 1.00 0.00 N ATOM 554 CA LYS A 265 -1.633 6.648 -8.054 1.00 0.00 C ATOM 555 C LYS A 265 -0.619 6.117 -7.048 1.00 0.00 C ATOM 556 O LYS A 265 0.264 6.849 -6.610 1.00 0.00 O ATOM 557 CB LYS A 265 -0.903 7.199 -9.279 1.00 0.00 C ATOM 558 CG LYS A 265 -0.169 6.147 -10.089 1.00 0.00 C ATOM 559 CD LYS A 265 0.682 6.786 -11.175 1.00 0.00 C ATOM 560 CE LYS A 265 1.289 5.743 -12.097 1.00 0.00 C ATOM 561 NZ LYS A 265 0.256 5.052 -12.911 1.00 0.00 N ATOM 0 H LYS A 265 -2.167 8.644 -7.745 1.00 0.00 H new ATOM 0 HA LYS A 265 -2.283 5.821 -8.340 1.00 0.00 H new ATOM 0 HB2 LYS A 265 -1.625 7.700 -9.924 1.00 0.00 H new ATOM 0 HB3 LYS A 265 -0.188 7.955 -8.953 1.00 0.00 H new ATOM 0 HG2 LYS A 265 0.464 5.552 -9.430 1.00 0.00 H new ATOM 0 HG3 LYS A 265 -0.889 5.465 -10.541 1.00 0.00 H new ATOM 0 HD2 LYS A 265 0.071 7.476 -11.757 1.00 0.00 H new ATOM 0 HD3 LYS A 265 1.477 7.374 -10.716 1.00 0.00 H new ATOM 0 HE2 LYS A 265 2.012 6.220 -12.758 1.00 0.00 H new ATOM 0 HE3 LYS A 265 1.835 5.009 -11.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 265 0.715 4.529 -13.683 1.00 0.00 H new ATOM 0 HZ2 LYS A 265 -0.273 4.388 -12.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 265 -0.398 5.755 -13.310 1.00 0.00 H new ATOM 575 N PHE A 266 -0.747 4.850 -6.687 1.00 0.00 N ATOM 576 CA PHE A 266 0.164 4.228 -5.739 1.00 0.00 C ATOM 577 C PHE A 266 1.191 3.347 -6.435 1.00 0.00 C ATOM 578 O PHE A 266 0.846 2.462 -7.218 1.00 0.00 O ATOM 579 CB PHE A 266 -0.622 3.404 -4.721 1.00 0.00 C ATOM 580 CG PHE A 266 -1.217 4.225 -3.614 1.00 0.00 C ATOM 581 CD1 PHE A 266 -2.397 4.926 -3.806 1.00 0.00 C ATOM 582 CD2 PHE A 266 -0.595 4.297 -2.381 1.00 0.00 C ATOM 583 CE1 PHE A 266 -2.943 5.680 -2.787 1.00 0.00 C ATOM 584 CE2 PHE A 266 -1.136 5.049 -1.359 1.00 0.00 C ATOM 585 CZ PHE A 266 -2.311 5.742 -1.563 1.00 0.00 C ATOM 0 H PHE A 266 -1.477 4.230 -7.038 1.00 0.00 H new ATOM 0 HA PHE A 266 0.702 5.026 -5.228 1.00 0.00 H new ATOM 0 HB2 PHE A 266 -1.421 2.871 -5.237 1.00 0.00 H new ATOM 0 HB3 PHE A 266 0.037 2.651 -4.289 1.00 0.00 H new ATOM 0 HD1 PHE A 266 -2.895 4.882 -4.763 1.00 0.00 H new ATOM 0 HD2 PHE A 266 0.326 3.758 -2.216 1.00 0.00 H new ATOM 0 HE1 PHE A 266 -3.864 6.221 -2.948 1.00 0.00 H new ATOM 0 HE2 PHE A 266 -0.640 5.095 -0.401 1.00 0.00 H new ATOM 0 HZ PHE A 266 -2.736 6.333 -0.765 1.00 0.00 H new ATOM 595 N ILE A 267 2.457 3.622 -6.172 1.00 0.00 N ATOM 596 CA ILE A 267 3.541 2.777 -6.641 1.00 0.00 C ATOM 597 C ILE A 267 4.332 2.212 -5.469 1.00 0.00 C ATOM 598 O ILE A 267 4.774 2.948 -4.579 1.00 0.00 O ATOM 599 CB ILE A 267 4.492 3.539 -7.594 1.00 0.00 C ATOM 600 CG1 ILE A 267 3.805 3.800 -8.937 1.00 0.00 C ATOM 601 CG2 ILE A 267 5.789 2.774 -7.802 1.00 0.00 C ATOM 602 CD1 ILE A 267 4.652 4.588 -9.914 1.00 0.00 C ATOM 0 H ILE A 267 2.761 4.432 -5.631 1.00 0.00 H new ATOM 0 HA ILE A 267 3.088 1.956 -7.197 1.00 0.00 H new ATOM 0 HB ILE A 267 4.736 4.496 -7.132 1.00 0.00 H new ATOM 0 HG12 ILE A 267 3.538 2.845 -9.390 1.00 0.00 H new ATOM 0 HG13 ILE A 267 2.875 4.340 -8.760 1.00 0.00 H new ATOM 0 HG21 ILE A 267 6.437 3.334 -8.476 1.00 0.00 H new ATOM 0 HG22 ILE A 267 6.291 2.641 -6.843 1.00 0.00 H new ATOM 0 HG23 ILE A 267 5.570 1.798 -8.236 1.00 0.00 H new ATOM 0 HD11 ILE A 267 4.098 4.733 -10.841 1.00 0.00 H new ATOM 0 HD12 ILE A 267 4.897 5.558 -9.483 1.00 0.00 H new ATOM 0 HD13 ILE A 267 5.571 4.041 -10.122 1.00 0.00 H new ATOM 614 N LEU A 268 4.514 0.906 -5.484 1.00 0.00 N ATOM 615 CA LEU A 268 5.264 0.219 -4.450 1.00 0.00 C ATOM 616 C LEU A 268 6.691 -0.036 -4.933 1.00 0.00 C ATOM 617 O LEU A 268 6.931 -0.135 -6.135 1.00 0.00 O ATOM 618 CB LEU A 268 4.571 -1.100 -4.102 1.00 0.00 C ATOM 619 CG LEU A 268 5.256 -1.926 -3.022 1.00 0.00 C ATOM 620 CD1 LEU A 268 5.153 -1.228 -1.682 1.00 0.00 C ATOM 621 CD2 LEU A 268 4.642 -3.307 -2.957 1.00 0.00 C ATOM 0 H LEU A 268 4.147 0.292 -6.211 1.00 0.00 H new ATOM 0 HA LEU A 268 5.304 0.839 -3.555 1.00 0.00 H new ATOM 0 HB2 LEU A 268 3.552 -0.883 -3.780 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.498 -1.703 -5.007 1.00 0.00 H new ATOM 0 HG LEU A 268 6.312 -2.029 -3.272 1.00 0.00 H new ATOM 0 HD11 LEU A 268 5.647 -1.830 -0.919 1.00 0.00 H new ATOM 0 HD12 LEU A 268 5.635 -0.252 -1.742 1.00 0.00 H new ATOM 0 HD13 LEU A 268 4.103 -1.099 -1.419 1.00 0.00 H new ATOM 0 HD21 LEU A 268 5.139 -3.890 -2.182 1.00 0.00 H new ATOM 0 HD22 LEU A 268 3.581 -3.223 -2.724 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.763 -3.805 -3.919 1.00 0.00 H new ATOM 633 N ARG A 269 7.628 -0.171 -3.999 1.00 0.00 N ATOM 634 CA ARG A 269 9.041 -0.335 -4.341 1.00 0.00 C ATOM 635 C ARG A 269 9.740 -1.213 -3.310 1.00 0.00 C ATOM 636 O ARG A 269 9.534 -1.051 -2.105 1.00 0.00 O ATOM 637 CB ARG A 269 9.759 1.018 -4.455 1.00 0.00 C ATOM 638 CG ARG A 269 9.349 1.835 -5.677 1.00 0.00 C ATOM 639 CD ARG A 269 10.265 3.032 -5.876 1.00 0.00 C ATOM 640 NE ARG A 269 9.915 3.823 -7.059 1.00 0.00 N ATOM 641 CZ ARG A 269 10.747 4.029 -8.085 1.00 0.00 C ATOM 642 NH1 ARG A 269 11.914 3.397 -8.134 1.00 0.00 N ATOM 643 NH2 ARG A 269 10.400 4.844 -9.075 1.00 0.00 N ATOM 0 H ARG A 269 7.436 -0.170 -2.997 1.00 0.00 H new ATOM 0 HA ARG A 269 9.087 -0.821 -5.316 1.00 0.00 H new ATOM 0 HB2 ARG A 269 9.559 1.601 -3.556 1.00 0.00 H new ATOM 0 HB3 ARG A 269 10.835 0.846 -4.490 1.00 0.00 H new ATOM 0 HG2 ARG A 269 9.375 1.203 -6.565 1.00 0.00 H new ATOM 0 HG3 ARG A 269 8.321 2.177 -5.560 1.00 0.00 H new ATOM 0 HD2 ARG A 269 10.221 3.669 -4.992 1.00 0.00 H new ATOM 0 HD3 ARG A 269 11.294 2.685 -5.968 1.00 0.00 H new ATOM 0 HE ARG A 269 8.985 4.240 -7.102 1.00 0.00 H new ATOM 0 HH11 ARG A 269 12.177 2.753 -7.388 1.00 0.00 H new ATOM 0 HH12 ARG A 269 12.547 3.556 -8.918 1.00 0.00 H new ATOM 0 HH21 ARG A 269 9.496 5.315 -9.054 1.00 0.00 H new ATOM 0 HH22 ARG A 269 11.038 4.998 -9.856 1.00 0.00 H new ATOM 657 N GLU A 270 10.564 -2.138 -3.793 1.00 0.00 N ATOM 658 CA GLU A 270 11.219 -3.115 -2.926 1.00 0.00 C ATOM 659 C GLU A 270 12.671 -2.752 -2.622 1.00 0.00 C ATOM 660 O GLU A 270 13.448 -2.460 -3.526 1.00 0.00 O ATOM 661 CB GLU A 270 11.128 -4.531 -3.532 1.00 0.00 C ATOM 662 CG GLU A 270 11.674 -4.682 -4.959 1.00 0.00 C ATOM 663 CD GLU A 270 13.159 -4.996 -5.029 1.00 0.00 C ATOM 664 OE1 GLU A 270 13.574 -6.050 -4.504 1.00 0.00 O ATOM 665 OE2 GLU A 270 13.915 -4.206 -5.638 1.00 0.00 O ATOM 0 H GLU A 270 10.795 -2.232 -4.782 1.00 0.00 H new ATOM 0 HA GLU A 270 10.684 -3.101 -1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 270 11.668 -5.220 -2.882 1.00 0.00 H new ATOM 0 HB3 GLU A 270 10.083 -4.841 -3.528 1.00 0.00 H new ATOM 0 HG2 GLU A 270 11.123 -5.475 -5.465 1.00 0.00 H new ATOM 0 HG3 GLU A 270 11.483 -3.760 -5.508 1.00 0.00 H new ATOM 672 N ASP A 271 12.975 -2.730 -1.323 1.00 0.00 N ATOM 673 CA ASP A 271 14.336 -2.611 -0.764 1.00 0.00 C ATOM 674 C ASP A 271 14.244 -1.995 0.635 1.00 0.00 C ATOM 675 O ASP A 271 14.533 -2.670 1.622 1.00 0.00 O ATOM 676 CB ASP A 271 15.324 -1.812 -1.632 1.00 0.00 C ATOM 677 CG ASP A 271 16.698 -1.733 -0.996 1.00 0.00 C ATOM 678 OD1 ASP A 271 17.480 -2.696 -1.139 1.00 0.00 O ATOM 679 OD2 ASP A 271 16.997 -0.715 -0.345 1.00 0.00 O ATOM 0 H ASP A 271 12.259 -2.797 -0.600 1.00 0.00 H new ATOM 0 HA ASP A 271 14.744 -3.621 -0.729 1.00 0.00 H new ATOM 0 HB2 ASP A 271 15.405 -2.279 -2.614 1.00 0.00 H new ATOM 0 HB3 ASP A 271 14.938 -0.805 -1.788 1.00 0.00 H new ATOM 684 N PRO A 272 13.810 -0.719 0.759 1.00 0.00 N ATOM 685 CA PRO A 272 13.568 -0.096 2.048 1.00 0.00 C ATOM 686 C PRO A 272 12.094 -0.173 2.443 1.00 0.00 C ATOM 687 O PRO A 272 11.713 0.176 3.563 1.00 0.00 O ATOM 688 CB PRO A 272 13.984 1.357 1.804 1.00 0.00 C ATOM 689 CG PRO A 272 13.977 1.557 0.313 1.00 0.00 C ATOM 690 CD PRO A 272 13.563 0.251 -0.316 1.00 0.00 C ATOM 0 HA PRO A 272 14.110 -0.580 2.860 1.00 0.00 H new ATOM 0 HB2 PRO A 272 13.294 2.046 2.291 1.00 0.00 H new ATOM 0 HB3 PRO A 272 14.974 1.552 2.217 1.00 0.00 H new ATOM 0 HG2 PRO A 272 13.285 2.353 0.036 1.00 0.00 H new ATOM 0 HG3 PRO A 272 14.964 1.856 -0.039 1.00 0.00 H new ATOM 0 HD2 PRO A 272 12.516 0.262 -0.619 1.00 0.00 H new ATOM 0 HD3 PRO A 272 14.150 0.027 -1.206 1.00 0.00 H new ATOM 698 N ALA A 273 11.286 -0.627 1.483 1.00 0.00 N ATOM 699 CA ALA A 273 9.841 -0.786 1.638 1.00 0.00 C ATOM 700 C ALA A 273 9.140 0.556 1.838 1.00 0.00 C ATOM 701 O ALA A 273 8.957 1.023 2.964 1.00 0.00 O ATOM 702 CB ALA A 273 9.512 -1.748 2.771 1.00 0.00 C ATOM 0 H ALA A 273 11.625 -0.899 0.560 1.00 0.00 H new ATOM 0 HA ALA A 273 9.463 -1.215 0.710 1.00 0.00 H new ATOM 0 HB1 ALA A 273 8.430 -1.846 2.862 1.00 0.00 H new ATOM 0 HB2 ALA A 273 9.948 -2.724 2.558 1.00 0.00 H new ATOM 0 HB3 ALA A 273 9.922 -1.364 3.705 1.00 0.00 H new ATOM 708 N TYR A 274 8.740 1.166 0.726 1.00 0.00 N ATOM 709 CA TYR A 274 8.035 2.442 0.759 1.00 0.00 C ATOM 710 C TYR A 274 6.912 2.473 -0.269 1.00 0.00 C ATOM 711 O TYR A 274 7.114 2.159 -1.445 1.00 0.00 O ATOM 712 CB TYR A 274 8.990 3.617 0.514 1.00 0.00 C ATOM 713 CG TYR A 274 9.876 3.941 1.694 1.00 0.00 C ATOM 714 CD1 TYR A 274 9.358 4.559 2.824 1.00 0.00 C ATOM 715 CD2 TYR A 274 11.227 3.629 1.680 1.00 0.00 C ATOM 716 CE1 TYR A 274 10.161 4.854 3.907 1.00 0.00 C ATOM 717 CE2 TYR A 274 12.036 3.918 2.761 1.00 0.00 C ATOM 718 CZ TYR A 274 11.500 4.534 3.870 1.00 0.00 C ATOM 719 OH TYR A 274 12.303 4.813 4.951 1.00 0.00 O ATOM 0 H TYR A 274 8.893 0.795 -0.212 1.00 0.00 H new ATOM 0 HA TYR A 274 7.606 2.545 1.756 1.00 0.00 H new ATOM 0 HB2 TYR A 274 9.618 3.389 -0.347 1.00 0.00 H new ATOM 0 HB3 TYR A 274 8.405 4.500 0.258 1.00 0.00 H new ATOM 0 HD1 TYR A 274 8.309 4.813 2.856 1.00 0.00 H new ATOM 0 HD2 TYR A 274 11.653 3.152 0.810 1.00 0.00 H new ATOM 0 HE1 TYR A 274 9.741 5.333 4.779 1.00 0.00 H new ATOM 0 HE2 TYR A 274 13.085 3.662 2.737 1.00 0.00 H new ATOM 0 HH TYR A 274 13.220 4.522 4.761 1.00 0.00 H new ATOM 729 N LEU A 275 5.732 2.846 0.189 1.00 0.00 N ATOM 730 CA LEU A 275 4.581 3.000 -0.682 1.00 0.00 C ATOM 731 C LEU A 275 4.469 4.458 -1.112 1.00 0.00 C ATOM 732 O LEU A 275 4.597 5.363 -0.286 1.00 0.00 O ATOM 733 CB LEU A 275 3.316 2.535 0.045 1.00 0.00 C ATOM 734 CG LEU A 275 2.010 2.666 -0.738 1.00 0.00 C ATOM 735 CD1 LEU A 275 2.135 2.032 -2.113 1.00 0.00 C ATOM 736 CD2 LEU A 275 0.873 2.014 0.030 1.00 0.00 C ATOM 0 H LEU A 275 5.544 3.050 1.171 1.00 0.00 H new ATOM 0 HA LEU A 275 4.701 2.385 -1.574 1.00 0.00 H new ATOM 0 HB2 LEU A 275 3.445 1.490 0.326 1.00 0.00 H new ATOM 0 HB3 LEU A 275 3.221 3.104 0.970 1.00 0.00 H new ATOM 0 HG LEU A 275 1.796 3.727 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 275 1.192 2.139 -2.650 1.00 0.00 H new ATOM 0 HD12 LEU A 275 2.929 2.528 -2.672 1.00 0.00 H new ATOM 0 HD13 LEU A 275 2.374 0.974 -2.005 1.00 0.00 H new ATOM 0 HD21 LEU A 275 -0.053 2.113 -0.537 1.00 0.00 H new ATOM 0 HD22 LEU A 275 1.095 0.958 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 275 0.760 2.503 0.998 1.00 0.00 H new ATOM 748 N HIS A 276 4.244 4.691 -2.401 1.00 0.00 N ATOM 749 CA HIS A 276 4.278 6.047 -2.938 1.00 0.00 C ATOM 750 C HIS A 276 2.947 6.414 -3.560 1.00 0.00 C ATOM 751 O HIS A 276 2.415 5.666 -4.373 1.00 0.00 O ATOM 752 CB HIS A 276 5.376 6.183 -3.994 1.00 0.00 C ATOM 753 CG HIS A 276 6.744 5.882 -3.482 1.00 0.00 C ATOM 754 ND1 HIS A 276 7.283 4.612 -3.485 1.00 0.00 N ATOM 755 CD2 HIS A 276 7.686 6.689 -2.945 1.00 0.00 C ATOM 756 CE1 HIS A 276 8.498 4.655 -2.971 1.00 0.00 C ATOM 757 NE2 HIS A 276 8.764 5.902 -2.637 1.00 0.00 N ATOM 0 H HIS A 276 4.038 3.966 -3.088 1.00 0.00 H new ATOM 0 HA HIS A 276 4.486 6.723 -2.109 1.00 0.00 H new ATOM 0 HB2 HIS A 276 5.153 5.513 -4.824 1.00 0.00 H new ATOM 0 HB3 HIS A 276 5.362 7.198 -4.391 1.00 0.00 H new ATOM 0 HD1 HIS A 276 6.817 3.773 -3.830 1.00 0.00 H new ATOM 0 HD2 HIS A 276 7.604 7.754 -2.788 1.00 0.00 H new ATOM 0 HE1 HIS A 276 9.161 3.812 -2.845 1.00 0.00 H new ATOM 766 N TYR A 277 2.415 7.563 -3.182 1.00 0.00 N ATOM 767 CA TYR A 277 1.175 8.046 -3.764 1.00 0.00 C ATOM 768 C TYR A 277 1.409 9.328 -4.549 1.00 0.00 C ATOM 769 O TYR A 277 1.929 10.315 -4.028 1.00 0.00 O ATOM 770 CB TYR A 277 0.090 8.243 -2.696 1.00 0.00 C ATOM 771 CG TYR A 277 0.609 8.673 -1.344 1.00 0.00 C ATOM 772 CD1 TYR A 277 1.148 7.742 -0.467 1.00 0.00 C ATOM 773 CD2 TYR A 277 0.551 9.999 -0.939 1.00 0.00 C ATOM 774 CE1 TYR A 277 1.617 8.115 0.770 1.00 0.00 C ATOM 775 CE2 TYR A 277 1.022 10.386 0.302 1.00 0.00 C ATOM 776 CZ TYR A 277 1.554 9.437 1.155 1.00 0.00 C ATOM 777 OH TYR A 277 2.023 9.808 2.396 1.00 0.00 O ATOM 0 H TYR A 277 2.821 8.178 -2.476 1.00 0.00 H new ATOM 0 HA TYR A 277 0.816 7.284 -4.456 1.00 0.00 H new ATOM 0 HB2 TYR A 277 -0.620 8.989 -3.052 1.00 0.00 H new ATOM 0 HB3 TYR A 277 -0.460 7.309 -2.579 1.00 0.00 H new ATOM 0 HD1 TYR A 277 1.200 6.704 -0.762 1.00 0.00 H new ATOM 0 HD2 TYR A 277 0.132 10.740 -1.603 1.00 0.00 H new ATOM 0 HE1 TYR A 277 2.033 7.375 1.438 1.00 0.00 H new ATOM 0 HE2 TYR A 277 0.975 11.422 0.603 1.00 0.00 H new ATOM 0 HH TYR A 277 1.908 10.774 2.514 1.00 0.00 H new ATOM 787 N TYR A 278 1.044 9.274 -5.813 1.00 0.00 N ATOM 788 CA TYR A 278 1.188 10.386 -6.739 1.00 0.00 C ATOM 789 C TYR A 278 -0.184 10.977 -7.009 1.00 0.00 C ATOM 790 O TYR A 278 -1.141 10.648 -6.318 1.00 0.00 O ATOM 791 CB TYR A 278 1.829 9.899 -8.039 1.00 0.00 C ATOM 792 CG TYR A 278 3.133 9.174 -7.818 1.00 0.00 C ATOM 793 CD1 TYR A 278 3.148 7.830 -7.482 1.00 0.00 C ATOM 794 CD2 TYR A 278 4.348 9.834 -7.932 1.00 0.00 C ATOM 795 CE1 TYR A 278 4.330 7.163 -7.260 1.00 0.00 C ATOM 796 CE2 TYR A 278 5.541 9.172 -7.714 1.00 0.00 C ATOM 797 CZ TYR A 278 5.527 7.836 -7.382 1.00 0.00 C ATOM 798 OH TYR A 278 6.713 7.174 -7.154 1.00 0.00 O ATOM 0 H TYR A 278 0.631 8.443 -6.236 1.00 0.00 H new ATOM 0 HA TYR A 278 1.832 11.152 -6.307 1.00 0.00 H new ATOM 0 HB2 TYR A 278 1.134 9.236 -8.554 1.00 0.00 H new ATOM 0 HB3 TYR A 278 2.001 10.753 -8.695 1.00 0.00 H new ATOM 0 HD1 TYR A 278 2.214 7.296 -7.393 1.00 0.00 H new ATOM 0 HD2 TYR A 278 4.361 10.881 -8.195 1.00 0.00 H new ATOM 0 HE1 TYR A 278 4.321 6.117 -6.991 1.00 0.00 H new ATOM 0 HE2 TYR A 278 6.479 9.700 -7.804 1.00 0.00 H new ATOM 0 HH TYR A 278 7.463 7.792 -7.283 1.00 0.00 H new ATOM 808 N ASP A 279 -0.293 11.828 -8.009 1.00 0.00 N ATOM 809 CA ASP A 279 -1.565 12.471 -8.289 1.00 0.00 C ATOM 810 C ASP A 279 -1.950 12.237 -9.738 1.00 0.00 C ATOM 811 O ASP A 279 -1.151 12.468 -10.647 1.00 0.00 O ATOM 812 CB ASP A 279 -1.515 13.969 -8.002 1.00 0.00 C ATOM 813 CG ASP A 279 -2.890 14.593 -8.002 1.00 0.00 C ATOM 814 OD1 ASP A 279 -3.614 14.461 -6.992 1.00 0.00 O ATOM 815 OD2 ASP A 279 -3.252 15.223 -9.008 1.00 0.00 O ATOM 0 H ASP A 279 0.470 12.089 -8.634 1.00 0.00 H new ATOM 0 HA ASP A 279 -2.315 12.031 -7.632 1.00 0.00 H new ATOM 0 HB2 ASP A 279 -1.041 14.137 -7.035 1.00 0.00 H new ATOM 0 HB3 ASP A 279 -0.894 14.461 -8.751 1.00 0.00 H new ATOM 820 N PRO A 280 -3.182 11.774 -9.969 1.00 0.00 N ATOM 821 CA PRO A 280 -3.682 11.455 -11.314 1.00 0.00 C ATOM 822 C PRO A 280 -3.948 12.710 -12.122 1.00 0.00 C ATOM 823 O PRO A 280 -4.025 12.682 -13.349 1.00 0.00 O ATOM 824 CB PRO A 280 -5.010 10.766 -11.013 1.00 0.00 C ATOM 825 CG PRO A 280 -5.462 11.458 -9.780 1.00 0.00 C ATOM 826 CD PRO A 280 -4.223 11.550 -8.942 1.00 0.00 C ATOM 0 HA PRO A 280 -2.976 10.861 -11.894 1.00 0.00 H new ATOM 0 HB2 PRO A 280 -5.723 10.885 -11.829 1.00 0.00 H new ATOM 0 HB3 PRO A 280 -4.884 9.695 -10.854 1.00 0.00 H new ATOM 0 HG2 PRO A 280 -5.868 12.445 -10.002 1.00 0.00 H new ATOM 0 HG3 PRO A 280 -6.247 10.897 -9.272 1.00 0.00 H new ATOM 0 HD2 PRO A 280 -4.274 12.369 -8.225 1.00 0.00 H new ATOM 0 HD3 PRO A 280 -4.046 10.638 -8.372 1.00 0.00 H new ATOM 834 N ALA A 281 -4.078 13.809 -11.404 1.00 0.00 N ATOM 835 CA ALA A 281 -4.542 15.049 -11.973 1.00 0.00 C ATOM 836 C ALA A 281 -3.388 16.012 -12.231 1.00 0.00 C ATOM 837 O ALA A 281 -3.465 16.854 -13.124 1.00 0.00 O ATOM 838 CB ALA A 281 -5.572 15.658 -11.039 1.00 0.00 C ATOM 0 H ALA A 281 -3.863 13.862 -10.408 1.00 0.00 H new ATOM 0 HA ALA A 281 -5.003 14.851 -12.941 1.00 0.00 H new ATOM 0 HB1 ALA A 281 -5.932 16.598 -11.458 1.00 0.00 H new ATOM 0 HB2 ALA A 281 -6.409 14.969 -10.921 1.00 0.00 H new ATOM 0 HB3 ALA A 281 -5.116 15.845 -10.067 1.00 0.00 H new ATOM 844 N GLY A 282 -2.325 15.896 -11.441 1.00 0.00 N ATOM 845 CA GLY A 282 -1.160 16.722 -11.672 1.00 0.00 C ATOM 846 C GLY A 282 -0.080 16.586 -10.614 1.00 0.00 C ATOM 847 O GLY A 282 0.083 17.471 -9.774 1.00 0.00 O ATOM 0 H GLY A 282 -2.252 15.251 -10.654 