USER MOD reduce.3.24.130724 H: found=0, std=0, add=643, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 646 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 270 GLN : amide:sc= -6.65! C(o=-13!,f=-19!) USER MOD Set 1.2: A 273 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.3: A 336 ASN : amide:sc= -6.2! C(o=-13!,f=-14!) USER MOD Set 2.1: A 306 SER OG : rot 38:sc= 0.00264 USER MOD Set 2.2: A 341 GLN : amide:sc= -2.34! K(o=-2.3!,f=-1.1) USER MOD Single : A 272 SER OG : rot 180:sc= 0 USER MOD Single : A 275 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 279 THR OG1 : rot -61:sc= 1.12 USER MOD Single : A 280 THR OG1 : rot -22:sc= -2.65! USER MOD Single : A 282 GLN : amide:sc= -0.303 X(o=-0.3,f=0) USER MOD Single : A 283 GLN : amide:sc= -6.4! C(o=-6.4!,f=-2.5!) USER MOD Single : A 286 ASN : amide:sc= -0.634 K(o=-0.63,f=-0.045) USER MOD Single : A 289 SER OG : rot 180:sc= -0.363 USER MOD Single : A 298 THR OG1 : rot 180:sc= 0 USER MOD Single : A 305 ASN : amide:sc= -0.0849 X(o=-0.085,f=-0.41) USER MOD Single : A 307 THR OG1 : rot -22:sc= 0.57! USER MOD Single : A 309 THR OG1 : rot -156:sc= -2.01! USER MOD Single : A 314 HIS : no HE2:sc= -16.6! C(o=-17!,f=-19!) USER MOD Single : A 315 SER OG : rot 180:sc= 0 USER MOD Single : A 316 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 318 GLN : amide:sc= -0.496 X(o=-0.5,f=0) USER MOD Single : A 321 THR OG1 : rot -135:sc= -5.16! USER MOD Single : A 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 62 N ALA A 268 3.991 13.633 5.835 1.00 0.00 N ATOM 63 CA ALA A 268 4.650 13.717 4.547 1.00 0.00 C ATOM 64 C ALA A 268 5.807 12.724 4.425 1.00 0.00 C ATOM 65 O ALA A 268 6.226 12.389 3.318 1.00 0.00 O ATOM 66 CB ALA A 268 5.140 15.137 4.305 1.00 0.00 C ATOM 0 HA ALA A 268 3.918 13.452 3.784 1.00 0.00 H new ATOM 0 HB1 ALA A 268 5.634 15.191 3.335 1.00 0.00 H new ATOM 0 HB2 ALA A 268 4.292 15.822 4.319 1.00 0.00 H new ATOM 0 HB3 ALA A 268 5.845 15.417 5.087 1.00 0.00 H new ATOM 72 N ARG A 269 6.337 12.276 5.562 1.00 0.00 N ATOM 73 CA ARG A 269 7.466 11.348 5.585 1.00 0.00 C ATOM 74 C ARG A 269 7.160 10.014 4.918 1.00 0.00 C ATOM 75 O ARG A 269 7.842 9.612 3.976 1.00 0.00 O ATOM 76 CB ARG A 269 7.888 11.101 7.034 1.00 0.00 C ATOM 77 CG ARG A 269 8.748 12.208 7.607 1.00 0.00 C ATOM 78 CD ARG A 269 10.098 12.276 6.914 1.00 0.00 C ATOM 79 NE ARG A 269 10.856 13.461 7.312 1.00 0.00 N ATOM 80 CZ ARG A 269 11.966 13.428 8.047 1.00 0.00 C ATOM 81 NH1 ARG A 269 12.462 12.273 8.478 1.00 0.00 N ATOM 82 NH2 ARG A 269 12.585 14.559 8.354 1.00 0.00 N ATOM 0 H ARG A 269 5.999 12.544 6.486 1.00 0.00 H new ATOM 0 HA ARG A 269 8.271 11.813 5.015 1.00 0.00 H new ATOM 0 HB2 ARG A 269 6.996 10.988 7.650 1.00 0.00 H new ATOM 0 HB3 ARG A 269 8.435 10.160 7.090 1.00 0.00 H new ATOM 0 HG2 ARG A 269 8.234 13.163 7.500 1.00 0.00 H new ATOM 0 HG3 ARG A 269 8.893 12.042 8.675 1.00 0.00 H new ATOM 0 HD2 ARG A 269 10.673 11.381 7.151 1.00 0.00 H new ATOM 0 HD3 ARG A 269 9.952 12.285 5.834 1.00 0.00 H new ATOM 0 HE ARG A 269 10.513 14.372 7.007 1.00 0.00 H new ATOM 0 HH11 ARG A 269 11.992 11.398 8.247 1.00 0.00 H new ATOM 0 HH12 ARG A 269 13.313 12.261 9.040 1.00 0.00 H new ATOM 0 HH21 ARG A 269 12.211 15.450 8.028 1.00 0.00 H new ATOM 0 HH22 ARG A 269 13.435 14.538 8.917 1.00 0.00 H new ATOM 96 N GLN A 270 6.161 9.312 5.429 1.00 0.00 N ATOM 97 CA GLN A 270 5.804 8.001 4.894 1.00 0.00 C ATOM 98 C GLN A 270 5.662 8.009 3.380 1.00 0.00 C ATOM 99 O GLN A 270 6.118 7.087 2.705 1.00 0.00 O ATOM 100 CB GLN A 270 4.509 7.532 5.516 1.00 0.00 C ATOM 101 CG GLN A 270 4.580 7.374 7.013 1.00 0.00 C ATOM 102 CD GLN A 270 5.748 6.554 7.516 1.00 0.00 C ATOM 103 OE1 GLN A 270 6.608 6.115 6.752 1.00 0.00 O ATOM 104 NE2 GLN A 270 5.778 6.356 8.827 1.00 0.00 N ATOM 0 H GLN A 270 5.583 9.623 6.210 1.00 0.00 H new ATOM 0 HA GLN A 270 6.616 7.319 5.145 1.00 0.00 H new ATOM 0 HB2 GLN A 270 3.720 8.243 5.271 1.00 0.00 H new ATOM 0 HB3 GLN A 270 4.227 6.578 5.071 1.00 0.00 H new ATOM 0 HG2 GLN A 270 4.629 8.364 7.466 1.00 0.00 H new ATOM 0 HG3 GLN A 270 3.655 6.911 7.358 1.00 0.00 H new ATOM 0 HE21 GLN A 270 5.041 6.741 9.418 1.00 0.00 H new ATOM 0 HE22 GLN A 270 6.538 5.819 9.244 1.00 0.00 H new ATOM 113 N LEU A 271 5.020 9.042 2.846 1.00 0.00 N ATOM 114 CA LEU A 271 4.825 9.135 1.400 1.00 0.00 C ATOM 115 C LEU A 271 6.110 8.850 0.650 1.00 0.00 C ATOM 116 O LEU A 271 6.086 8.438 -0.504 1.00 0.00 O ATOM 117 CB LEU A 271 4.258 10.503 1.009 1.00 0.00 C ATOM 118 CG LEU A 271 2.742 10.531 0.777 1.00 0.00 C ATOM 119 CD1 LEU A 271 2.409 10.258 -0.682 1.00 0.00 C ATOM 120 CD2 LEU A 271 2.039 9.525 1.673 1.00 0.00 C ATOM 0 H LEU A 271 4.630 9.818 3.382 1.00 0.00 H new ATOM 0 HA LEU A 271 4.099 8.373 1.117 1.00 0.00 H new ATOM 0 HB2 LEU A 271 4.504 11.220 1.792 1.00 0.00 H new ATOM 0 HB3 LEU A 271 4.756 10.840 0.100 1.00 0.00 H new ATOM 0 HG LEU A 271 2.386 11.529 1.030 1.00 0.00 H new ATOM 0 HD11 LEU A 271 1.328 10.283 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 271 2.873 11.019 -1.310 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.787 9.275 -0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 271 0.965 9.563 1.490 1.00 0.00 H new ATOM 0 HD22 LEU A 271 2.409 8.523 1.455 1.00 0.00 H new ATOM 0 HD23 LEU A 271 2.238 9.766 2.717 1.00 0.00 H new ATOM 132 N SER A 272 7.226 9.043 1.324 1.00 0.00 N ATOM 133 CA SER A 272 8.521 8.776 0.725 1.00 0.00 C ATOM 134 C SER A 272 8.653 7.296 0.382 1.00 0.00 C ATOM 135 O SER A 272 9.072 6.943 -0.719 1.00 0.00 O ATOM 136 CB SER A 272 9.651 9.202 1.665 1.00 0.00 C ATOM 137 OG SER A 272 10.890 9.237 0.982 1.00 0.00 O ATOM 0 H SER A 272 7.264 9.383 2.285 1.00 0.00 H new ATOM 0 HA SER A 272 8.598 9.358 -0.193 1.00 0.00 H new ATOM 0 HB2 SER A 272 9.432 10.186 2.081 1.00 0.00 H new ATOM 0 HB3 SER A 272 9.713 8.508 2.504 1.00 0.00 H new ATOM 0 HG SER A 272 11.597 9.513 1.602 1.00 0.00 H new ATOM 143 N LYS A 273 8.294 6.432 1.330 1.00 0.00 N ATOM 144 CA LYS A 273 8.373 4.988 1.124 1.00 0.00 C ATOM 145 C LYS A 273 7.173 4.474 0.337 1.00 0.00 C ATOM 146 O LYS A 273 7.318 3.635 -0.548 1.00 0.00 O ATOM 147 CB LYS A 273 8.445 4.263 2.469 1.00 0.00 C ATOM 148 CG LYS A 273 9.475 4.850 3.422 1.00 0.00 C ATOM 149 CD LYS A 273 8.816 5.482 4.639 1.00 0.00 C ATOM 150 CE LYS A 273 9.765 6.424 5.367 1.00 0.00 C ATOM 151 NZ LYS A 273 10.199 5.878 6.685 1.00 0.00 N ATOM 0 H LYS A 273 7.946 6.707 2.248 1.00 0.00 H new ATOM 0 HA LYS A 273 9.277 4.786 0.550 1.00 0.00 H new ATOM 0 HB2 LYS A 273 7.464 4.295 2.943 1.00 0.00 H new ATOM 0 HB3 LYS A 273 8.680 3.213 2.294 1.00 0.00 H new ATOM 0 HG2 LYS A 273 10.161 4.067 3.745 1.00 0.00 H new ATOM 0 HG3 LYS A 273 10.070 5.599 2.899 1.00 0.00 H new ATOM 0 HD2 LYS A 273 7.927 6.030 4.328 1.00 0.00 H new ATOM 0 HD3 LYS A 273 8.485 4.699 5.322 1.00 0.00 H new ATOM 0 HE2 LYS A 273 10.641 6.607 4.745 1.00 0.00 H new ATOM 0 HE3 LYS A 273 9.275 7.386 5.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 10.844 6.552 7.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 9.366 5.728 7.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 10.690 4.973 6.541 1.00 0.00 H new ATOM 165 N LEU A 274 5.989 4.973 0.670 1.00 0.00 N ATOM 166 CA LEU A 274 4.773 4.552 -0.009 1.00 0.00 C ATOM 167 C LEU A 274 4.857 4.840 -1.502 1.00 0.00 C ATOM 168 O LEU A 274 4.613 3.966 -2.328 1.00 0.00 O ATOM 169 CB LEU A 274 3.563 5.266 0.587 1.00 0.00 C ATOM 170 CG LEU A 274 2.978 4.626 1.847 1.00 0.00 C ATOM 171 CD1 LEU A 274 2.434 3.238 1.557 1.00 0.00 C ATOM 172 CD2 LEU A 274 4.008 4.570 2.968 1.00 0.00 C ATOM 0 H LEU A 274 5.846 5.667 1.404 1.00 0.00 H new ATOM 0 HA LEU A 274 4.662 3.477 0.131 1.00 0.00 H new ATOM 0 HB2 LEU A 274 3.846 6.292 0.820 1.00 0.00 H new ATOM 0 HB3 LEU A 274 2.782 5.315 -0.171 1.00 0.00 H new ATOM 0 HG LEU A 274 2.151 5.255 2.176 1.00 0.00 H new ATOM 0 HD11 LEU A 274 2.025 2.809 2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 274 1.648 3.305 0.805 1.00 0.00 H new ATOM 0 HD13 LEU A 274 3.238 2.602 1.186 1.00 0.00 H new ATOM 0 HD21 LEU A 274 3.562 4.110 3.850 1.00 0.00 H new ATOM 0 HD22 LEU A 274 4.865 3.979 2.645 1.00 0.00 H new ATOM 0 HD23 LEU A 274 4.335 5.581 3.212 1.00 0.00 H new ATOM 184 N LYS A 275 5.207 6.073 -1.847 1.00 0.00 N ATOM 185 CA LYS A 275 5.318 6.459 -3.247 1.00 0.00 C ATOM 186 C LYS A 275 6.404 5.644 -3.951 1.00 0.00 C ATOM 187 O LYS A 275 6.354 5.448 -5.166 1.00 0.00 O ATOM 188 CB LYS A 275 5.596 7.968 -3.357 1.00 0.00 C ATOM 189 CG LYS A 275 6.562 8.352 -4.467 1.00 0.00 C ATOM 190 CD LYS A 275 8.006 8.169 -4.028 1.00 0.00 C ATOM 191 CE LYS A 275 8.758 9.491 -4.016 1.00 0.00 C ATOM 192 NZ LYS A 275 10.198 9.321 -3.669 1.00 0.00 N ATOM 0 H LYS A 275 5.417 6.817 -1.182 1.00 0.00 H new ATOM 0 HA LYS A 275 4.372 6.246 -3.746 1.00 0.00 H new ATOM 0 HB2 LYS A 275 4.652 8.488 -3.519 1.00 0.00 H new ATOM 0 HB3 LYS A 275 5.996 8.321 -2.406 1.00 0.00 H new ATOM 0 HG2 LYS A 275 6.367 7.742 -5.349 1.00 0.00 H new ATOM 0 HG3 LYS A 275 6.395 9.390 -4.754 1.00 0.00 H new ATOM 0 HD2 LYS A 275 8.031 7.726 -3.032 1.00 0.00 H new ATOM 0 HD3 LYS A 275 8.506 7.471 -4.700 1.00 0.00 H new ATOM 0 HE2 LYS A 275 8.676 9.962 -4.996 1.00 0.00 H new ATOM 0 HE3 LYS A 275 8.291 10.165 -3.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 275 10.668 10.249 -3.674 1.00 0.00 H new ATOM 0 HZ2 LYS A 275 10.279 8.896 -2.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 275 10.652 8.699 -4.368 1.00 0.00 H new ATOM 206 N ARG A 276 7.392 5.185 -3.187 1.00 0.00 N ATOM 207 CA ARG A 276 8.489 4.403 -3.751 1.00 0.00 C ATOM 208 C ARG A 276 8.115 2.927 -3.868 1.00 0.00 C ATOM 209 O ARG A 276 8.220 2.332 -4.941 1.00 0.00 O ATOM 210 CB ARG A 276 9.751 4.548 -2.892 1.00 0.00 C ATOM 211 CG ARG A 276 10.421 5.908 -3.004 1.00 0.00 C ATOM 212 CD ARG A 276 11.462 5.937 -4.114 1.00 0.00 C ATOM 213 NE ARG A 276 12.598 6.798 -3.778 1.00 0.00 N ATOM 214 CZ ARG A 276 13.823 6.653 -4.285 1.00 0.00 C ATOM 215 NH1 ARG A 276 14.084 5.682 -5.153 1.00 0.00 N ATOM 216 NH2 ARG A 276 14.793 7.480 -3.919 1.00 0.00 N ATOM 0 H ARG A 276 7.456 5.340 -2.181 1.00 0.00 H new ATOM 0 HA ARG A 276 8.688 4.790 -4.750 1.00 0.00 H new ATOM 0 HB2 ARG A 276 9.491 4.367 -1.849 1.00 0.00 H new ATOM 0 HB3 ARG A 276 10.466 3.777 -3.181 1.00 0.00 H new ATOM 0 HG2 ARG A 276 9.666 6.670 -3.194 1.00 0.00 H new ATOM 0 HG3 ARG A 276 10.895 6.159 -2.055 1.00 0.00 H new ATOM 0 HD2 ARG A 276 11.818 4.924 -4.304 1.00 0.00 H new ATOM 0 HD3 ARG A 276 11.000 6.290 -5.036 1.00 0.00 H new ATOM 0 HE ARG A 276 12.442 7.557 -3.114 1.00 0.00 H new ATOM 0 HH11 ARG A 276 13.344 5.040 -5.437 1.00 0.00 H new ATOM 0 HH12 