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -0.735 16.468 -12.643 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -1.473 17.765 -11.724 1.00 0.00 H new ATOM 851 N ALA A 283 0.657 15.480 -10.664 1.00 0.00 N ATOM 852 CA ALA A 283 1.849 15.286 -9.840 1.00 0.00 C ATOM 853 C ALA A 283 2.530 13.975 -10.194 1.00 0.00 C ATOM 854 O ALA A 283 2.063 12.896 -9.819 1.00 0.00 O ATOM 855 CB ALA A 283 1.542 15.319 -8.348 1.00 0.00 C ATOM 0 H ALA A 283 0.446 14.692 -11.277 1.00 0.00 H new ATOM 0 HA ALA A 283 2.518 16.120 -10.055 1.00 0.00 H new ATOM 0 HB1 ALA A 283 2.463 15.170 -7.784 1.00 0.00 H new ATOM 0 HB2 ALA A 283 1.109 16.285 -8.087 1.00 0.00 H new ATOM 0 HB3 ALA A 283 0.835 14.526 -8.104 1.00 0.00 H new ATOM 861 N GLU A 284 3.619 14.074 -10.941 1.00 0.00 N ATOM 862 CA GLU A 284 4.420 12.910 -11.293 1.00 0.00 C ATOM 863 C GLU A 284 5.405 12.628 -10.180 1.00 0.00 C ATOM 864 O GLU A 284 6.024 11.564 -10.119 1.00 0.00 O ATOM 865 CB GLU A 284 5.157 13.166 -12.599 1.00 0.00 C ATOM 866 CG GLU A 284 4.269 13.740 -13.650 1.00 0.00 C ATOM 867 CD GLU A 284 4.974 13.972 -14.964 1.00 0.00 C ATOM 868 OE1 GLU A 284 5.171 12.998 -15.724 1.00 0.00 O ATOM 869 OE2 GLU A 284 5.328 15.131 -15.252 1.00 0.00 O ATOM 0 H GLU A 284 3.971 14.954 -11.318 1.00 0.00 H new ATOM 0 HA GLU A 284 3.771 12.044 -11.425 1.00 0.00 H new ATOM 0 HB2 GLU A 284 5.987 13.848 -12.417 1.00 0.00 H new ATOM 0 HB3 GLU A 284 5.586 12.231 -12.960 1.00 0.00 H new ATOM 0 HG2 GLU A 284 3.426 13.068 -13.811 1.00 0.00 H new ATOM 0 HG3 GLU A 284 3.859 14.685 -13.293 1.00 0.00 H new ATOM 876 N ASP A 285 5.544 13.607 -9.309 1.00 0.00 N ATOM 877 CA ASP A 285 6.350 13.461 -8.109 1.00 0.00 C ATOM 878 C ASP A 285 5.446 13.075 -6.939 1.00 0.00 C ATOM 879 O ASP A 285 4.299 13.525 -6.855 1.00 0.00 O ATOM 880 CB ASP A 285 7.116 14.757 -7.810 1.00 0.00 C ATOM 881 CG ASP A 285 6.245 15.861 -7.249 1.00 0.00 C ATOM 882 OD1 ASP A 285 5.592 16.576 -8.041 1.00 0.00 O ATOM 883 OD2 ASP A 285 6.233 16.041 -6.014 1.00 0.00 O ATOM 0 H ASP A 285 5.105 14.522 -9.410 1.00 0.00 H new ATOM 0 HA ASP A 285 7.087 12.673 -8.262 1.00 0.00 H new ATOM 0 HB2 ASP A 285 7.916 14.541 -7.101 1.00 0.00 H new ATOM 0 HB3 ASP A 285 7.589 15.109 -8.727 1.00 0.00 H new ATOM 888 N PRO A 286 5.944 12.219 -6.035 1.00 0.00 N ATOM 889 CA PRO A 286 5.132 11.637 -4.962 1.00 0.00 C ATOM 890 C PRO A 286 4.708 12.651 -3.905 1.00 0.00 C ATOM 891 O PRO A 286 5.465 13.552 -3.542 1.00 0.00 O ATOM 892 CB PRO A 286 6.059 10.585 -4.347 1.00 0.00 C ATOM 893 CG PRO A 286 7.432 11.071 -4.647 1.00 0.00 C ATOM 894 CD PRO A 286 7.344 11.757 -5.982 1.00 0.00 C ATOM 0 HA PRO A 286 4.194 11.238 -5.348 1.00 0.00 H new ATOM 0 HB2 PRO A 286 5.897 10.494 -3.273 1.00 0.00 H new ATOM 0 HB3 PRO A 286 5.884 9.600 -4.781 1.00 0.00 H new ATOM 0 HG2 PRO A 286 7.780 11.759 -3.876 1.00 0.00 H new ATOM 0 HG3 PRO A 286 8.141 10.244 -4.679 1.00 0.00 H new ATOM 0 HD2 PRO A 286 8.045 12.589 -6.054 1.00 0.00 H new ATOM 0 HD3 PRO A 286 7.574 11.075 -6.801 1.00 0.00 H new ATOM 902 N LEU A 287 3.494 12.474 -3.405 1.00 0.00 N ATOM 903 CA LEU A 287 2.944 13.331 -2.365 1.00 0.00 C ATOM 904 C LEU A 287 3.480 12.910 -1.000 1.00 0.00 C ATOM 905 O LEU A 287 3.243 13.570 0.009 1.00 0.00 O ATOM 906 CB LEU A 287 1.416 13.240 -2.376 1.00 0.00 C ATOM 907 CG LEU A 287 0.755 13.542 -3.722 1.00 0.00 C ATOM 908 CD1 LEU A 287 -0.723 13.196 -3.676 1.00 0.00 C ATOM 909 CD2 LEU A 287 0.947 15.001 -4.087 1.00 0.00 C ATOM 0 H LEU A 287 2.863 11.733 -3.709 1.00 0.00 H new ATOM 0 HA LEU A 287 3.244 14.361 -2.558 1.00 0.00 H new ATOM 0 HB2 LEU A 287 1.126 12.237 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 287 1.021 13.932 -1.632 1.00 0.00 H new ATOM 0 HG LEU A 287 1.229 12.928 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -1.179 13.417 -4.641 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -0.842 12.136 -3.453 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -1.211 13.787 -2.901 1.00 0.00 H new ATOM 0 HD21 LEU A 287 0.472 15.201 -5.047 1.00 0.00 H new ATOM 0 HD22 LEU A 287 0.496 15.630 -3.320 1.00 0.00 H new ATOM 0 HD23 LEU A 287 2.012 15.222 -4.157 1.00 0.00 H new ATOM 921 N GLY A 288 4.196 11.793 -0.983 1.00 0.00 N ATOM 922 CA GLY A 288 4.768 11.285 0.243 1.00 0.00 C ATOM 923 C GLY A 288 5.072 9.808 0.140 1.00 0.00 C ATOM 924 O GLY A 288 4.838 9.194 -0.907 1.00 0.00 O ATOM 0 H GLY A 288 4.391 11.226 -1.808 1.00 0.00 H new ATOM 0 HA2 GLY A 288 5.683 11.831 0.473 1.00 0.00 H new ATOM 0 HA3 GLY A 288 4.077 11.459 1.068 1.00 0.00 H new ATOM 928 N ALA A 289 5.590 9.234 1.215 1.00 0.00 N ATOM 929 CA ALA A 289 5.925 7.821 1.240 1.00 0.00 C ATOM 930 C ALA A 289 5.501 7.193 2.561 1.00 0.00 C ATOM 931 O ALA A 289 5.812 7.718 3.630 1.00 0.00 O ATOM 932 CB ALA A 289 7.420 7.627 1.013 1.00 0.00 C ATOM 0 H ALA A 289 5.788 9.729 2.085 1.00 0.00 H new ATOM 0 HA ALA A 289 5.384 7.324 0.435 1.00 0.00 H new ATOM 0 HB1 ALA A 289 7.656 6.563 1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 289 7.698 8.041 0.044 1.00 0.00 H new ATOM 0 HB3 ALA A 289 7.977 8.138 1.799 1.00 0.00 H new ATOM 938 N ILE A 290 4.775 6.090 2.476 1.00 0.00 N ATOM 939 CA ILE A 290 4.362 5.348 3.659 1.00 0.00 C ATOM 940 C ILE A 290 5.521 4.497 4.162 1.00 0.00 C ATOM 941 O ILE A 290 6.205 3.839 3.372 1.00 0.00 O ATOM 942 CB ILE A 290 3.130 4.456 3.363 1.00 0.00 C ATOM 943 CG1 ILE A 290 1.931 5.332 2.990 1.00 0.00 C ATOM 944 CG2 ILE A 290 2.793 3.564 4.552 1.00 0.00 C ATOM 945 CD1 ILE A 290 0.648 4.562 2.767 1.00 0.00 C ATOM 0 H ILE A 290 4.457 5.686 1.595 1.00 0.00 H new ATOM 0 HA ILE A 290 4.076 6.064 4.430 1.00 0.00 H new ATOM 0 HB ILE A 290 3.372 3.806 2.522 1.00 0.00 H new ATOM 0 HG12 ILE A 290 1.770 6.064 3.781 1.00 0.00 H new ATOM 0 HG13 ILE A 290 2.170 5.889 2.084 1.00 0.00 H new ATOM 0 HG21 ILE A 290 1.924 2.951 4.312 1.00 0.00 H new ATOM 0 HG22 ILE A 290 3.642 2.918 4.775 1.00 0.00 H new ATOM 0 HG23 ILE A 290 2.571 4.184 5.421 1.00 0.00 H new ATOM 0 HD11 ILE A 290 -0.152 5.255 2.507 1.00 0.00 H new ATOM 0 HD12 ILE A 290 0.788 3.849 1.955 1.00 0.00 H new ATOM 0 HD13 ILE A 290 0.382 4.026 3.678 1.00 0.00 H new ATOM 957 N HIS A 291 5.731 4.499 5.472 1.00 0.00 N ATOM 958 CA HIS A 291 6.866 3.803 6.059 1.00 0.00 C ATOM 959 C HIS A 291 6.504 2.351 6.317 1.00 0.00 C ATOM 960 O HIS A 291 6.175 1.973 7.441 1.00 0.00 O ATOM 961 CB HIS A 291 7.305 4.467 7.369 1.00 0.00 C ATOM 962 CG HIS A 291 8.589 3.916 7.916 1.00 0.00 C ATOM 963 ND1 HIS A 291 8.739 3.496 9.219 1.00 0.00 N ATOM 964 CD2 HIS A 291 9.788 3.720 7.322 1.00 0.00 C ATOM 965 CE1 HIS A 291 9.974 3.064 9.399 1.00 0.00 C ATOM 966 NE2 HIS A 291 10.635 3.191 8.264 1.00 0.00 N ATOM 0 H HIS A 291 5.131 4.974 6.146 1.00 0.00 H new ATOM 0 HA HIS A 291 7.696 3.854 5.355 1.00 0.00 H new ATOM 0 HB2 HIS A 291 7.419 5.538 7.204 1.00 0.00 H new ATOM 0 HB3 HIS A 291 6.518 4.341 8.113 1.00 0.00 H new ATOM 0 HD1 HIS A 291 8.011 3.516 9.933 1.00 0.00 H new ATOM 0 HD2 HIS A 291 10.034 3.940 6.294 1.00 0.00 H new ATOM 0 HE1 HIS A 291 10.376 2.672 10.322 1.00 0.00 H new ATOM 975 N LEU A 292 6.565 1.541 5.270 1.00 0.00 N ATOM 976 CA LEU A 292 6.223 0.134 5.384 1.00 0.00 C ATOM 977 C LEU A 292 7.149 -0.566 6.363 1.00 0.00 C ATOM 978 O LEU A 292 6.690 -1.049 7.386 1.00 0.00 O ATOM 979 CB LEU A 292 6.299 -0.563 4.028 1.00 0.00 C ATOM 980 CG LEU A 292 5.377 -0.011 2.944 1.00 0.00 C ATOM 981 CD1 LEU A 292 5.482 -0.873 1.701 1.00 0.00 C ATOM 982 CD2 LEU A 292 3.940 0.050 3.436 1.00 0.00 C ATOM 0 H LEU A 292 6.848 1.835 4.335 1.00 0.00 H new ATOM 0 HA LEU A 292 5.199 0.075 5.753 1.00 0.00 H new ATOM 0 HB2 LEU A 292 7.326 -0.506 3.668 1.00 0.00 H new ATOM 0 HB3 LEU A 292 6.070 -1.619 4.170 1.00 0.00 H new ATOM 0 HG LEU A 292 5.688 1.005 2.700 1.00 0.00 H new ATOM 0 HD11 LEU A 292 4.823 -0.478 0.928 1.00 0.00 H new ATOM 0 HD12 LEU A 292 6.510 -0.867 1.340 1.00 0.00 H new ATOM 0 HD13 LEU A 292 5.188 -1.895 1.941 1.00 0.00 H new ATOM 0 HD21 LEU A 292 3.302 0.447 2.646 1.00 0.00 H new ATOM 0 HD22 LEU A 292 3.605 -0.952 3.705 1.00 0.00 H new ATOM 0 HD23 LEU A 292 3.882 0.699 4.310 1.00 0.00 H new ATOM 994 N ARG A 293 8.451 -0.525 6.051 1.00 0.00 N ATOM 995 CA ARG A 293 9.518 -1.269 6.756 1.00 0.00 C ATOM 996 C ARG A 293 9.115 -1.747 8.159 1.00 0.00 