ARG A 276 15.024 5.579 -5.535 1.00 0.00 H new ATOM 0 HH21 ARG A 276 14.602 8.226 -3.250 1.00 0.00 H new ATOM 0 HH22 ARG A 276 15.730 7.370 -4.306 1.00 0.00 H new ATOM 230 N PHE A 277 7.697 2.338 -2.752 1.00 0.00 N ATOM 231 CA PHE A 277 7.330 0.924 -2.714 1.00 0.00 C ATOM 232 C PHE A 277 6.315 0.567 -3.790 1.00 0.00 C ATOM 233 O PHE A 277 6.419 -0.476 -4.435 1.00 0.00 O ATOM 234 CB PHE A 277 6.770 0.548 -1.341 1.00 0.00 C ATOM 235 CG PHE A 277 7.053 -0.878 -0.986 1.00 0.00 C ATOM 236 CD1 PHE A 277 8.351 -1.284 -0.776 1.00 0.00 C ATOM 237 CD2 PHE A 277 6.035 -1.816 -0.885 1.00 0.00 C ATOM 238 CE1 PHE A 277 8.643 -2.594 -0.472 1.00 0.00 C ATOM 239 CE2 PHE A 277 6.320 -3.136 -0.575 1.00 0.00 C ATOM 240 CZ PHE A 277 7.628 -3.524 -0.370 1.00 0.00 C ATOM 0 H PHE A 277 7.603 2.819 -1.858 1.00 0.00 H new ATOM 0 HA PHE A 277 8.241 0.357 -2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 277 7.202 1.202 -0.583 1.00 0.00 H new ATOM 0 HB3 PHE A 277 5.693 0.716 -1.331 1.00 0.00 H new ATOM 0 HD1 PHE A 277 9.152 -0.564 -0.851 1.00 0.00 H new ATOM 0 HD2 PHE A 277 5.011 -1.514 -1.050 1.00 0.00 H new ATOM 0 HE1 PHE A 277 9.668 -2.895 -0.313 1.00 0.00 H new ATOM 0 HE2 PHE A 277 5.521 -3.858 -0.494 1.00 0.00 H new ATOM 0 HZ PHE A 277 7.857 -4.552 -0.131 1.00 0.00 H new ATOM 250 N LEU A 278 5.328 1.428 -3.965 1.00 0.00 N ATOM 251 CA LEU A 278 4.278 1.199 -4.950 1.00 0.00 C ATOM 252 C LEU A 278 4.851 1.073 -6.355 1.00 0.00 C ATOM 253 O LEU A 278 4.309 0.349 -7.192 1.00 0.00 O ATOM 254 CB LEU A 278 3.253 2.329 -4.898 1.00 0.00 C ATOM 255 CG LEU A 278 2.585 2.518 -3.539 1.00 0.00 C ATOM 256 CD1 LEU A 278 1.943 3.892 -3.448 1.00 0.00 C ATOM 257 CD2 LEU A 278 1.557 1.427 -3.297 1.00 0.00 C ATOM 0 H LEU A 278 5.229 2.295 -3.438 1.00 0.00 H new ATOM 0 HA LEU A 278 3.787 0.258 -4.704 1.00 0.00 H new ATOM 0 HB2 LEU A 278 3.744 3.261 -5.180 1.00 0.00 H new ATOM 0 HB3 LEU A 278 2.482 2.137 -5.644 1.00 0.00 H new ATOM 0 HG LEU A 278 3.349 2.446 -2.764 1.00 0.00 H new ATOM 0 HD11 LEU A 278 1.471 4.009 -2.472 1.00 0.00 H new ATOM 0 HD12 LEU A 278 2.706 4.659 -3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 278 1.190 3.994 -4.230 1.00 0.00 H new ATOM 0 HD21 LEU A 278 1.090 1.577 -2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 278 0.795 1.466 -4.075 1.00 0.00 H new ATOM 0 HD23 LEU A 278 2.047 0.454 -3.318 1.00 0.00 H new ATOM 269 N THR A 279 5.938 1.788 -6.617 1.00 0.00 N ATOM 270 CA THR A 279 6.566 1.755 -7.930 1.00 0.00 C ATOM 271 C THR A 279 6.867 0.327 -8.366 1.00 0.00 C ATOM 272 O THR A 279 6.725 -0.004 -9.539 1.00 0.00 O ATOM 273 CB THR A 279 7.854 2.577 -7.936 1.00 0.00 C ATOM 274 OG1 THR A 279 8.897 1.878 -7.281 1.00 0.00 O ATOM 275 CG2 THR A 279 7.711 3.927 -7.268 1.00 0.00 C ATOM 0 H THR A 279 6.401 2.395 -5.940 1.00 0.00 H new ATOM 0 HA THR A 279 5.861 2.191 -8.638 1.00 0.00 H new ATOM 0 HB THR A 279 8.087 2.738 -8.989 1.00 0.00 H new ATOM 0 HG1 THR A 279 8.649 1.721 -6.346 1.00 0.00 H new ATOM 0 HG21 THR A 279 8.663 4.456 -7.309 1.00 0.00 H new ATOM 0 HG22 THR A 279 6.949 4.510 -7.786 1.00 0.00 H new ATOM 0 HG23 THR A 279 7.417 3.789 -6.227 1.00 0.00 H new ATOM 283 N THR A 280 7.285 -0.513 -7.419 1.00 0.00 N ATOM 284 CA THR A 280 7.607 -1.903 -7.731 1.00 0.00 C ATOM 285 C THR A 280 6.364 -2.757 -7.785 1.00 0.00 C ATOM 286 O THR A 280 6.241 -3.630 -8.643 1.00 0.00 O ATOM 287 CB THR A 280 8.591 -2.485 -6.726 1.00 0.00 C ATOM 288 OG1 THR A 280 8.077 -2.412 -5.411 1.00 0.00 O ATOM 289 CG2 THR A 280 9.930 -1.790 -6.749 1.00 0.00 C ATOM 0 H THR A 280 7.407 -0.258 -6.439 1.00 0.00 H new ATOM 0 HA THR A 280 8.074 -1.907 -8.716 1.00 0.00 H new ATOM 0 HB THR A 280 8.733 -3.524 -7.022 1.00 0.00 H new ATOM 0 HG1 THR A 280 7.389 -1.716 -5.367 1.00 0.00 H new ATOM 0 HG21 THR A 280 10.590 -2.247 -6.012 1.00 0.00 H new ATOM 0 HG22 THR A 280 10.372 -1.885 -7.741 1.00 0.00 H new ATOM 0 HG23 THR A 280 9.796 -0.735 -6.511 1.00 0.00 H new ATOM 297 N LEU A 281 5.446 -2.510 -6.872 1.00 0.00 N ATOM 298 CA LEU A 281 4.219 -3.273 -6.835 1.00 0.00 C ATOM 299 C LEU A 281 3.424 -3.082 -8.121 1.00 0.00 C ATOM 300 O LEU A 281 2.734 -3.992 -8.577 1.00 0.00 O ATOM 301 CB LEU A 281 3.382 -2.871 -5.631 1.00 0.00 C ATOM 302 CG LEU A 281 4.134 -2.846 -4.302 1.00 0.00 C ATOM 303 CD1 LEU A 281 3.402 -1.971 -3.298 1.00 0.00 C ATOM 304 CD2 LEU A 281 4.311 -4.259 -3.762 1.00 0.00 C ATOM 0 H LEU A 281 5.527 -1.792 -6.152 1.00 0.00 H new ATOM 0 HA LEU A 281 4.476 -4.329 -6.746 1.00 0.00 H new ATOM 0 HB2 LEU A 281 2.963 -1.881 -5.813 1.00 0.00 H new ATOM 0 HB3 LEU A 281 2.543 -3.561 -5.544 1.00 0.00 H new ATOM 0 HG LEU A 281 5.124 -2.421 -4.469 1.00 0.00 H new ATOM 0 HD11 LEU A 281 3.949 -1.963 -2.355 1.00 0.00 H new ATOM 0 HD12 LEU A 281 3.331 -0.955 -3.685 1.00 0.00 H new ATOM 0 HD13 LEU A 281 2.400 -2.367 -3.132 1.00 0.00 H new ATOM 0 HD21 LEU A 281 4.849 -4.222 -2.815 1.00 0.00 H new ATOM 0 HD22 LEU A 281 3.333 -4.714 -3.606 1.00 0.00 H new ATOM 0 HD23 LEU A 281 4.878 -4.854 -4.478 1.00 0.00 H new ATOM 316 N GLN A 282 3.534 -1.893 -8.706 1.00 0.00 N ATOM 317 CA GLN A 282 2.829 -1.579 -9.943 1.00 0.00 C ATOM 318 C GLN A 282 3.474 -2.260 -11.137 1.00 0.00 C ATOM 319 O GLN A 282 2.791 -2.773 -12.024 1.00 0.00 O ATOM 320 CB GLN A 282 2.822 -0.074 -10.188 1.00 0.00 C ATOM 321 CG GLN A 282 1.925 0.334 -11.344 1.00 0.00 C ATOM 322 CD GLN A 282 1.806 1.838 -11.488 1.00 0.00 C ATOM 323 OE1 GLN A 282 0.713 2.368 -11.689 1.00 0.00 O ATOM 324 NE2 GLN A 282 2.932 2.531 -11.384 1.00 0.00 N ATOM 0 H GLN A 282 4.106 -1.131 -8.342 1.00 0.00 H new ATOM 0 HA GLN A 282 1.808 -1.944 -9.832 1.00 0.00 H new ATOM 0 HB2 GLN A 282 2.492 0.435 -9.282 1.00 0.00 H new ATOM 0 HB3 GLN A 282 3.840 0.261 -10.389 1.00 0.00 H new ATOM 0 HG2 GLN A 282 2.319 -0.086 -12.270 1.00 0.00 H new ATOM 0 HG3 GLN A 282 0.933 -0.093 -11.197 1.00 0.00 H new ATOM 0 HE21 GLN A 282 3.815 2.048 -11.217 1.00 0.00 H new ATOM 0 HE22 GLN A 282 2.915 3.547 -11.471 1.00 0.00 H new ATOM 333 N GLN A 283 4.798 -2.232 -11.169 1.00 0.00 N ATOM 334 CA GLN A 283 5.547 -2.819 -12.268 1.00 0.00 C ATOM 335 C GLN A 283 5.613 -4.334 -12.164 1.00 0.00 C ATOM 336 O GLN A 283 5.763 -5.028 -13.171 1.00 0.00 O ATOM 337 CB GLN A 283 6.960 -2.243 -12.316 1.00 0.00 C ATOM 338 CG GLN A 283 7.713 -2.291 -10.995 1.00 0.00 C ATOM 339 CD GLN A 283 9.082 -1.646 -11.122 1.00 0.00 C ATOM 340 OE1 GLN A 283 9.600 -1.511 -12.229 1.00 0.00 O ATOM 341 NE2 GLN A 283 9.678 -1.238 -10.003 1.00 0.00 N ATOM 0 H GLN A 283 5.376 -1.808 -10.444 1.00 0.00 H new ATOM 0 HA GLN A 283 5.020 -2.569 -13.189 1.00 0.00 H new ATOM 0 HB2 GLN A 283 7.534 -2.788 -13.065 1.00 0.00 H new ATOM 0 HB3 GLN A 283 6.904 -1.207 -12.649 1.00 0.00 H new ATOM 0 HG2 GLN A 283 7.136 -1.778 -10.225 1.00 0.00 H new ATOM 0 HG3 GLN A 283 7.824 -3.327 -10.674 1.00 0.00 H new ATOM 0 HE21 GLN A 283 9.216 -1.367 -9.103 1.00 0.00 H new ATOM 0 HE22 GLN A 283 10.596 -0.796 -10.046 1.00 0.00 H new ATOM 350 N PHE A 284 5.501 -4.848 -10.947 1.00 0.00 N ATOM 351 CA PHE A 284 5.553 -6.281 -10.727 1.00 0.00 C ATOM 352 C PHE A 284 4.469 -6.987 -11.530 1.00 0.00 C ATOM 353 O PHE A 284 4.744 -7.928 -12.275 1.00 0.00 O ATOM 354 CB PHE A 284 5.396 -6.586 -9.241 1.00 0.00 C ATOM 355 CG PHE A 284 6.382 -7.593 -8.729 1.00 0.00 C ATOM 356 CD1 PHE A 284 6.284 -8.921 -9.099 1.00 0.00 C ATOM 357 CD2 PHE A 284 7.404 -7.214 -7.876 1.00 0.00 C ATOM 358 CE1 PHE A 284 7.184 -9.858 -8.628 1.00 0.00 C ATOM 359 CE2 PHE A 284 8.310 -8.145 -7.402 1.00 0.00 C ATOM 360 CZ PHE A 284 8.199 -9.470 -7.779 1.00 0.00 C ATOM 0 H PHE A 284 5.374 -4.293 -10.101 1.00 0.00 H new ATOM 0 HA PHE A 284 6.522 -6.650 -11.063 1.00 0.00 H new ATOM 0 HB2 PHE A 284 5.506 -5.661 -8.675 1.00 0.00 H new ATOM 0 HB3 PHE A 284 4.386 -6.953 -9.058 1.00 0.00 H new ATOM 0 HD1 PHE A 284 5.493 -9.231 -9.766 1.00 0.00 H new ATOM 0 HD2 PHE A 284 7.495 -6.180 -7.577 1.00 0.00 H new ATOM 0 HE1 PHE A 284 7.093 -10.893 -8.924 1.00 0.00 H new ATOM 0 HE2 PHE A 284 9.104 -7.837 -6.738 1.00 0.00 H new ATOM 0 HZ PHE A 284 8.905 -10.199 -7.410 1.00 0.00 H new ATOM 370 N GLY A 285 3.238 -6.518 -11.379 1.00 0.00 N ATOM 371 CA GLY A 285 2.129 -7.104 -12.102 1.00 0.00 C ATOM 372 C GLY A 285 1.684 -6.245 -13.263 1.00 0.00 C ATOM 373 O GLY A 285 0.513 -6.255 -13.643 1.00 0.00 O ATOM 0 H GLY A 285 2.988 -5.741 -10.767 1.00 0.00 H new ATOM 0 HA2 GLY A 285 2.418 -8.088 -12.471 1.00 0.00 H new ATOM 0 HA3 GLY A 285 1.291 -7.252 -11.420 1.00 0.00 H new ATOM 377 N ASN A 286 2.623 -5.500 -13.831 1.00 0.00 N ATOM 378 CA ASN A 286 2.335 -4.624 -14.960 1.00 0.00 C ATOM 379 C ASN A 286 2.151 -5.417 -16.254 1.00 0.00 C ATOM 380 O ASN A 286 2.396 -4.900 -17.344 1.00 0.00 O ATOM 381 CB ASN A 286 3.468 -3.614 -15.131 1.00 0.00 C ATOM 382 CG ASN A 286 2.967 -2.189 -15.251 1.00 0.00 C ATOM 383 OD1 ASN A 286 2.768 -1.501 -14.250 1.00 0.00 O ATOM 384 ND2 ASN A 286 2.762 -1.737 -16.483 1.00 0.00 N ATOM 0 H ASN A 286 3.596 -5.485 -13.526 1.00 0.00 H new ATOM 0 HA ASN A 286 1.402 -4.102 -14.750 1.00 0.00 H new ATOM 0 HB2 ASN A 286 4.145 -3.686 -14.280 1.00 0.00 H new ATOM 0 HB3 ASN A 286 4.045 -3.868 -16.020 1.00 0.00 H new ATOM 0 HD21 ASN A 286 2.426 -0.785 -16.628 1.00 0.00 H new ATOM 0 HD22 ASN A 286 2.940 -2.342 -17.285 1.00 0.00 H new ATOM 391 N ASP A 287 1.728 -6.674 -16.133 1.00 0.00 N ATOM 392 CA ASP A 287 1.526 -7.522 -17.300 1.00 0.00 C ATOM 393 C ASP A 287 0.586 -8.688 -16.995 1.00 0.00 C ATOM 394 O ASP A 287 0.579 -9.687 -17.713 1.00 0.00 O ATOM 395 CB ASP A 287 2.873 -8.055 -17.792 1.00 0.00 C ATOM 396 CG ASP A 287 3.351 -7.352 -19.046 1.00 0.00 C ATOM 397 OD1 ASP A 287 2.501 -6.994 -19.887 1.00 0.00 O ATOM 398 OD2 ASP A 287 4.578 -7.160 -19.187 1.00 0.00 O ATOM 0 H ASP A 287 1.520 -7.124 -15.241 1.00 0.00 H new ATOM 0 HA ASP A 287 1.063 -6.916 -18.078 1.00 0.00 H new ATOM 0 HB2 ASP A 287 3.617 -7.934 -17.005 1.00 0.00 H new ATOM 0 HB3 ASP A 287 2.788 -9.124 -17.988 1.00 0.00 H new ATOM 403 N ILE A 288 -0.214 -8.559 -15.940 1.00 0.00 N ATOM 404 CA ILE A 288 -1.153 -9.606 -15.577 1.00 0.00 C ATOM 405 C ILE A 288 -2.408 -9.513 -16.447 1.00 0.00 C ATOM 406 O ILE A 288 -2.995 -10.528 -16.826 1.00 0.00 O ATOM 407 CB ILE A 288 -1.532 -9.511 -14.086 1.00 0.00 C ATOM 408 CG1 ILE A 288 -0.405 -10.049 -13.214 1.00 0.00 C ATOM 409 CG2 ILE A 288 -2.837 -10.238 -13.811 1.00 0.00 C ATOM 410 CD1 ILE A 288 -0.105 -11.514 -13.431 1.00 0.00 C ATOM 0 H ILE A 288 -0.228 -7.744 -15.327 1.00 0.00 H new ATOM 0 HA ILE A 288 -0.673 -10.570 -15.747 1.00 0.00 H new ATOM 0 HB ILE A 288 -1.681 -8.461 -13.835 1.00 0.00 H new ATOM 0 HG12 ILE A 288 0.498 -9.471 -13.409 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.664 -9.893 -12.167 1.00 0.00 H new ATOM 0 HG21 ILE A 288 -3.083 -10.156 -12.752 1.00 0.00 H new ATOM 0 HG22 ILE A 288 -3.635 -9.791 -14.404 1.00 0.00 H new ATOM 0 HG23 ILE A 288 -2.731 -11.289 -14.079 1.00 0.00 H new ATOM 0 HD11 ILE A 288 0.709 -11.820 -12.773 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.994 -12.104 -13.208 1.00 0.00 H new ATOM 0 HD13 ILE A 288 0.187 -11.676 -14.469 1.00 0.00 H new ATOM 422 N SER A 289 -2.808 -8.281 -16.759 1.00 0.00 N ATOM 423 CA SER A 289 -3.987 -8.035 -17.590 1.00 0.00 C ATOM 424 C SER A 289 -4.159 -6.537 -17.825 1.00 0.00 C ATOM 425 O SER A 289 -3.563 -5.725 -17.117 1.00 0.00 O ATOM 426 CB SER A 289 -5.247 -8.609 -16.928 1.00 0.00 C ATOM 427 OG SER A 289 -5.818 -9.646 -17.712 1.00 0.00 O ATOM 0 H SER A 289 -2.331 -7.435 -16.448 1.00 0.00 H new ATOM 0 HA SER A 289 -3.842 -8.533 -18.548 1.00 0.00 H new ATOM 0 HB2 SER A 289 -4.997 -8.994 -15.939 1.00 0.00 H new ATOM 0 HB3 SER A 289 -5.979 -7.814 -16.785 1.00 0.00 H new ATOM 0 HG SER A 289 -6.618 -9.993 -17.264 1.00 0.00 H new ATOM 433 N PRO A 290 -4.978 -6.143 -18.818 1.00 0.00 N ATOM 434 CA PRO A 290 -5.217 -4.727 -19.124 1.00 0.00 C ATOM 435 C PRO A 290 -5.939 -3.999 -17.987 1.00 0.00 C ATOM 436 O PRO A 290 -6.247 -2.812 -18.101 1.00 0.00 O ATOM 437 CB PRO A 290 -6.104 -4.774 -20.376 1.00 0.00 C ATOM 438 CG PRO A 290 -6.741 -6.120 -20.348 1.00 0.00 C ATOM 439 CD PRO A 290 -5.735 -7.037 -19.715 1.00 0.00 C ATOM 0 HA PRO A 290 -4.285 -4.181 -19.266 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -6.853 -3.983 -20.359 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -5.515 -4.635 -21.282 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -7.668 -6.102 -19.775 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -6.995 -6.453 -21.354 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -6.217 -7.845 -19.165 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -5.089 -7.501 -20.460 1.00 0.00 H new ATOM 447 N GLU A 291 -6.216 -4.715 -16.897 1.00 0.00 N ATOM 448 CA GLU A 291 -6.911 -4.138 -15.756 1.00 0.00 C ATOM 449 C GLU A 291 -5.991 -4.013 -14.542 1.00 0.00 C ATOM 450 O GLU A 291 -6.256 -3.226 -13.631 1.00 0.00 O ATOM 451 CB GLU A 291 -8.131 -5.000 -15.427 1.00 0.00 C ATOM 452 CG GLU A 291 -8.234 -5.422 -13.970 1.00 0.00 C ATOM 453 CD GLU A 291 -9.557 -6.090 -13.654 1.00 0.00 C ATOM 454 OE1 GLU A 291 -9.762 -7.239 -14.097 1.00 0.00 O ATOM 455 OE2 GLU A 291 -10.391 -5.458 -12.972 1.00 0.00 O ATOM 0 H GLU A 291 -5.967 -5.698 -16.784 1.00 0.00 H new ATOM 0 HA GLU A 291 -7.235 -3.130 -16.015 1.00 0.00 H new ATOM 0 HB2 GLU A 291 -9.032 -4.449 -15.696 1.00 0.00 H new ATOM 0 HB3 GLU A 291 -8.106 -5.894 -16.050 1.00 0.00 H new ATOM 0 HG2 GLU A 291 -7.419 -6.106 -13.734 1.00 0.00 H new ATOM 0 HG3 GLU A 291 -8.110 -4.547 -13.332 1.00 0.00 H new ATOM 462 N ILE A 292 -4.902 -4.773 -14.547 1.00 0.00 N ATOM 463 CA ILE A 292 -3.937 -4.715 -13.455 1.00 0.00 C ATOM 464 C ILE A 292 -3.313 -3.348 -13.426 1.00 0.00 C ATOM 465 O ILE A 292 -3.228 -2.707 -12.376 1.00 0.00 O ATOM 466 CB ILE A 292 -2.834 -5.768 -13.596 1.00 0.00 C ATOM 467 CG1 ILE A 292 -3.420 -7.040 -14.200 1.00 0.00 C ATOM 468 CG2 ILE A 292 -2.190 -6.042 -12.237 1.00 0.00 C ATOM 469 CD1 ILE A 292 -4.588 -7.583 -13.422 1.00 0.00 C ATOM 0 H ILE A 292 -4.666 -5.432 -15.289 1.00 0.00 H new ATOM 0 HA ILE A 292 -4.472 -4.921 -12.528 1.00 0.00 H new ATOM 0 HB ILE A 292 -2.056 -5.397 -14.263 1.00 0.00 H new ATOM 0 HG12 ILE A 292 -3.737 -6.836 -15.223 1.00 0.00 H new ATOM 0 HG13 ILE A 292 -2.642 -7.801 -14.253 1.00 0.00 H new ATOM 0 HG21 ILE A 292 -1.407 -6.792 -12.350 1.00 0.00 H new ATOM 0 HG22 ILE A 292 -1.756 -5.121 -11.848 1.00 0.00 H new ATOM 0 HG23 ILE A 292 -2.947 -6.409 -11.543 1.00 0.00 H new ATOM 0 HD11 ILE A 292 -4.958 -8.488 -13.905 1.00 0.00 H new ATOM 0 HD12 ILE A 292 -4.271 -7.818 -12.406 1.00 0.00 H new ATOM 0 HD13 ILE A 292 -5.383 -6.838 -13.391 1.00 0.00 H new ATOM 481 N GLY A 293 -2.913 -2.887 -14.603 1.00 0.00 N ATOM 482 CA GLY A 293 -2.345 -1.559 -14.699 1.00 0.00 C ATOM 483 C GLY A 293 -3.263 -0.561 -14.025 1.00 0.00 C ATOM 484 O GLY A 293 -2.819 0.440 -13.462 1.00 0.00 O ATOM 0 H GLY A 293 -2.971 -3.401 -15.482 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -1.362 -1.539 -14.229 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -2.203 -1.288 -15.745 1.00 0.00 H new ATOM 488 N GLU A 294 -4.558 -0.876 -14.060 1.00 0.00 N ATOM 489 CA GLU A 294 -5.582 -0.058 -13.431 1.00 0.00 C ATOM 490 C GLU A 294 -5.721 -0.446 -11.962 1.00 0.00 C ATOM 491 O GLU A 294 -6.005 0.394 -11.107 1.00 0.00 O ATOM 492 CB GLU A 294 -6.919 -0.254 -14.150 1.00 0.00 C ATOM 493 CG GLU A 294 -7.997 0.731 -13.727 1.00 0.00 C ATOM 494 CD GLU A 294 -9.023 0.973 -14.818 1.00 0.00 C ATOM 495 OE1 GLU A 294 -8.788 1.862 -15.665 1.00 0.00 O ATOM 496 OE2 GLU A 294 -10.058 0.277 -14.826 1.00 0.00 O ATOM 0 H GLU A 294 -4.921 -1.707 -14.527 1.00 0.00 H new ATOM 0 HA GLU A 294 -5.293 0.991 -13.498 1.00 0.00 H new ATOM 0 HB2 GLU A 294 -6.759 -0.163 -15.224 1.00 0.00 H new ATOM 0 HB3 GLU A 294 -7.274 -1.268 -13.965 1.00 0.00 H new ATOM 0 HG2 GLU A 294 -8.500 0.354 -12.837 1.00 0.00 H new ATOM 0 HG3 GLU A 294 -7.532 1.678 -13.453 1.00 0.00 H new ATOM 503 N ARG A 295 -5.518 -1.732 -11.679 1.00 0.00 N ATOM 504 CA