C ATOM 997 O ARG A 293 9.380 -1.071 9.152 1.00 0.00 O ATOM 998 CB ARG A 293 10.751 -0.366 6.857 1.00 0.00 C ATOM 999 CG ARG A 293 12.036 -1.092 7.221 1.00 0.00 C ATOM 1000 CD ARG A 293 13.177 -0.114 7.469 1.00 0.00 C ATOM 1001 NE ARG A 293 13.381 0.810 6.345 1.00 0.00 N ATOM 1002 CZ ARG A 293 14.572 1.302 5.982 1.00 0.00 C ATOM 1003 NH1 ARG A 293 15.690 0.850 6.546 1.00 0.00 N ATOM 1004 NH2 ARG A 293 14.643 2.227 5.028 1.00 0.00 N ATOM 0 H ARG A 293 8.807 0.041 5.281 1.00 0.00 H new ATOM 0 HA ARG A 293 9.724 -2.169 6.177 1.00 0.00 H new ATOM 0 HB2 ARG A 293 10.893 0.142 5.903 1.00 0.00 H new ATOM 0 HB3 ARG A 293 10.561 0.405 7.603 1.00 0.00 H new ATOM 0 HG2 ARG A 293 11.873 -1.697 8.113 1.00 0.00 H new ATOM 0 HG3 ARG A 293 12.309 -1.776 6.417 1.00 0.00 H new ATOM 0 HD2 ARG A 293 12.970 0.459 8.373 1.00 0.00 H new ATOM 0 HD3 ARG A 293 14.096 -0.671 7.648 1.00 0.00 H new ATOM 0 HE ARG A 293 12.563 1.095 5.807 1.00 0.00 H new ATOM 0 HH11 ARG A 293 15.643 0.123 7.260 1.00 0.00 H new ATOM 0 HH12 ARG A 293 16.593 1.230 6.264 1.00 0.00 H new ATOM 0 HH21 ARG A 293 13.791 2.559 4.575 1.00 0.00 H new ATOM 0 HH22 ARG A 293 15.549 2.604 4.749 1.00 0.00 H new ATOM 1018 N GLY A 294 8.484 -2.920 8.227 1.00 0.00 N ATOM 1019 CA GLY A 294 8.034 -3.458 9.501 1.00 0.00 C ATOM 1020 C GLY A 294 6.520 -3.440 9.636 1.00 0.00 C ATOM 1021 O GLY A 294 5.985 -3.472 10.747 1.00 0.00 O ATOM 0 H GLY A 294 8.277 -3.508 7.420 1.00 0.00 H new ATOM 0 HA2 GLY A 294 8.393 -4.482 9.607 1.00 0.00 H new ATOM 0 HA3 GLY A 294 8.475 -2.880 10.313 1.00 0.00 H new ATOM 1025 N CYS A 295 5.828 -3.366 8.505 1.00 0.00 N ATOM 1026 CA CYS A 295 4.375 -3.253 8.498 1.00 0.00 C ATOM 1027 C CYS A 295 3.692 -4.610 8.394 1.00 0.00 C ATOM 1028 O CYS A 295 4.187 -5.529 7.737 1.00 0.00 O ATOM 1029 CB CYS A 295 3.925 -2.375 7.327 1.00 0.00 C ATOM 1030 SG CYS A 295 4.325 -3.055 5.701 1.00 0.00 S ATOM 0 H CYS A 295 6.252 -3.382 7.578 1.00 0.00 H new ATOM 0 HA CYS A 295 4.084 -2.801 9.446 1.00 0.00 H new ATOM 0 HB2 CYS A 295 2.847 -2.226 7.392 1.00 0.00 H new ATOM 0 HB3 CYS A 295 4.389 -1.393 7.423 1.00 0.00 H new ATOM 0 HG CYS A 295 4.450 -4.346 5.789 1.00 0.00 H new ATOM 1036 N VAL A 296 2.551 -4.724 9.050 1.00 0.00 N ATOM 1037 CA VAL A 296 1.681 -5.871 8.881 1.00 0.00 C ATOM 1038 C VAL A 296 0.425 -5.411 8.165 1.00 0.00 C ATOM 1039 O VAL A 296 -0.015 -4.283 8.353 1.00 0.00 O ATOM 1040 CB VAL A 296 1.272 -6.504 10.227 1.00 0.00 C ATOM 1041 CG1 VAL A 296 0.679 -7.890 10.023 1.00 0.00 C ATOM 1042 CG2 VAL A 296 2.445 -6.555 11.194 1.00 0.00 C ATOM 0 H VAL A 296 2.204 -4.028 9.710 1.00 0.00 H new ATOM 0 HA VAL A 296 2.224 -6.625 8.311 1.00 0.00 H new ATOM 0 HB VAL A 296 0.504 -5.869 10.668 1.00 0.00 H new ATOM 0 HG11 VAL A 296 0.400 -8.312 10.988 1.00 0.00 H new ATOM 0 HG12 VAL A 296 -0.205 -7.818 9.389 1.00 0.00 H new ATOM 0 HG13 VAL A 296 1.417 -8.535 9.545 1.00 0.00 H new ATOM 0 HG21 VAL A 296 2.123 -7.006 12.133 1.00 0.00 H new ATOM 0 HG22 VAL A 296 3.248 -7.151 10.761 1.00 0.00 H new ATOM 0 HG23 VAL A 296 2.805 -5.544 11.382 1.00 0.00 H new ATOM 1052 N VAL A 297 -0.147 -6.261 7.345 1.00 0.00 N ATOM 1053 CA VAL A 297 -1.343 -5.897 6.600 1.00 0.00 C ATOM 1054 C VAL A 297 -2.468 -6.876 6.930 1.00 0.00 C ATOM 1055 O VAL A 297 -2.211 -8.001 7.357 1.00 0.00 O ATOM 1056 CB VAL A 297 -1.072 -5.851 5.067 1.00 0.00 C ATOM 1057 CG1 VAL A 297 -2.310 -5.441 4.283 1.00 0.00 C ATOM 1058 CG2 VAL A 297 0.058 -4.884 4.751 1.00 0.00 C ATOM 0 H VAL A 297 0.190 -7.208 7.173 1.00 0.00 H new ATOM 0 HA VAL A 297 -1.645 -4.893 6.899 1.00 0.00 H new ATOM 0 HB VAL A 297 -0.790 -6.860 4.766 1.00 0.00 H new ATOM 0 HG11 VAL A 297 -2.077 -5.422 3.218 1.00 0.00 H new ATOM 0 HG12 VAL A 297 -3.111 -6.158 4.466 1.00 0.00 H new ATOM 0 HG13 VAL A 297 -2.631 -4.449 4.602 1.00 0.00 H new ATOM 0 HG21 VAL A 297 0.232 -4.866 3.675 1.00 0.00 H new ATOM 0 HG22 VAL A 297 -0.213 -3.884 5.091 1.00 0.00 H new ATOM 0 HG23 VAL A 297 0.966 -5.207 5.260 1.00 0.00 H new ATOM 1068 N THR A 298 -3.699 -6.439 6.733 1.00 0.00 N ATOM 1069 CA THR A 298 -4.860 -7.241 7.075 1.00 0.00 C ATOM 1070 C THR A 298 -5.990 -6.998 6.077 1.00 0.00 C ATOM 1071 O THR A 298 -6.270 -5.857 5.695 1.00 0.00 O ATOM 1072 CB THR A 298 -5.337 -6.966 8.524 1.00 0.00 C ATOM 1073 OG1 THR A 298 -6.410 -7.851 8.878 1.00 0.00 O ATOM 1074 CG2 THR A 298 -5.785 -5.523 8.701 1.00 0.00 C ATOM 0 H THR A 298 -3.921 -5.526 6.335 1.00 0.00 H new ATOM 0 HA THR A 298 -4.567 -8.290 7.021 1.00 0.00 H new ATOM 0 HB THR A 298 -4.489 -7.145 9.185 1.00 0.00 H new ATOM 0 HG1 THR A 298 -6.698 -7.665 9.796 1.00 0.00 H new ATOM 0 HG21 THR A 298 -6.113 -5.367 9.729 1.00 0.00 H new ATOM 0 HG22 THR A 298 -4.953 -4.854 8.480 1.00 0.00 H new ATOM 0 HG23 THR A 298 -6.611 -5.312 8.021 1.00 0.00 H new ATOM 1082 N SER A 299 -6.605 -8.079 5.621 1.00 0.00 N ATOM 1083 CA SER A 299 -7.706 -7.991 4.680 1.00 0.00 C ATOM 1084 C SER A 299 -9.011 -7.713 5.416 1.00 0.00 C ATOM 1085 O SER A 299 -9.632 -8.621 5.972 1.00 0.00 O ATOM 1086 CB SER A 299 -7.806 -9.285 3.866 1.00 0.00 C ATOM 1087 OG SER A 299 -7.767 -10.426 4.708 1.00 0.00 O ATOM 0 H SER A 299 -6.357 -9.031 5.890 1.00 0.00 H new ATOM 0 HA SER A 299 -7.520 -7.165 3.994 1.00 0.00 H new ATOM 0 HB2 SER A 299 -8.732 -9.285 3.291 1.00 0.00 H new ATOM 0 HB3 SER A 299 -6.986 -9.331 3.149 1.00 0.00 H new ATOM 0 HG SER A 299 -8.368 -10.291 5.470 1.00 0.00 H new ATOM 1093 N VAL A 300 -9.418 -6.454 5.422 1.00 0.00 N ATOM 1094 CA VAL A 300 -10.627 -6.048 6.114 1.00 0.00 C ATOM 1095 C VAL A 300 -11.843 -6.282 5.236 1.00 0.00 C ATOM 1096 O VAL A 300 -11.944 -5.724 4.141 1.00 0.00 O ATOM 1097 CB VAL A 300 -10.589 -4.552 6.509 1.00 0.00 C ATOM 1098 CG1 VAL A 300 -11.806 -4.181 7.346 1.00 0.00 C ATOM 1099 CG2 VAL A 300 -9.303 -4.216 7.250 1.00 0.00 C ATOM 0 H VAL A 300 -8.925 -5.694 4.953 1.00 0.00 H new ATOM 0 HA VAL A 300 -10.691 -6.651 7.020 1.00 0.00 H new ATOM 0 HB VAL A 300 -10.614 -3.963 5.592 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -11.757 -3.125 7.611 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -12.713 -4.369 6.772 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -11.820 -4.783 8.254 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -9.302 -3.159 7.516 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -9.237 -4.818 8.156 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -8.447 -4.430 6.609 1.00 0.00 H new ATOM 1253 N GLU A 311 -16.506 1.627 2.714 1.00 0.00 N ATOM 1254 CA GLU A 311 -15.227 0.966 2.646 1.00 0.00 C ATOM 1255 C GLU A 311 -15.365 -0.490 2.209 1.00 0.00 C ATOM 1256 O GLU A 311 -15.724 -1.356 3.006 1.00 0.00 O ATOM 1257 CB GLU A 311 -14.570 1.035 4.028 1.00 0.00 C ATOM 1258 CG GLU A 311 -14.300 2.453 4.530 1.00 0.00 C ATOM 1259 CD GLU A 311 -15.547 3.277 4.815 1.00 0.00 C ATOM 1260 OE1 GLU A 311 -16.576 2.699 5.242 1.00 0.00 O ATOM 1261 OE2 GLU A 311 -15.508 4.506 4.598 1.00 0.00 O ATOM 0 HA GLU A 311 -14.611 1.471 1.902 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -15.211 0.524 4.747 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -13.627 0.489 3.996 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -13.705 2.394 5.441 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -13.697 2.977 3.789 1.00 0.00 H new ATOM 1268 N GLU A 312 -15.082 -0.752 0.942 1.00 0.00 N ATOM 1269 CA GLU A 312 -15.075 -2.111 0.423 1.00 0.00 C ATOM 1270 C GLU A 312 -13.680 -2.495 -0.031 1.00 0.00 C ATOM 1271 O GLU A 312 -12.867 -1.619 -0.318 1.00 0.00 O ATOM 1272 CB GLU A 312 -16.053 -2.271 -0.734 1.00 0.00 C ATOM 1273 CG GLU A 312 -17.506 -2.323 -0.307 1.00 0.00 C ATOM 1274 CD GLU A 312 -18.380 -2.951 -1.366 1.00 0.00 C ATOM 1275 OE1 GLU A 312 -18.308 -4.188 -1.538 1.00 0.00 O ATOM 1276 OE2 GLU A 312 -19.122 -2.217 -2.044 1.00 0.00 O ATOM 0 H GLU A 312 -14.853 -0.037 0.251 1.00 0.00 H new ATOM 0 HA GLU A 312 -15.389 -2.773 1.230 1.00 0.00 H new ATOM 0 HB2 GLU A 312 -15.918 -1.442 -1.428 1.00 0.00 H new ATOM 0 HB3 GLU A 312 -15.811 -3.184 -1.278 1.00 0.00 H new ATOM 0 HG2 GLU A 312 -17.592 -2.891 0.619 1.00 0.00 H new ATOM 0 HG3 GLU A 312 -17.859 -1.314 -0.096 1.00 0.00 H new ATOM 1283 N ASN A 313 -13.434 -3.809 -0.112 1.00 0.00 N ATOM 1284 CA ASN A 313 -12.111 -4.369 -0.433 1.00 0.00 C ATOM 