ARG A 295 -5.616 -2.243 -10.319 1.00 0.00 C ATOM 505 C ARG A 295 -4.630 -1.545 -9.398 1.00 0.00 C ATOM 506 O ARG A 295 -5.009 -0.969 -8.385 1.00 0.00 O ATOM 507 CB ARG A 295 -5.355 -3.749 -10.293 1.00 0.00 C ATOM 508 CG ARG A 295 -6.466 -4.564 -10.925 1.00 0.00 C ATOM 509 CD ARG A 295 -7.465 -5.046 -9.885 1.00 0.00 C ATOM 510 NE ARG A 295 -7.039 -6.295 -9.254 1.00 0.00 N ATOM 511 CZ ARG A 295 -7.821 -7.039 -8.475 1.00 0.00 C ATOM 512 NH1 ARG A 295 -9.071 -6.669 -8.229 1.00 0.00 N ATOM 513 NH2 ARG A 295 -7.350 -8.158 -7.943 1.00 0.00 N ATOM 0 H ARG A 295 -5.284 -2.438 -12.377 1.00 0.00 H new ATOM 0 HA ARG A 295 -6.627 -2.044 -9.965 1.00 0.00 H new ATOM 0 HB2 ARG A 295 -4.420 -3.957 -10.814 1.00 0.00 H new ATOM 0 HB3 ARG A 295 -5.222 -4.069 -9.260 1.00 0.00 H new ATOM 0 HG2 ARG A 295 -6.981 -3.961 -11.673 1.00 0.00 H new ATOM 0 HG3 ARG A 295 -6.039 -5.421 -11.445 1.00 0.00 H new ATOM 0 HD2 ARG A 295 -7.592 -4.279 -9.121 1.00 0.00 H new ATOM 0 HD3 ARG A 295 -8.437 -5.191 -10.356 1.00 0.00 H new ATOM 0 HE ARG A 295 -6.085 -6.615 -9.421 1.00 0.00 H new ATOM 0 HH11 ARG A 295 -9.438 -5.810 -8.638 1.00 0.00 H new ATOM 0 HH12 ARG A 295 -9.665 -7.244 -7.631 1.00 0.00 H new ATOM 0 HH21 ARG A 295 -6.390 -8.447 -8.131 1.00 0.00 H new ATOM 0 HH22 ARG A 295 -7.947 -8.730 -7.346 1.00 0.00 H new ATOM 527 N VAL A 296 -3.361 -1.585 -9.756 1.00 0.00 N ATOM 528 CA VAL A 296 -2.347 -0.947 -8.942 1.00 0.00 C ATOM 529 C VAL A 296 -2.690 0.510 -8.671 1.00 0.00 C ATOM 530 O VAL A 296 -2.529 0.998 -7.555 1.00 0.00 O ATOM 531 CB VAL A 296 -0.962 -1.028 -9.588 1.00 0.00 C ATOM 532 CG1 VAL A 296 0.086 -0.564 -8.591 1.00 0.00 C ATOM 533 CG2 VAL A 296 -0.685 -2.446 -10.073 1.00 0.00 C ATOM 0 H VAL A 296 -3.011 -2.047 -10.595 1.00 0.00 H new ATOM 0 HA VAL A 296 -2.323 -1.491 -7.998 1.00 0.00 H new ATOM 0 HB VAL A 296 -0.924 -0.373 -10.458 1.00 0.00 H new ATOM 0 HG11 VAL A 296 1.074 -0.621 -9.048 1.00 0.00 H new ATOM 0 HG12 VAL A 296 -0.120 0.466 -8.299 1.00 0.00 H new ATOM 0 HG13 VAL A 296 0.057 -1.204 -7.709 1.00 0.00 H new ATOM 0 HG21 VAL A 296 0.304 -2.488 -10.530 1.00 0.00 H new ATOM 0 HG22 VAL A 296 -0.723 -3.134 -9.228 1.00 0.00 H new ATOM 0 HG23 VAL A 296 -1.437 -2.732 -10.808 1.00 0.00 H new ATOM 543 N ARG A 297 -3.163 1.202 -9.700 1.00 0.00 N ATOM 544 CA ARG A 297 -3.527 2.604 -9.571 1.00 0.00 C ATOM 545 C ARG A 297 -4.751 2.773 -8.677 1.00 0.00 C ATOM 546 O ARG A 297 -4.789 3.664 -7.830 1.00 0.00 O ATOM 547 CB ARG A 297 -3.796 3.208 -10.951 1.00 0.00 C ATOM 548 CG ARG A 297 -3.769 4.728 -10.969 1.00 0.00 C ATOM 549 CD ARG A 297 -2.358 5.271 -10.822 1.00 0.00 C ATOM 550 NE ARG A 297 -2.123 6.417 -11.698 1.00 0.00 N ATOM 551 CZ ARG A 297 -0.985 7.102 -11.731 1.00 0.00 C ATOM 552 NH1 ARG A 297 0.022 6.765 -10.935 1.00 0.00 N ATOM 553 NH2 ARG A 297 -0.853 8.128 -12.561 1.00 0.00 N ATOM 0 H ARG A 297 -3.303 0.813 -10.633 1.00 0.00 H new ATOM 0 HA ARG A 297 -2.692 3.130 -9.107 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -3.052 2.832 -11.654 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -4.769 2.867 -11.304 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -4.201 5.088 -11.903 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -4.392 5.112 -10.161 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -2.188 5.564 -9.786 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -1.640 4.484 -11.053 1.00 0.00 H new ATOM 0 HE ARG A 297 -2.877 6.708 -12.321 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -0.076 5.977 -10.294 1.00 0.00 H new ATOM 0 HH12 ARG A 297 0.894 7.294 -10.964 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -1.625 8.391 -13.174 1.00 0.00 H new ATOM 0 HH22 ARG A 297 0.020 8.654 -12.587 1.00 0.00 H new ATOM 567 N THR A 298 -5.751 1.916 -8.867 1.00 0.00 N ATOM 568 CA THR A 298 -6.974 1.987 -8.069 1.00 0.00 C ATOM 569 C THR A 298 -6.715 1.569 -6.625 1.00 0.00 C ATOM 570 O THR A 298 -7.279 2.147 -5.696 1.00 0.00 O ATOM 571 CB THR A 298 -8.077 1.116 -8.681 1.00 0.00 C ATOM 572 OG1 THR A 298 -9.311 1.332 -8.017 1.00 0.00 O ATOM 573 CG2 THR A 298 -7.780 -0.363 -8.624 1.00 0.00 C ATOM 0 H THR A 298 -5.740 1.169 -9.561 1.00 0.00 H new ATOM 0 HA THR A 298 -7.308 3.025 -8.071 1.00 0.00 H new ATOM 0 HB THR A 298 -8.130 1.416 -9.728 1.00 0.00 H new ATOM 0 HG1 THR A 298 -10.003 0.769 -8.422 1.00 0.00 H new ATOM 0 HG21 THR A 298 -8.603 -0.917 -9.075 1.00 0.00 H new ATOM 0 HG22 THR A 298 -6.860 -0.571 -9.171 1.00 0.00 H new ATOM 0 HG23 THR A 298 -7.662 -0.671 -7.585 1.00 0.00 H new ATOM 581 N LEU A 299 -5.857 0.569 -6.435 1.00 0.00 N ATOM 582 CA LEU A 299 -5.539 0.090 -5.093 1.00 0.00 C ATOM 583 C LEU A 299 -5.008 1.228 -4.226 1.00 0.00 C ATOM 584 O LEU A 299 -5.481 1.440 -3.110 1.00 0.00 O ATOM 585 CB LEU A 299 -4.497 -1.030 -5.153 1.00 0.00 C ATOM 586 CG LEU A 299 -4.896 -2.265 -5.963 1.00 0.00 C ATOM 587 CD1 LEU A 299 -3.710 -3.204 -6.107 1.00 0.00 C ATOM 588 CD2 LEU A 299 -6.069 -2.979 -5.309 1.00 0.00 C ATOM 0 H LEU A 299 -5.373 0.078 -7.187 1.00 0.00 H new ATOM 0 HA LEU A 299 -6.457 -0.298 -4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 299 -3.578 -0.623 -5.574 1.00 0.00 H new ATOM 0 HB3 LEU A 299 -4.269 -1.344 -4.134 1.00 0.00 H new ATOM 0 HG LEU A 299 -5.206 -1.943 -6.957 1.00 0.00 H new ATOM 0 HD11 LEU A 299 -4.007 -4.079 -6.685 1.00 0.00 H