1285 C ASN A 313 -10.994 -3.612 0.284 1.00 0.00 C ATOM 1286 O ASN A 313 -9.960 -3.285 -0.295 1.00 0.00 O ATOM 1287 CB ASN A 313 -11.853 -4.447 -1.952 1.00 0.00 C ATOM 1288 CG ASN A 313 -12.013 -3.136 -2.697 1.00 0.00 C ATOM 1289 OD1 ASN A 313 -11.102 -2.324 -2.742 1.00 0.00 O ATOM 1290 ND2 ASN A 313 -13.162 -2.942 -3.326 1.00 0.00 N ATOM 0 H ASN A 313 -14.150 -4.519 0.044 1.00 0.00 H new ATOM 0 HA ASN A 313 -12.110 -5.394 -0.064 1.00 0.00 H new ATOM 0 HB2 ASN A 313 -10.842 -4.819 -2.115 1.00 0.00 H new ATOM 0 HB3 ASN A 313 -12.535 -5.179 -2.384 1.00 0.00 H new ATOM 0 HD21 ASN A 313 -13.308 -2.092 -3.871 1.00 0.00 H new ATOM 0 HD22 ASN A 313 -13.901 -3.643 -3.266 1.00 0.00 H new ATOM 1297 N LEU A 314 -11.216 -3.364 1.562 1.00 0.00 N ATOM 1298 CA LEU A 314 -10.276 -2.638 2.388 1.00 0.00 C ATOM 1299 C LEU A 314 -9.114 -3.542 2.795 1.00 0.00 C ATOM 1300 O LEU A 314 -9.312 -4.704 3.157 1.00 0.00 O ATOM 1301 CB LEU A 314 -11.014 -2.132 3.632 1.00 0.00 C ATOM 1302 CG LEU A 314 -10.593 -0.764 4.164 1.00 0.00 C ATOM 1303 CD1 LEU A 314 -11.483 -0.361 5.331 1.00 0.00 C ATOM 1304 CD2 LEU A 314 -9.135 -0.763 4.592 1.00 0.00 C ATOM 0 H LEU A 314 -12.057 -3.663 2.055 1.00 0.00 H new ATOM 0 HA LEU A 314 -9.867 -1.796 1.829 1.00 0.00 H new ATOM 0 HB2 LEU A 314 -12.080 -2.097 3.406 1.00 0.00 H new ATOM 0 HB3 LEU A 314 -10.881 -2.864 4.429 1.00 0.00 H new ATOM 0 HG LEU A 314 -10.707 -0.039 3.358 1.00 0.00 H new ATOM 0 HD11 LEU A 314 -11.175 0.616 5.703 1.00 0.00 H new ATOM 0 HD12 LEU A 314 -12.520 -0.312 4.998 1.00 0.00 H new ATOM 0 HD13 LEU A 314 -11.393 -1.098 6.129 1.00 0.00 H new ATOM 0 HD21 LEU A 314 -8.866 0.225 4.966 1.00 0.00 H new ATOM 0 HD22 LEU A 314 -8.986 -1.502 5.380 1.00 0.00 H new ATOM 0 HD23 LEU A 314 -8.505 -1.012 3.738 1.00 0.00 H new ATOM 1316 N PHE A 315 -7.904 -3.019 2.699 1.00 0.00 N ATOM 1317 CA PHE A 315 -6.750 -3.672 3.288 1.00 0.00 C ATOM 1318 C PHE A 315 -5.989 -2.661 4.127 1.00 0.00 C ATOM 1319 O PHE A 315 -5.596 -1.598 3.645 1.00 0.00 O ATOM 1320 CB PHE A 315 -5.847 -4.337 2.230 1.00 0.00 C ATOM 1321 CG PHE A 315 -5.140 -3.396 1.295 1.00 0.00 C ATOM 1322 CD1 PHE A 315 -5.814 -2.814 0.234 1.00 0.00 C ATOM 1323 CD2 PHE A 315 -3.791 -3.110 1.468 1.00 0.00 C ATOM 1324 CE1 PHE A 315 -5.163 -1.963 -0.635 1.00 0.00 C ATOM 1325 CE2 PHE A 315 -3.136 -2.257 0.602 1.00 0.00 C ATOM 1326 CZ PHE A 315 -3.823 -1.683 -0.451 1.00 0.00 C ATOM 0 H PHE A 315 -7.696 -2.144 2.218 1.00 0.00 H new ATOM 0 HA PHE A 315 -7.096 -4.484 3.928 1.00 0.00 H new ATOM 0 HB2 PHE A 315 -5.099 -4.940 2.744 1.00 0.00 H new ATOM 0 HB3 PHE A 315 -6.455 -5.021 1.638 1.00 0.00 H new ATOM 0 HD1 PHE A 315 -6.862 -3.029 0.085 1.00 0.00 H new ATOM 0 HD2 PHE A 315 -3.250 -3.559 2.288 1.00 0.00 H new ATOM 0 HE1 PHE A 315 -5.701 -1.516 -1.458 1.00 0.00 H new ATOM 0 HE2 PHE A 315 -2.088 -2.039 0.747 1.00 0.00 H new ATOM 0 HZ PHE A 315 -3.312 -1.016 -1.130 1.00 0.00 H new ATOM 1336 N GLU A 316 -5.836 -2.976 5.396 1.00 0.00 N ATOM 1337 CA GLU A 316 -5.214 -2.063 6.333 1.00 0.00 C ATOM 1338 C GLU A 316 -3.716 -2.329 6.425 1.00 0.00 C ATOM 1339 O GLU A 316 -3.284 -3.482 6.458 1.00 0.00 O ATOM 1340 CB GLU A 316 -5.877 -2.200 7.707 1.00 0.00 C ATOM 1341 CG GLU A 316 -5.218 -1.379 8.800 1.00 0.00 C ATOM 1342 CD GLU A 316 -5.821 -1.637 10.166 1.00 0.00 C ATOM 1343 OE1 GLU A 316 -5.398 -2.592 10.842 1.00 0.00 O ATOM 1344 OE2 GLU A 316 -6.698 -0.867 10.592 1.00 0.00 O ATOM 0 H GLU A 316 -6.135 -3.862 5.804 1.00 0.00 H new ATOM 0 HA GLU A 316 -5.352 -1.042 5.978 1.00 0.00 H new ATOM 0 HB2 GLU A 316 -6.922 -1.903 7.625 1.00 0.00 H new ATOM 0 HB3 GLU A 316 -5.866 -3.250 8.000 1.00 0.00 H new ATOM 0 HG2 GLU A 316 -4.152 -1.607 8.828 1.00 0.00 H new ATOM 0 HG3 GLU A 316 -5.311 -0.320 8.560 1.00 0.00 H new ATOM 1351 N ILE A 317 -2.932 -1.263 6.475 1.00 0.00 N ATOM 1352 CA ILE A 317 -1.491 -1.379 6.594 1.00 0.00 C ATOM 1353 C ILE A 317 -1.052 -0.868 7.959 1.00 0.00 C ATOM 1354 O ILE A 317 -1.141 0.322 8.242 1.00 0.00 O ATOM 1355 CB ILE A 317 -0.750 -0.587 5.496 1.00 0.00 C ATOM 1356 CG1 ILE A 317 -1.067 -1.154 4.114 1.00 0.00 C ATOM 1357 CG2 ILE A 317 0.752 -0.616 5.744 1.00 0.00 C ATOM 1358 CD1 ILE A 317 -0.496 -0.323 2.988 1.00 0.00 C ATOM 0 H ILE A 317 -3.275 -0.303 6.435 1.00 0.00 H new ATOM 0 HA ILE A 317 -1.236 -2.432 6.477 1.00 0.00 H new ATOM 0 HB ILE A 317 -1.092 0.447 5.531 1.00 0.00 H new ATOM 0 HG12 ILE A 317 -0.674 -2.168 4.045 1.00 0.00 H new ATOM 0 HG13 ILE A 317 -2.148 -1.223 3.995 1.00 0.00 H new ATOM 0 HG21 ILE A 317 1.261 -0.053 4.961 1.00 0.00 H new ATOM 0 HG22 ILE A 317 0.969 -0.167 6.713 1.00 0.00 H new ATOM 0 HG23 ILE A 317 1.102 -1.648 5.735 1.00 0.00 H new ATOM 0 HD11 ILE A 317 -0.756 -0.778 2.032 1.00 0.00 H new ATOM 0 HD12 ILE A 317 -0.909 0.685 3.034 1.00 0.00 H new ATOM 0 HD13 ILE A 317 0.589 -0.276 3.085 1.00 0.00 H new ATOM 1370 N ILE A 318 -0.611 -1.775 8.803 1.00 0.00 N ATOM 1371 CA ILE A 318 -0.153 -1.429 10.133 1.00 0.00 C ATOM 1372 C ILE A 318 1.360 -1.289 10.120 1.00 0.00 C ATOM 1373 O ILE A 318 2.085 -2.248 10.391 1.00 0.00 O ATOM 1374 CB ILE A 318 -0.573 -2.504 11.154 1.00 0.00 C ATOM 1375 CG1 ILE A 318 -2.036 -2.888 10.927 1.00 0.00 C ATOM 1376 CG2 ILE A 318 -0.366 -1.995 12.576 1.00 0.00 C ATOM 1377 CD1 ILE A 318 -2.475 -4.111 11.702 1.00 0.00 C ATOM 0 H ILE A 318 -0.559 -2.771 8.589 1.00 0.00 H new ATOM 0 HA ILE A 318 -0.609 -0.484 10.429 1.00 0.00 H new ATOM 0 HB ILE A 318 0.048 -3.389 11.016 1.00 0.00 H new ATOM 0 HG12 ILE A 318 -2.670 -2.046 11.206 1.00 0.00 H new ATOM 0 HG13 ILE A 318 -2.194 -3.068 9.864 1.00 0.00 H new ATOM 0 HG21 ILE A 318 -0.667 -2.766 13.286 1.00 0.00 H new ATOM 0 HG22 ILE A 318 0.686 -1.754 12.727 1.00 0.00 H new ATOM 0 HG23 ILE A 318 -0.969 -1.101 12.734 1.00 0.00 H new ATOM 0 HD11 ILE A 318 -3.523 -4.320 11.489 1.00 0.00 H new ATOM 0 HD12 ILE A 318 -1.867 -4.966 11.407 1.00 0.00 H new ATOM 0 HD13 ILE A 318 -2.351 -3.929 12.770 1.00 0.00 H new ATOM 1389 N THR A 319 1.823 -0.100 9.757 1.00 0.00 N ATOM 1390 CA THR A 319 3.248 0.166 9.596 1.00 0.00 C ATOM 1391 C THR A 319 4.040 -0.038 10.887 1.00 0.00 C ATOM 1392 O THR A 319 3.466 -0.302 11.947 1.00 0.00 O ATOM 1393 CB THR A 319 3.480 1.595 9.081 1.00 0.00 C ATOM 1394 OG1 THR A 319 2.818 2.542 9.930 1.00 0.00 O ATOM 1395 CG2 THR A 319 2.966 1.738 7.661 1.00 0.00 C ATOM 0 H THR A 319 1.225 0.704 9.566 1.00 0.00 H new ATOM 0 HA THR A 319 3.611 -0.557 8.866 1.00 0.00 H new ATOM 0 HB THR A 319 4.552 1.792 9.091 1.00 0.00 H new ATOM 0 HG1 THR A 319 2.974 3.449 9.593 1.00 0.00 H new ATOM 0 HG21 THR A 319 3.139 2.756 7.312 1.00 0.00 H new ATOM 0 HG22 THR A 319 3.492 1.038 7.012 1.00 0.00 H new ATOM 0 HG23 THR A 319 1.898 1.522 7.637 1.00 0.00 H new ATOM 1403 N ALA A 320 5.361 0.102 10.803 1.00 0.00 N ATOM 1404 CA ALA A 320 6.216 -0.070 11.973 1.00 0.00 C ATOM 1405 C ALA A 320 5.968 1.046 12.978 1.00 0.00 C ATOM 1406 O ALA A 320 6.247 0.909 14.170 1.00 0.00 O ATOM 1407 CB ALA A 320 7.678 -0.113 11.564 1.00 0.00 C ATOM 0 H ALA A 320 5.859 0.332 9.943 1.00 0.00 H new ATOM 0 HA ALA A 320 5.969 -1.020 12.447 1.00 0.00 H new ATOM 0 HB1 ALA A 320 8.300 -0.242 12.450 1.00 0.00 H new ATOM 0 HB2 ALA A 320 7.841 -0.948 10.882 1.00 0.00 H new ATOM 0 HB3 ALA A 320 7.944 0.819 11.066 1.00 0.00 H new ATOM 1413 N ASP A 321 5.407 2.136 12.483 1.00 0.00 N ATOM 1414 CA ASP A 321 5.071 3.288 13.307 1.00 0.00 C ATOM 1415 C ASP A 321 3.737 3.057 14.018 1.00 0.00 C ATOM 1416 O ASP A 321 3.235 3.931 14.721 1.00 0.00 O ATOM 1417 CB ASP A 321 4.983 4.548 12.436 1.00 0.00 C ATOM 1418 CG ASP A 321 6.282 4.878 11.712 1.00 0.00 C ATOM 1419 OD1 ASP A 321 6.822 4.002 11.002 1.00 0.00 O ATOM 1420 OD2 ASP A 321 6.757 6.028 11.826 1.00 0.00 O ATOM 0 H ASP A 321 5.171 2.249 11.497 1.00 0.00 H new ATOM 0 HA ASP A 321 5.852 3.424 14.055 1.00 0.00 H new ATOM 0 HB2 ASP A 321 4.189 4.417 11.700 1.00 0.00 H new ATOM 0 HB3 ASP A 321 4.700 5.394 13.062 1.00 0.00 H new ATOM 1425 N GLU A 322 3.180 1.860 13.812 1.00 0.00 N ATOM 1426 CA GLU A 322 1.896 1.452 14.383 1.00 0.00 C ATOM 1427 C GLU A 322 0.773 2.391 13.986 1.00 0.00 C ATOM 1428 O GLU A 322 -0.117 2.701 14.779 1.00 0.00 O ATOM 1429 CB GLU A 322 1.967 1.303 15.902 1.00 0.00 C ATOM 1430 CG GLU A 322 2.685 0.040 16.343 1.00 0.00 C ATOM 1431 CD GLU A 322 2.357 -0.350 17.766 1.00 0.00 C ATOM 1432 OE1 GLU A 322 1.184 -0.692 18.037 1.00 0.00 O ATOM 1433 OE2 GLU A 322 3.268 -0.327 18.621 1.00 0.00 O ATOM 0 H GLU A 322 3.615 1.139 13.236 1.00 0.00 H new ATOM 0 HA GLU A 322 1.671 0.471 13.964 1.00 0.00 H new ATOM 0 HB2 GLU A 322 2.477 2.170 16.323 1.00 0.00 H new ATOM 0 HB3 GLU A 322 0.956 1.300 16.309 1.00 0.00 H new ATOM 0 HG2 GLU A 322 2.416 -0.778 15.675 1.00 0.00 H new ATOM 0 HG3 GLU A 322 3.761 0.187 16.250 1.00 0.00 H new ATOM 1440 N VAL A 323 0.819 2.840 12.749 1.00 0.00 N ATOM 1441 CA VAL A 323 -0.261 3.615 12.187 1.00 0.00 C ATOM 1442 C VAL A 323 -1.087 2.724 11.280 1.00 0.00 C ATOM 1443 O VAL A 323 -0.537 2.050 10.410 1.00 0.00 O ATOM 1444 CB VAL A 323 0.266 4.813 11.377 1.00 0.00 C ATOM 1445 CG1 VAL A 323 -0.879 5.731 10.976 1.00 0.00 C ATOM 1446 CG2 VAL A 323 1.324 5.565 12.168 1.00 0.00 C ATOM 0 H VAL A 323 1.599 2.679 12.112 1.00 0.00 H new ATOM 0 HA VAL A 323 -0.869 4.001 13.005 1.00 0.00 H new ATOM 0 HB VAL A 323 0.731 4.440 10.464 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.488 6.572 10.404 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -1.592 5.178 10.365 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -1.379 6.102 11.871 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.686 6.409 11.581 1.00 0.00 H new ATOM 0 HG22 VAL A 323 0.891 5.930 13.099 1.00 0.00 H new ATOM 0 HG23 VAL A 323 2.155 4.896 12.392 1.00 0.00 H new ATOM 1456 N HIS A 324 -2.393 2.692 11.489 1.00 0.00 N ATOM 1457 CA HIS A 324 -3.252 1.877 10.647 1.00 0.00 C ATOM 1458 C HIS A 324 -3.610 2.673 9.411 1.00 0.00 C ATOM 1459 O HIS A 324 -4.318 3.680 9.490 1.00 0.00 O ATOM 1460 CB HIS A 324 -4.527 1.415 11.384 1.00 0.00 C ATOM 1461 CG HIS A 324 -4.259 0.609 12.628 1.00 0.00 C ATOM 1462 ND1 HIS A 324 -4.705 -0.683 12.798 1.00 0.00 N ATOM 1463 CD2 HIS A 324 -3.588 0.920 13.765 1.00 0.00 C ATOM 1464 CE1 HIS A 324 -4.323 -1.131 13.976 1.00 0.00 C ATOM 1465 NE2 HIS A 324 -3.641 -0.182 14.586 1.00 0.00 N ATOM 0 H HIS A 324 -2.875 3.212 12.222 1.00 0.00 H new ATOM 0 HA HIS A 324 -2.710 0.972 10.371 1.00 0.00 H new ATOM 0 HB2 HIS A 324 -5.117 2.292 11.652 1.00 0.00 H new ATOM 0 HB3 HIS A 324 -5.133 0.819 10.701 1.00 0.00 H new ATOM 0 HD2 HIS A 324 -3.102 1.859 13.985 1.00 0.00 H new ATOM 0 HE1 HIS A 324 -4.533 -2.112 14.376 1.00 0.00 H new ATOM 0 HE2 HIS A 324 -3.222 -0.253 15.513 1.00 0.00 H new ATOM 1474 N TYR A 325 -3.113 2.230 8.273 1.00 0.00 N ATOM 1475 CA TYR A 325 -3.345 2.917 7.020 1.00 0.00 C ATOM 1476 C TYR A 325 -4.474 2.244 6.277 1.00 0.00 C ATOM 1477 O TYR A 325 -4.438 1.037 6.046 1.00 0.00 O ATOM 1478 CB TYR A 325 -2.083 2.914 6.164 1.00 0.00 C ATOM 1479 CG TYR A 325 -1.105 3.975 6.546 1.00 0.00 C ATOM 1480 CD1 TYR A 325 -1.214 5.257 6.045 1.00 0.00 C ATOM 1481 CD2 TYR A 325 -0.070 3.690 7.413 1.00 0.00 C ATOM 1482 CE1 TYR A 325 -0.311 6.231 6.395 1.00 0.00 C ATOM 1483 CE2 TYR A 325 0.839 4.652 7.769 1.00 0.00 C ATOM 1484 CZ TYR A 325 0.717 5.927 7.261 1.00 0.00 C ATOM 1485 OH TYR A 325 1.633 6.894 7.610 1.00 0.00 O ATOM 0 H TYR A 325 -2.541 1.389 8.192 1.00 0.00 H new ATOM 0 HA TYR A 325 -3.614 3.952 7.231 1.00 0.00 H new ATOM 0 HB2 TYR A 325 -1.601 1.940 6.244 1.00 0.00 H new ATOM 0 HB3 TYR A 325 -2.362 3.046 5.119 1.00 0.00 H new ATOM 0 HD1 TYR A 325 -2.021 5.497 5.368 1.00 0.00 H new ATOM 0 HD2 TYR A 325 0.025 2.693 7.817 1.00 0.00 H new ATOM 0 HE1 TYR A 325 -0.406 7.229 5.994 1.00 0.00 H new ATOM 0 HE2 TYR A 325 1.647 4.412 8.444 1.00 0.00 H new ATOM 0 HH TYR A 325 2.291 6.513 8.229 1.00 0.00 H new ATOM 1495 N PHE A 326 -5.479 3.011 5.918 1.00 0.00 N ATOM 1496 CA PHE A 326 -6.631 2.455 5.250 1.00 0.00 C ATOM 1497 C PHE A 326 -6.562 2.696 3.761 1.00 0.00 C ATOM 1498 O PHE A 326 -6.505 3.839 3.301 1.00 0.00 O ATOM 1499 CB PHE A 326 -7.914 3.020 5.842 1.00 0.00 C ATOM 1500 CG PHE A 326 -8.229 2.414 7.170 1.00 0.00 C ATOM 1501 CD1 PHE A 326 -7.564 2.823 8.313 1.00 0.00 C ATOM 1502 CD2 PHE A 326 -9.172 1.409 7.266 1.00 0.00 C ATOM 1503 CE1 PHE A 326 -7.836 2.235 9.526 1.00 0.00 C ATOM 1504 CE2 PHE A 326 -9.452 0.822 8.475 1.00 0.00 C ATOM 1505 CZ PHE A 326 -8.784 1.235 9.605 1.00 0.00 C ATOM 0 H PHE A 326 -5.521 4.018 6.077 1.00 0.00 H new ATOM 0 HA PHE A 326 -6.632 1.377 5.408 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -7.819 4.101 5.949 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -8.741 2.839 5.155 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -6.826 3.609 8.252 1.00 0.00 H new ATOM 0 HD2 PHE A 326 -9.695 1.081 6.380 1.00 0.00 H new ATOM 0 HE1 PHE A 326 -7.310 2.554 10.413 1.00 0.00 H new ATOM 0 HE2 PHE A 326 -10.193 0.039 8.539 1.00 0.00 H new ATOM 0 HZ PHE A 326 -9.002 0.775 10.557 1.00 0.00 H new ATOM 1515 N LEU A 327 -6.548 1.604 3.021 1.00 0.00 N ATOM 1516 CA LEU A 327 -6.486 1.654 1.578 1.00 0.00 C ATOM 1517 C LEU A 327 -7.551 0.765 0.970 1.00 0.00 C ATOM 1518 O LEU A 327 -7.994 -0.208 1.584 1.00 0.00 O ATOM 1519 CB LEU A 327 -5.117 1.202 1.087 1.00 0.00 C ATOM 1520 CG LEU A 327 -3.948 2.102 1.471 1.00 0.00 C ATOM 1521 CD1 LEU A 327 -2.654 1.456 1.043 1.00 0.00 C ATOM 1522 CD2 LEU A 327 -4.087 3.470 0.831 1.00 0.00 C ATOM 0 H LEU A 327 -6.579 0.660 3.405 1.00 0.00 H new ATOM 0 HA LEU A 327 -6.658 2.685 1.270 1.00 0.00 H new ATOM 0 HB2 LEU A 327 -4.924 0.202 1.474 1.00 0.00 H new ATOM 0 HB3 LEU A 327 -5.149 1.122 0.000 1.00 0.00 H new ATOM 0 HG LEU A 327 -3.947 2.234 2.553 1.00 0.00 H new ATOM 0 HD11 LEU A 327 -1.818 2.099 1.317 1.00 0.00 H new ATOM 0 HD12 LEU A 327 -2.548 0.491 1.539 1.00 0.00 H new ATOM 0 HD13 LEU A 327 -2.660 1.310 -0.037 1.00 0.00 H new ATOM 0 HD21 LEU A 327 -3.241 4.094 1.120 1.00 0.00 H new ATOM 0 HD22 LEU A 327 -4.106 3.364 -0.254 1.00 0.00 H new ATOM 0 HD23 LEU A 327 -5.013 3.936 1.167 1.00 0.00 H new ATOM 1534 N GLN A 328 -7.939 1.099 -0.243 1.00 0.00 N ATOM 1535 CA GLN A 328 -8.946 0.347 -0.972 1.00 0.00 C ATOM 1536 C GLN A 328 -8.571 0.297 -2.441 1.00 0.00 C ATOM 1537 O GLN A 328 -7.935 1.219 -2.957 1.00 0.00 O ATOM 1538 CB GLN A 328 -10.328 0.988 -0.834 1.00 0.00 C ATOM 1539 CG GLN A 328 -10.919 0.964 0.568 1.00 0.00 C ATOM 1540 CD GLN A 328 -12.322 1.532 0.584 1.00 0.00 C ATOM 1541 OE1 GLN A 328 -13.036 1.388 -0.519 1.00 0.00 O flip ATOM 1542 NE2 GLN A 328 -12.766 2.092 1.571 1.00 0.00 N flip ATOM 0 H GLN A 328 -7.567 1.899 -0.754 1.00 0.00 H new ATOM 0 HA GLN A 328 -8.987 -0.658 -0.553 1.00 0.00 H new ATOM 0 HB2 GLN A 328 -10.264 2.024 -1.166 1.00 0.00 H new ATOM 0 HB3 GLN A 328 -11.016 0.479 -1.509 1.00 0.00 H new ATOM 0 HG2 GLN A 328 -10.935 -0.060 0.941 1.00 0.00 H new ATOM 0 HG3 GLN A 328 -10.284 1.539 1.242 1.00 0.00 H new ATOM 0 HE21 GLN A 328 -12.189 2.187 2.407 1.00 0.00 H new ATOM 0 HE22 GLN A 328 -13.715 2.466 1.562 1.00 0.00 H new ATOM 1551 N ALA A 329 -8.967 -0.769 -3.110 1.00 0.00 N ATOM 1552 CA ALA A 329 -8.686 -0.945 -4.522 1.00 0.00 C ATOM 1553 C ALA A 329 -9.963 -0.781 -5.343 1.00 0.00 C ATOM 1554 O ALA A 329 -10.986 -0.323 -4.824 1.00 0.00 O ATOM 1555 CB ALA A 329 -8.076 -2.319 -4.755 1.00 0.00 C ATOM 0 H ALA A 329 -9.492 -1.536 -2.691 1.00 0.00 H new ATOM 0 HA ALA A 329 -7.975 -0.183 -4.841 1.00 0.00 H new ATOM 0 HB1 ALA A 329 -7.866 -2.449 -5.817 1.00 0.00 H new ATOM 0 HB2 ALA A 329 -7.149 -2.406 -4.188 1.00 0.00 H new ATOM 0 HB3 ALA A 329 -8.775 -3.088 -4.427 1.00 0.00 H new ATOM 1561 N ALA A 330 -9.909 -1.140 -6.615 1.00 0.00 N ATOM 1562 CA ALA A 330 -11.101 -1.126 -7.445 1.00 0.00 C ATOM 1563 C ALA A 330 -11.857 -2.444 -7.304 1.00 0.00 C ATOM 1564 O ALA A 330 -13.088 -2.465 -7.242 1.00 0.00 O ATOM 1565 CB ALA A 330 -10.733 -0.859 -8.896 1.00 0.00 C ATOM 0 H ALA A 330 -9.060 -1.442 -7.092 1.00 0.00 H new ATOM 0 HA ALA A 330 -11.755 -0.321 -7.110 1.00 0.00 H new ATOM 0 HB1 ALA A 330 -11.637 -0.852 -9.505 1.00 0.00 H new ATOM 0 HB2 ALA A 330 -10.235 0.108 -8.973 1.00 0.00 H new ATOM 0 HB3 ALA A 330 -10.062 -1.642 -9.251 1.00 0.00 H new ATOM 1571 N THR A 331 -11.113 -3.542 -7.220 1.00 0.00 N ATOM 1572 CA THR A 331 -11.710 -4.860 -7.089 1.00 0.00 C ATOM 1573 C THR A 331 -11.265 -5.526 -5.788 1.00 0.00 C ATOM 1574 O THR A 331 -10.160 -5.280 -5.294 1.00 0.00 O ATOM 1575 CB THR A 331 -11.341 -5.766 -8.281 1.00 0.00 C ATOM 1576 