new ATOM 0 HD12 LEU A 299 -2.898 -2.688 -6.620 1.00 0.00 H new ATOM 0 HD13 LEU A 299 -3.373 -3.519 -5.119 1.00 0.00 H new ATOM 0 HD21 LEU A 299 -6.338 -3.854 -5.900 1.00 0.00 H new ATOM 0 HD22 LEU A 299 -5.789 -3.292 -4.303 1.00 0.00 H new ATOM 0 HD23 LEU A 299 -6.922 -2.303 -5.254 1.00 0.00 H new ATOM 600 N VAL A 300 -4.018 1.951 -4.741 1.00 0.00 N ATOM 601 CA VAL A 300 -3.425 3.057 -3.998 1.00 0.00 C ATOM 602 C VAL A 300 -4.436 4.172 -3.771 1.00 0.00 C ATOM 603 O VAL A 300 -4.550 4.695 -2.663 1.00 0.00 O ATOM 604 CB VAL A 300 -2.189 3.634 -4.714 1.00 0.00 C ATOM 605 CG1 VAL A 300 -1.540 4.723 -3.871 1.00 0.00 C ATOM 606 CG2 VAL A 300 -1.190 2.530 -5.023 1.00 0.00 C ATOM 0 H VAL A 300 -3.612 1.792 -5.663 1.00 0.00 H new ATOM 0 HA VAL A 300 -3.112 2.651 -3.036 1.00 0.00 H new ATOM 0 HB VAL A 300 -2.513 4.079 -5.655 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -0.669 5.118 -4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -2.256 5.527 -3.701 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -1.230 4.305 -2.913 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -0.323 2.955 -5.529 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -0.872 2.056 -4.094 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -1.658 1.786 -5.668 1.00 0.00 H new ATOM 616 N LEU A 301 -5.169 4.532 -4.819 1.00 0.00 N ATOM 617 CA LEU A 301 -6.169 5.585 -4.717 1.00 0.00 C ATOM 618 C LEU A 301 -7.297 5.166 -3.794 1.00 0.00 C ATOM 619 O LEU A 301 -7.889 5.995 -3.104 1.00 0.00 O ATOM 620 CB LEU A 301 -6.741 5.917 -6.089 1.00 0.00 C ATOM 621 CG LEU A 301 -5.707 6.215 -7.166 1.00 0.00 C ATOM 622 CD1 LEU A 301 -6.269 5.878 -8.535 1.00 0.00 C ATOM 623 CD2 LEU A 301 -5.276 7.671 -7.102 1.00 0.00 C ATOM 0 H LEU A 301 -5.089 4.111 -5.745 1.00 0.00 H new ATOM 0 HA LEU A 301 -5.680 6.469 -4.307 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -7.357 5.081 -6.420 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -7.400 6.780 -5.991 1.00 0.00 H new ATOM 0 HG LEU A 301 -4.828 5.595 -6.991 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -5.522 6.095 -9.298 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -6.529 4.820 -8.571 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -7.161 6.477 -8.720 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -4.537 7.866 -7.879 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -6.143 8.314 -7.256 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -4.839 7.879 -6.125 1.00 0.00 H new ATOM 635 N GLY A 302 -7.590 3.874 -3.785 1.00 0.00 N ATOM 636 CA GLY A 302 -8.648 3.373 -2.941 1.00 0.00 C ATOM 637 C GLY A 302 -8.273 3.439 -1.479 1.00 0.00 C ATOM 638 O GLY A 302 -9.051 3.904 -0.647 1.00 0.00 O ATOM 0 H GLY A 302 -7.114 3.168 -4.346 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -9.555 3.953 -3.111 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -8.874 2.342 -3.213 1.00 0.00 H new ATOM 642 N LEU A 303 -7.075 2.957 -1.164 1.00 0.00 N ATOM 643 CA LEU A 303 -6.573 2.942 0.201 1.00 0.00 C ATOM 644 C LEU A 303 -6.477 4.354 0.771 1.00 0.00 C ATOM 645 O LEU A 303 -6.726 4.576 1.955 1.00 0.00 O ATOM 646 CB LEU A 303 -5.204 2.259 0.216 1.00 0.00 C ATOM 647 CG LEU A 303 -4.403 2.393 1.515 1.00 0.00 C ATOM 648 CD1 LEU A 303 -4.260 1.037 2.192 1.00 0.00 C ATOM 649 CD2 LEU A 303 -3.034 2.995 1.233 1.00 0.00 C ATOM 0 H LEU A 303 -6.427 2.567 -1.849 1.00 0.00 H new ATOM 0 HA LEU A 303 -7.268 2.387 0.831 1.00 0.00 H new ATOM 0 HB2 LEU A 303 -5.346 1.199 0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 303 -4.607 2.667 -0.600 1.00 0.00 H new ATOM 0 HG LEU A 303 -4.942 3.060 2.188 1.00 0.00 H new ATOM 0 HD11 LEU A 303 -3.689 1.149 3.113 1.00 0.00 H new ATOM 0 HD12 LEU A 303 -5.248 0.640 2.424 1.00 0.00 H new ATOM 0 HD13 LEU A 303 -3.741 0.350 1.524 1.00 0.00 H new ATOM 0 HD21 LEU A 303 -2.477 3.084 2.165 1.00 0.00 H new ATOM 0 HD22 LEU A 303 -2.488 2.351 0.544 1.00 0.00 H new ATOM 0 HD23 LEU A 303 -3.155 3.982 0.787 1.00 0.00 H new ATOM 661 N VAL A 304 -6.119 5.303 -0.082 1.00 0.00 N ATOM 662 CA VAL A 304 -5.994 6.693 0.331 1.00 0.00 C ATOM 663 C VAL A 304 -7.363 7.364 0.417 1.00 0.00 C ATOM 664 O VAL A 304 -7.606 8.184 1.304 1.00 0.00 O ATOM 665 CB VAL A 304 -5.105 7.481 -0.645 1.00 0.00 C ATOM 666 CG1 VAL A 304 -3.694 6.915 -0.652 1.00 0.00 C ATOM 667 CG2 VAL A 304 -5.707 7.458 -2.038 1.00 0.00 C ATOM 0 H VAL A 304 -5.910 5.135 -1.066 1.00 0.00 H new ATOM 0 HA VAL A 304 -5.531 6.697 1.318 1.00 0.00 H new ATOM 0 HB VAL A 304 -5.051 8.518 -0.314 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -3.077 7.484 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -3.269 6.984 0.349 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -3.722 5.871 -0.963 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -5.068 8.019 -2.720 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -5.788 6.427 -2.382 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -6.698 7.911 -2.014 1.00 0.00 H new ATOM 677 N ASN A 305 -8.259 7.003 -0.501 1.00 0.00 N ATOM 678 CA ASN A 305 -9.607 7.568 -0.515 1.00 0.00 C ATOM 679 C ASN A 305 -10.458 7.015 0.632 1.00 0.00 C ATOM 680 O ASN A 305 -11.666 7.244 0.677 1.00 0.00 O ATOM 681 CB ASN A 305 -10.300 7.291 -1.856 1.00 0.00 C ATOM 682 CG ASN A 305 -10.253 8.483 -2.794 1.00 0.00 C ATOM 683 OD1 ASN A 305 -10.504 