OG1 THR A 331 -9.916 -5.867 -8.407 1.00 0.00 O ATOM 1577 CG2 THR A 331 -11.929 -5.232 -9.576 1.00 0.00 C ATOM 0 H THR A 331 -10.093 -3.542 -7.241 1.00 0.00 H new ATOM 0 HA THR A 331 -12.792 -4.726 -7.076 1.00 0.00 H new ATOM 0 HB THR A 331 -11.759 -6.755 -8.091 1.00 0.00 H new ATOM 0 HG1 THR A 331 -9.695 -6.446 -9.166 1.00 0.00 H new ATOM 0 HG21 THR A 331 -11.653 -5.890 -10.400 1.00 0.00 H new ATOM 0 HG22 THR A 331 -13.015 -5.191 -9.493 1.00 0.00 H new ATOM 0 HG23 THR A 331 -11.541 -4.231 -9.766 1.00 0.00 H new ATOM 1585 N PRO A 332 -12.137 -6.374 -5.216 1.00 0.00 N ATOM 1586 CA PRO A 332 -11.893 -7.047 -3.931 1.00 0.00 C ATOM 1587 C PRO A 332 -10.700 -7.996 -3.956 1.00 0.00 C ATOM 1588 O PRO A 332 -10.220 -8.418 -2.904 1.00 0.00 O ATOM 1589 CB PRO A 332 -13.186 -7.832 -3.677 1.00 0.00 C ATOM 1590 CG PRO A 332 -14.204 -7.192 -4.553 1.00 0.00 C ATOM 1591 CD PRO A 332 -13.457 -6.724 -5.766 1.00 0.00 C ATOM 0 HA PRO A 332 -11.650 -6.322 -3.154 1.00 0.00 H new ATOM 0 HB2 PRO A 332 -13.062 -8.887 -3.922 1.00 0.00 H new ATOM 0 HB3 PRO A 332 -13.479 -7.781 -2.628 1.00 0.00 H new ATOM 0 HG2 PRO A 332 -14.988 -7.899 -4.824 1.00 0.00 H new ATOM 0 HG3 PRO A 332 -14.689 -6.358 -4.046 1.00 0.00 H new ATOM 0 HD2 PRO A 332 -13.386 -7.504 -6.524 1.00 0.00 H new ATOM 0 HD3 PRO A 332 -13.941 -5.867 -6.234 1.00 0.00 H new ATOM 1599 N LYS A 333 -10.225 -8.339 -5.146 1.00 0.00 N ATOM 1600 CA LYS A 333 -9.078 -9.226 -5.268 1.00 0.00 C ATOM 1601 C LYS A 333 -7.774 -8.441 -5.368 1.00 0.00 C ATOM 1602 O LYS A 333 -6.739 -8.893 -4.881 1.00 0.00 O ATOM 1603 CB LYS A 333 -9.222 -10.151 -6.475 1.00 0.00 C ATOM 1604 CG LYS A 333 -10.389 -11.112 -6.365 1.00 0.00 C ATOM 1605 CD LYS A 333 -10.309 -12.191 -7.428 1.00 0.00 C ATOM 1606 CE LYS A 333 -11.473 -13.163 -7.341 1.00 0.00 C ATOM 1607 NZ LYS A 333 -11.293 -14.314 -8.262 1.00 0.00 N ATOM 0 H LYS A 333 -10.613 -8.019 -6.033 1.00 0.00 H new ATOM 0 HA LYS A 333 -9.046 -9.834 -4.364 1.00 0.00 H new ATOM 0 HB2 LYS A 333 -9.343 -9.546 -7.374 1.00 0.00 H new ATOM 0 HB3 LYS A 333 -8.302 -10.722 -6.597 1.00 0.00 H new ATOM 0 HG2 LYS A 333 -10.395 -11.571 -5.376 1.00 0.00 H new ATOM 0 HG3 LYS A 333 -11.326 -10.565 -6.468 1.00 0.00 H new ATOM 0 HD2 LYS A 333 -10.297 -11.728 -8.415 1.00 0.00 H new ATOM 0 HD3 LYS A 333 -9.372 -12.737 -7.320 1.00 0.00 H new ATOM 0 HE2 LYS A 333 -11.569 -13.526 -6.318 1.00 0.00 H new ATOM 0 HE3 LYS A 333 -12.400 -12.644 -7.583 1.00 0.00 H new ATOM 0 HZ1 LYS A 333 -12.106 -14.957 -8.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 333 -11.226 -13.968 -9.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 333 -10.421 -14.823 -8.015 1.00 0.00 H new ATOM 1621 N GLU A 334 -7.823 -7.258 -5.985 1.00 0.00 N ATOM 1622 CA GLU A 334 -6.617 -6.449 -6.161 1.00 0.00 C ATOM 1623 C GLU A 334 -6.059 -6.032 -4.808 1.00 0.00 C ATOM 1624 O GLU A 334 -4.847 -5.981 -4.614 1.00 0.00 O ATOM 1625 CB GLU A 334 -6.904 -5.200 -6.993 1.00 0.00 C ATOM 1626 CG GLU A 334 -5.656 -4.503 -7.493 1.00 0.00 C ATOM 1627 CD GLU A 334 -4.885 -5.319 -8.515 1.00 0.00 C ATOM 1628 OE1 GLU A 334 -4.039 -6.150 -8.115 1.00 0.00 O ATOM 1629 OE2 GLU A 334 -5.107 -5.117 -9.726 1.00 0.00 O ATOM 0 H GLU A 334 -8.674 -6.844 -6.366 1.00 0.00 H new ATOM 0 HA GLU A 334 -5.884 -7.060 -6.688 1.00 0.00 H new ATOM 0 HB2 GLU A 334 -7.522 -5.477 -7.847 1.00 0.00 H new ATOM 0 HB3 GLU A 334 -7.485 -4.500 -6.393 1.00 0.00 H new ATOM 0 HG2 GLU A 334 -5.934 -3.547 -7.936 1.00 0.00 H new ATOM 0 HG3 GLU A 334 -5.005 -4.285 -6.646 1.00 0.00 H new ATOM 1636 N ARG A 335 -6.954 -5.735 -3.875 1.00 0.00 N ATOM 1637 CA ARG A 335 -6.548 -5.340 -2.535 1.00 0.00 C ATOM 1638 C ARG A 335 -5.748 -6.462 -1.873 1.00 0.00 C ATOM 1639 O ARG A 335 -4.724 -6.212 -1.245 1.00 0.00 O ATOM 1640 CB ARG A 335 -7.772 -4.954 -1.689 1.00 0.00 C ATOM 1641 CG ARG A 335 -8.758 -6.089 -1.443 1.00 0.00 C ATOM 1642 CD ARG A 335 -8.593 -6.694 -0.058 1.00 0.00 C ATOM 1643 NE ARG A 335 -9.377 -7.918 0.092 1.00 0.00 N ATOM 1644 CZ ARG A 335 -10.210 -8.156 1.104 1.00 0.00 C ATOM 1645 NH1 ARG A 335 -10.410 -7.227 2.037 1.00 0.00 N ATOM 1646 NH2 ARG A 335 -10.846 -9.318 1.174 1.00 0.00 N ATOM 0 H ARG A 335 -7.963 -5.760 -4.022 1.00 0.00 H new ATOM 0 HA ARG A 335 -5.906 -4.462 -2.607 1.00 0.00 H new ATOM 0 HB2 ARG A 335 -7.427 -4.575 -0.727 1.00 0.00 H new ATOM 0 HB3 ARG A 335 -8.296 -4.136 -2.184 1.00 0.00 H new ATOM 0 HG2 ARG A 335 -9.776 -5.717 -1.557 1.00 0.00 H new ATOM 0 HG3 ARG A 335 -8.615 -6.863 -2.197 1.00 0.00 H new ATOM 0 HD2 ARG A 335 -7.540 -6.912 0.121 1.00 0.00 H new ATOM 0 HD3 ARG A 335 -8.902 -5.969 0.695 1.00 0.00 H new ATOM 0 HE ARG A 335 -9.280 -8.637 -0.625 1.00 0.00 H new ATOM 0 HH11 ARG A 335 -9.925 -6.332 1.977 1.00 0.00 H new ATOM 0 HH12 ARG A 335 -11.048 -7.411 2.811 1.00 0.00 H new ATOM 0 HH21 ARG A 335 -10.696 -10.025 0.455 1.00 0.00 H new ATOM 0 HH22 ARG A 335 -11.485 -9.504 1.947 1.00 0.00 H new ATOM 1660 N THR A 336 -6.230 -7.694 -2.022 1.00 0.00 N ATOM 1661 CA THR A 336 -5.521 -8.865 -1.531 1.00 0.00 C ATOM 1662 C THR A 336 -4.121 -8.934 -2.140 1.00 0.00 C ATOM 1663 O THR A 336 -3.138 -9.197 -1.447 1.00 0.00 O ATOM 1664 CB THR A 336 -6.305 -10.148 -1.868 1.00 0.00 C ATOM 1665 OG1 THR A 336 -7.704 -9.946 -1.603 1.00 0.00 O ATOM 1666 CG2 THR A 336 -5.799 -11.324 -1.045 1.00 0.00 C ATOM 0 H THR A 336 -7.115 -7.904 -2.483 1.00 0.00 H new ATOM 0 HA THR A 336 -5.430 -8.783 -0.448 1.00 0.00 H new ATOM 0 HB THR A 336 -6.158 -10.372 -2.924 1.00 0.00 H new ATOM 0 HG1 THR A 336 -8.199 -10.763 -1.820 1.00 0.00 H new ATOM 0 HG21 THR A 336 -6.368 -12.218 -1.300 1.00 0.00 H new ATOM 0 HG22 THR A 336 -4.744 -11.491 -1.260 1.00 0.00 H new ATOM 0 HG23 THR A 336 -5.923 -11.106 0.016 1.00 0.00 H new ATOM 1674 N GLU A 337 -4.049 -8.686 -3.442 1.00 0.00 N ATOM 1675 CA GLU A 337 -2.780 -8.620 -4.162 1.00 0.00 C ATOM 1676 C GLU A 337 -1.868 -7.518 -3.619 1.00 0.00 C ATOM 1677 O GLU A 337 -0.652 -7.685 -3.581 1.00 0.00 O ATOM 1678 CB GLU A 337 -3.042 -8.382 -5.648 1.00 0.00 C ATOM 1679 CG GLU A 337 -3.736 -9.544 -6.332 1.00 0.00 C ATOM 1680 CD GLU A 337 -2.826 -10.740 -6.499 1.00 0.00 C ATOM 1681 OE1 GLU A 337 -2.070 -10.783 -7.493 1.00 0.00 O ATOM 1682 OE2 GLU A 337 -2.858 -11.642 -5.638 1.00 0.00 O ATOM 0 H GLU A 337 -4.867 -8.525 -4.030 1.00 0.00 H new ATOM 0 HA GLU A 337 -2.270 -9.573 -4.019 1.00 0.00 H new ATOM 0 HB2 GLU A 337 -3.652 -7.486 -5.763 1.00 0.00 H new ATOM 0 HB3 GLU A 337 -2.094 -8.189 -6.150 1.00 0.00 H new ATOM 0 HG2 GLU A 337 -4.611 -9.835 -5.750 1.00 0.00 H new ATOM 0 HG3 GLU A 337 -4.095 -9.225 -7.310 1.00 0.00 H new ATOM 1689 N TRP A 338 -2.447 -6.390 -3.224 1.00 0.00 N ATOM 1690 CA TRP A 338 -1.670 -5.303 -2.634 1.00 0.00 C ATOM 1691 C TRP A 338 -1.184 -5.670 -1.243 1.00 0.00 C ATOM 1692 O TRP A 338 -0.118 -5.226 -0.816 1.00 0.00 O ATOM 1693 CB TRP A 338 -2.463 -3.990 -2.629 1.00 0.00 C ATOM 1694 CG TRP A 338 -2.363 -3.301 -3.949 1.00 0.00 C ATOM 1695 CD1 TRP A 338 -3.168 -3.474 -5.029 1.00 0.00 C ATOM 1696 CD2 TRP A 338 -1.369 -2.355 -4.331 1.00 0.00 C ATOM 1697 NE1 TRP A 338 -2.706 -2.734 -6.086 1.00 0.00 N ATOM 1698 CE2 TRP A 338 -1.601 -2.017 -5.680 1.00 0.00 C ATOM 1699 CE3 TRP A 338 -0.293 -1.777 -3.661 1.00 0.00 C ATOM 1700 CZ2 TRP A 338 -0.786 -1.116 -6.366 1.00 0.00 C ATOM 1701 CZ3 TRP A 338 0.513 -0.892 -4.337 1.00 0.00 C ATOM 1702 CH2 TRP A 338 0.263 -0.564 -5.679 1.00 0.00 C ATOM 0 H TRP A 338 -3.447 -6.203 -3.300 1.00 0.00 H new ATOM 0 HA TRP A 338 -0.789 -5.146 -3.257 1.00 0.00 H new ATOM 0 HB2 TRP A 338 -3.509 -4.193 -2.399 1.00 0.00 H new ATOM 0 HB3 TRP A 338 -2.085 -3.336 -1.843 1.00 0.00 H new ATOM 0 HD1 TRP A 338 -4.045 -4.104 -5.052 1.00 0.00 H new ATOM 0 HE1 TRP A 338 -3.114 -2.717 -7.021 1.00 0.00 H new ATOM 0 HE3 TRP A 338 -0.095 -2.020 -2.627 1.00 0.00 H new ATOM 0 HZ2 TRP A 338 -0.975 -0.863 -7.399 1.00 0.00 H new ATOM 0 HZ3 TRP A 338 1.352 -0.442 -3.827 1.00 0.00 H new ATOM 0 HH2 TRP A 338 0.912 0.139 -6.181 1.00 0.00 H new ATOM 1713 N ILE A 339 -1.956 -6.490 -0.543 1.00 0.00 N ATOM 1714 CA ILE A 339 -1.488 -7.086 0.697 1.00 0.00 C ATOM 1715 C ILE A 339 -0.233 -7.894 0.407 1.00 0.00 C ATOM 1716 O ILE A 339 0.803 -7.713 1.043 1.00 0.00 O ATOM 1717 CB ILE A 339 -2.544 -8.017 1.325 1.00 0.00 C ATOM 1718 CG1 ILE A 339 -3.847 -7.261 1.576 1.00 0.00 C ATOM 1719 CG2 ILE A 339 -2.017 -8.618 2.621 1.00 0.00 C ATOM 1720 CD1 ILE A 339 -4.987 -8.162 1.986 1.00 0.00 C ATOM 0 H ILE A 339 -2.903 -6.755 -0.812 1.00 0.00 H new ATOM 0 HA ILE A 339 -1.286 -6.281 1.404 1.00 0.00 H new ATOM 0 HB ILE A 339 -2.749 -8.827 0.625 1.00 0.00 H new ATOM 0 HG12 ILE A 339 -3.683 -6.516 2.354 1.00 0.00 H new ATOM 0 HG13 ILE A 339 -4.126 -6.721 0.671 1.00 0.00 H new ATOM 0 HG21 ILE A 339 -2.774 -9.273 3.053 1.00 0.00 H new ATOM 0 HG22 ILE A 339 -1.114 -9.193 2.415 1.00 0.00 H new ATOM 0 HG23 ILE A 339 -1.785 -7.819 3.325 1.00 0.00 H new ATOM 0 HD11 ILE A 339 -5.883 -7.563 2.149 1.00 0.00 H new ATOM 0 HD12 ILE A 339 -5.176 -8.891 1.198 1.00 0.00 H new ATOM 0 HD13 ILE A 339 -4.726 -8.683 2.907 1.00 0.00 H new ATOM 1732 N LYS A 340 -0.346 -8.771 -0.587 1.00 0.00 N ATOM 1733 CA LYS A 340 0.779 -9.584 -1.048 1.00 0.00 C ATOM 1734 C LYS A 340 1.975 -8.703 -1.378 1.00 0.00 C ATOM 1735 O LYS A 340 3.079 -8.892 -0.860 1.00 0.00 O ATOM 1736 CB LYS A 340 0.407 -10.360 -2.302 1.00 0.00 C ATOM 1737 CG LYS A 340 -0.833 -11.219 -2.165 1.00 0.00 C ATOM 1738 CD LYS A 340 -0.993 -11.833 -0.786 1.00 0.00 C ATOM 1739 CE LYS A 340 -2.329 -12.516 -0.665 1.00 0.00 C ATOM 1740 NZ LYS A 340 -2.559 -13.095 0.687 1.00 0.00 N ATOM 0 H LYS A 340 -1.215 -8.939 -1.094 1.00 0.00 H new ATOM 0 HA LYS A 340 1.031 -10.275 -0.244 1.00 0.00 H new ATOM 0 HB2 LYS A 340 0.256 -9.654 -3.119 1.00 0.00 H new ATOM 0 HB3 LYS A 340 1.246 -10.997 -2.582 1.00 0.00 H new ATOM 0 HG2 LYS A 340 -1.711 -10.614 -2.389 1.00 0.00 H new ATOM 0 HG3 LYS A 340 -0.797 -12.016 -2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 340 -0.193 -12.551 -0.606 1.00 0.00 H new ATOM 0 HD3 LYS A 340 -0.903 -11.059 -0.024 1.00 0.00 H new ATOM 0 HE2 LYS A 340 -3.120 -11.800 -0.888 1.00 0.00 H new ATOM 0 HE3 LYS A 340 -2.396 -13.308 -1.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 340 -3.493 -13.552 0.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 340 -1.822 -13.799 0.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 340 -2.523 -12.338 1.399 1.00 0.00 H new ATOM 1754 N ALA A 341 1.712 -7.735 -2.249 1.00 0.00 N ATOM 1755 CA ALA A 341 2.713 -6.819 -2.772 1.00 0.00 C ATOM 1756 C ALA A 341 3.501 -6.144 -1.656 1.00 0.00 C ATOM 1757 O ALA A 341 4.723 -6.245 -1.583 1.00 0.00 O ATOM 1758 CB ALA A 341 2.017 -5.769 -3.638 1.00 0.00 C ATOM 0 H ALA A 341 0.776 -7.564 -2.617 1.00 0.00 H new ATOM 0 HA ALA A 341 3.426 -7.388 -3.370 1.00 0.00 H new ATOM 0 HB1 ALA A 341 2.758 -5.076 -4.036 1.00 0.00 H new ATOM 0 HB2 ALA A 341 1.501 -6.261 -4.462 1.00 0.00 H new ATOM 0 HB3 ALA A 341 1.295 -5.220 -3.034 1.00 0.00 H new ATOM 1764 N ILE A 342 2.780 -5.475 -0.783 1.00 0.00 N ATOM 1765 CA ILE A 342 3.371 -4.672 0.269 1.00 0.00 C ATOM 1766 C ILE A 342 4.036 -5.523 1.344 1.00 0.00 C ATOM 1767 O ILE A 342 5.146 -5.217 1.785 1.00 0.00 O ATOM 1768 CB ILE A 342 2.292 -3.754 0.867 1.00 0.00 C ATOM 1769 CG1 ILE A 342 2.011 -2.632 -0.133 1.00 0.00 C ATOM 1770 CG2 ILE A 342 2.708 -3.200 2.223 1.00 0.00 C ATOM 1771 CD1 ILE A 342 0.668 -1.975 0.032 1.00 0.00 C ATOM 0 H ILE A 342 1.760 -5.472 -0.782 1.00 0.00 H new ATOM 0 HA ILE A 342 4.165 -4.064 -0.166 1.00 0.00 H new ATOM 0 HB ILE A 342 1.383 -4.329 1.042 1.00 0.00 H new ATOM 0 HG12 ILE A 342 2.787 -1.873 -0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 342 2.083 -3.035 -1.143 1.00 0.00 H new ATOM 0 HG21 ILE A 342 1.918 -2.557 2.611 1.00 0.00 H new ATOM 0 HG22 ILE A 342 2.878 -4.024 2.916 1.00 0.00 H new ATOM 0 HG23 ILE A 342 3.626 -2.622 2.114 1.00 0.00 H new ATOM 0 HD11 ILE A 342 0.552 -1.192 -0.717 1.00 0.00 H new ATOM 0 HD12 ILE A 342 -0.119 -2.718 -0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 342 0.597 -1.538 1.028 1.00 0.00 H new ATOM 1783 N GLN A 343 3.383 -6.603 1.748 1.00 0.00 N ATOM 1784 CA GLN A 343 3.947 -7.467 2.780 1.00 0.00 C ATOM 1785 C GLN A 343 5.238 -8.132 2.309 1.00 0.00 C ATOM 1786 O GLN A 343 6.154 -8.343 3.104 1.00 0.00 O ATOM 1787 CB GLN A 343 2.948 -8.527 3.242 1.00 0.00 C ATOM 1788 CG GLN A 343 1.736 -7.941 3.946 1.00 0.00 C ATOM 1789 CD GLN A 343 1.096 -8.913 4.909 1.00 0.00 C ATOM 1790 OE1 GLN A 343 0.205 -9.680 4.555 1.00 0.00 O ATOM 1791 NE2 GLN A 343 1.546 -8.866 6.146 1.00 0.00 N ATOM 0 H GLN A 343 2.477 -6.900 1.386 1.00 0.00 H new ATOM 0 HA GLN A 343 4.179 -6.826 3.631 1.00 0.00 H new ATOM 0 HB2 GLN A 343 2.615 -9.104 2.379 1.00 0.00 H new ATOM 0 HB3 GLN A 343 3.450 -9.222 3.915 1.00 0.00 H new ATOM 0 HG2 GLN A 343 2.034 -7.043 4.487 1.00 0.00 H new ATOM 0 HG3 GLN A 343 1.001 -7.636 3.202 1.00 0.00 H new ATOM 0 HE21 GLN A 343 2.288 -8.212 6.394 1.00 0.00 H new ATOM 0 HE22 GLN A 343 1.152 -9.484 6.856 1.00 0.00 H new ATOM 1800 N MET A 344 5.325 -8.449 1.020 1.00 0.00 N ATOM 1801 CA MET A 344 6.529 -9.078 0.488 1.00 0.00 C ATOM 1802 C MET A 344 7.620 -8.038 0.255 1.00 0.00 C ATOM 1803 O MET A 344 8.803 -8.370 0.201 1.00 0.00 O ATOM 1804 CB MET A 344 6.249 -9.842 -0.806 1.00 0.00 C ATOM 1805 CG MET A 344 6.151 -8.940 -2.007 1.00 0.00 C ATOM 1806 SD MET A 344 6.583 -9.768 -3.552 1.00 0.00 S ATOM 1807 CE MET A 344 8.305 -10.152 -3.250 1.00 0.00 C ATOM 0 H MET A 344 4.588 -8.284 0.334 1.00 0.00 H new ATOM 0 HA MET A 344 6.873 -9.797 1.232 1.00 0.00 H new ATOM 0 HB2 MET A 344 7.041 -10.573 -0.970 1.00 0.00 H new ATOM 0 HB3 MET A 344 5.318 -10.399 -0.699 1.00 0.00 H new ATOM 0 HG2 MET A 344 5.135 -8.553 -2.081 1.00 0.00 H new ATOM 0 HG3 MET A 344 6.809 -8.083 -1.865 1.00 0.00 H new ATOM 0 HE1 MET A 344 8.851 -10.141 -4.193 1.00 0.00 H new ATOM 0 HE2 MET A 344 8.730 -9.409 -2.575 1.00 0.00 H new ATOM 0 HE3 MET A 344 8.383 -11.140 -2.797 1.00 0.00 H new ATOM 1817 N ALA A 345 7.224 -6.778 0.137 1.00 0.00 N ATOM 1818 CA ALA A 345 8.169 -5.706 -0.126 1.00 0.00 C ATOM 1819 C ALA A 345 8.855 -5.242 1.153 1.00 0.00 C ATOM 1820 O ALA A 345 9.934 -4.662 1.108 1.00 0.00 O ATOM 1821 CB ALA A 345 7.463 -4.536 -0.794 1.00 0.00 C ATOM 0 H ALA A 345 6.254 -6.475 0.220 1.00 0.00 H new ATOM 0 HA ALA A 345 8.936 -6.094 -0.797 1.00 0.00 H new ATOM 0 HB1 ALA A 345 8.181 -3.739 -0.986 1.00 0.00 H new ATOM 0 HB2 ALA A 345 7.026 -4.865 -1.737 1.00 0.00 H new ATOM 0 HB3 ALA A 345 6.675 -4.164 -0.139 1.00 0.00 H new ATOM 1827 N SER A 346 8.233 -5.497 2.296 1.00 0.00 N ATOM 1828 CA SER A 346 8.762 -5.022 3.567 1.00 0.00 C ATOM 1829 C SER A 346 9.738 -6.028 4.196 1.00 0.00 C ATOM 1830 O SER A 346 10.163 -5.862 5.342 1.00 0.00 O ATOM 1831 CB SER A 346 7.600 -4.711 4.524 1.00 0.00 C ATOM 1832 OG SER A 346 8.067 -4.307 5.804 1.00 0.00 O ATOM 0 H SER A 346 7.365 -6.028 2.369 1.00 0.00 H new ATOM 0 HA SER A 346 9.329 -4.110 3.380 1.00 0.00 H new ATOM 0 HB2 SER A 346 6.979 -3.923 4.098 1.00 0.00 H new ATOM 0 HB3 SER A 346 6.969 -5.593 4.629 1.00 0.00 H new ATOM 0 HG SER A 346 8.968 -4.664 5.951 1.00 0.00 H new ATOM 1838 N ARG A 347 10.112 -7.058 3.445 1.00 0.00 N ATOM 1839 CA ARG A 347 11.073 -8.040 3.944 1.00 0.00 C ATOM 1840 C ARG A 347 12.335 -8.039 3.093 1.00 0.00 C ATOM 1841 O ARG A 347 13.093 -9.006 3.078 1.00 0.00 O ATOM 1842 CB ARG A 347 10.464 -9.444 3.982 1.00 0.00 C ATOM 1843 CG ARG A 347 10.030 -9.963 2.627 1.00 0.00 C ATOM 1844 CD ARG A 347 9.532 -11.394 2.720 1.00 0.00 C ATOM 1845 NE ARG A 347 10.587 -12.316 3.148 1.00 0.00 N ATOM 1846 CZ ARG A 347 10.365 -13.475 3.772 1.00 0.00 C ATOM 1847 NH1 ARG A 347 9.136 -13.836 4.101 1.00 0.00 N ATOM 1848 NH2 ARG A 347 11.376 -14.275 4.082 1.00 0.00 N ATOM 0 H ARG A 347 9.771 -7.235 2.500 1.00 0.00 H new ATOM 0 HA ARG A 347 11.336 -7.755 4.963 1.00 0.00 H new ATOM 0 HB2 ARG A 347 11.193 -10.134 4.408 1.00 0.00 H new ATOM 0 HB3 ARG A 347 9.603 -9.438 4.650 1.00 0.00 H new ATOM 0 HG2 ARG A 347 9.241 -9.326 2.227 1.00 0.00 H new ATOM 0 HG3 ARG A 347 10.866 -9.911 1.930 1.00 0.00 H new ATOM 0 HD2 ARG A 347 8.700 -11.443 3.423 1.00 0.00 H new ATOM 0 HD3 ARG A 347 9.148 -11.708 1.749 1.00 0.00 H new ATOM 0 HE ARG A 347 11.554 -12.055 2.957 1.00 0.00 H new ATOM 0 HH11 ARG A 347 8.349 -13.227 3.878 1.00 0.00 H new ATOM 0 HH12 ARG A 347 8.975 -14.723 4.578 1.00 0.00 H new ATOM 0 HH21 ARG A 347 12.331 -14.006 3.844 1.00 0.00 H new ATOM 0 HH22 ARG A 347 11.199 -15.159 4.559 1.00 0.00 H new