9.617 -2.387 1.00 0.00 O ATOM 684 ND2 ASN A 305 -9.932 8.232 -4.059 1.00 0.00 N ATOM 0 H ASN A 305 -8.077 6.325 -1.241 1.00 0.00 H new ATOM 0 HA ASN A 305 -9.508 8.645 -0.381 1.00 0.00 H new ATOM 0 HB2 ASN A 305 -9.825 6.436 -2.337 1.00 0.00 H new ATOM 0 HB3 ASN A 305 -11.339 7.017 -1.674 1.00 0.00 H new ATOM 0 HD21 ASN A 305 -9.886 8.995 -4.735 1.00 0.00 H new ATOM 0 HD22 ASN A 305 -9.731 7.277 -4.354 1.00 0.00 H new ATOM 691 N SER A 306 -9.830 6.283 1.553 1.00 0.00 N ATOM 692 CA SER A 306 -10.542 5.705 2.688 1.00 0.00 C ATOM 693 C SER A 306 -11.576 4.682 2.223 1.00 0.00 C ATOM 694 O SER A 306 -12.457 4.288 2.987 1.00 0.00 O ATOM 695 CB SER A 306 -11.222 6.811 3.504 1.00 0.00 C ATOM 696 OG SER A 306 -10.633 6.947 4.790 1.00 0.00 O ATOM 0 H SER A 306 -8.831 6.078 1.533 1.00 0.00 H new ATOM 0 HA SER A 306 -9.816 5.192 3.319 1.00 0.00 H new ATOM 0 HB2 SER A 306 -11.149 7.757 2.968 1.00 0.00 H new ATOM 0 HB3 SER A 306 -12.283 6.586 3.611 1.00 0.00 H new ATOM 0 HG SER A 306 -9.663 6.826 4.720 1.00 0.00 H new ATOM 702 N THR A 307 -11.461 4.251 0.967 1.00 0.00 N ATOM 703 CA THR A 307 -12.385 3.272 0.408 1.00 0.00 C ATOM 704 C THR A 307 -11.792 1.862 0.432 1.00 0.00 C ATOM 705 O THR A 307 -12.463 0.893 0.078 1.00 0.00 O ATOM 706 CB THR A 307 -12.760 3.654 -1.023 1.00 0.00 C ATOM 707 OG1 THR A 307 -13.499 2.611 -1.642 1.00 0.00 O ATOM 708 CG2 THR A 307 -11.560 3.957 -1.897 1.00 0.00 C ATOM 0 H THR A 307 -10.737 4.565 0.320 1.00 0.00 H new ATOM 0 HA THR A 307 -13.281 3.272 1.029 1.00 0.00 H new ATOM 0 HB THR A 307 -13.358 4.561 -0.935 1.00 0.00 H new ATOM 0 HG1 THR A 307 -13.311 1.763 -1.188 1.00 0.00 H new ATOM 0 HG21 THR A 307 -11.897 4.221 -2.899 1.00 0.00 H new ATOM 0 HG22 THR A 307 -11.001 4.790 -1.471 1.00 0.00 H new ATOM 0 HG23 THR A 307 -10.917 3.078 -1.950 1.00 0.00 H new ATOM 716 N LEU A 308 -10.534 1.754 0.851 1.00 0.00 N ATOM 717 CA LEU A 308 -9.857 0.464 0.919 1.00 0.00 C ATOM 718 C LEU A 308 -9.511 0.118 2.365 1.00 0.00 C ATOM 719 O LEU A 308 -10.109 0.640 3.307 1.00 0.00 O ATOM 720 CB LEU A 308 -8.585 0.488 0.056 1.00 0.00 C ATOM 721 CG LEU A 308 -8.451 -0.635 -0.978 1.00 0.00 C ATOM 722 CD1 LEU A 308 -7.689 -0.136 -2.195 1.00 0.00 C ATOM 723 CD2 LEU A 308 -7.749 -1.849 -0.385 1.00 0.00 C ATOM 0 H LEU A 308 -9.963 2.545 1.149 1.00 0.00 H new ATOM 0 HA LEU A 308 -10.529 -0.303 0.533 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -8.543 1.443 -0.467 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -7.720 0.450 0.718 1.00 0.00 H new ATOM 0 HG LEU A 308 -9.454 -0.937 -1.280 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.599 -0.942 -2.924 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.226 0.700 -2.643 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -6.695 0.192 -1.892 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -7.669 -2.629 -1.142 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.752 -1.565 -0.050 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -8.323 -2.224 0.462 1.00 0.00 H new ATOM 735 N THR A 309 -8.539 -0.758 2.520 1.00 0.00 N ATOM 736 CA THR A 309 -8.083 -1.191 3.819 1.00 0.00 C ATOM 737 C THR A 309 -6.729 -1.832 3.678 1.00 0.00 C ATOM 738 O THR A 309 -6.361 -2.309 2.607 1.00 0.00 O ATOM 739 CB THR A 309 -9.069 -2.176 4.442 1.00 0.00 C ATOM 740 OG1 THR A 309 -9.901 -2.750 3.447 1.00 0.00 O ATOM 741 CG2 THR A 309 -9.954 -1.541 5.485 1.00 0.00 C ATOM 0 H THR A 309 -8.042 -1.190 1.741 1.00 0.00 H new ATOM 0 HA THR A 309 -8.013 -0.325 4.477 1.00 0.00 H new ATOM 0 HB THR A 309 -8.460 -2.940 4.925 1.00 0.00 H new ATOM 0 HG1 THR A 309 -10.736 -3.059 3.857 1.00 0.00 H new ATOM 0 HG21 THR A 309 -10.633 -2.291 5.891 1.00 0.00 H new ATOM 0 HG22 THR A 309 -9.338 -1.137 6.288 1.00 0.00 H new ATOM 0 HG23 THR A 309 -10.532 -0.736 5.031 1.00 0.00 H new ATOM 749 N ILE A 310 -5.989 -1.829 4.756 1.00 0.00 N ATOM 750 CA ILE A 310 -4.670 -2.399 4.765 1.00 0.00 C ATOM 751 C ILE A 310 -4.721 -3.873 4.406 1.00 0.00 C ATOM 752 O ILE A 310 -4.046 -4.328 3.485 1.00 0.00 O ATOM 753 CB ILE A 310 -4.059 -2.215 6.154 1.00 0.00 C ATOM 754 CG1 ILE A 310 -3.104 -1.028 6.135 1.00 0.00 C ATOM 755 CG2 ILE A 310 -3.375 -3.486 6.629 1.00 0.00 C ATOM 756 CD1 ILE A 310 -3.535 0.077 7.063 1.00 0.00 C ATOM 0 H ILE A 310 -6.284 -1.433 5.649 1.00 0.00 H new ATOM 0 HA ILE A 310 -4.054 -1.892 4.022 1.00 0.00 H new ATOM 0 HB ILE A 310 -4.855 -2.006 6.869 1.00 0.00 H new ATOM 0 HG12 ILE A 310 -2.106 -1.365 6.416 1.00 0.00 H new ATOM 0 HG13 ILE A 310 -3.035 -0.638 5.119 1.00 0.00 H new ATOM 0 HG21 ILE A 310 -2.951 -3.322 7.620 1.00 0.00 H new ATOM 0 HG22 ILE A 310 -4.103 -4.296 6.675 1.00 0.00 H new ATOM 0 HG23 ILE A 310 -2.580 -3.753 5.933 1.00 0.00 H new ATOM 0 HD11 ILE A 310 -2.819 0.897 7.010 1.00 0.00 H new ATOM 0 HD12 ILE A 310 -4.521 0.436 6.768 1.00 0.00 H new ATOM 0 HD13 ILE A 310 -3.578 -0.301 8.084 1.00 0.00 H new ATOM 768 N GLU A 311 -5.530 -4.611 5.149 1.00 0.00 N ATOM 769 CA GLU A 311 -5.686 -6.043 4.930 1.00 0.00 C ATOM 770 C GLU A 311 -6.100 -6.329 3.494 1.00 0.00 C ATOM 771 O GLU A 311 -5.705 -7.335 2.917 1.00 0.00 O ATOM 772 CB GLU A 311 -6.725 -6.622 5.892 1.00 0.00 C ATOM 773 CG GLU A 311 -7.860 -5.659 6.210 1.00 0.00 C ATOM 774 CD GLU A 311 -9.118 -6.364 6.672 1.00 0.00 C ATOM 775 OE1 GLU A 311 -9.007 -7.308 7.480 1.00 0.00 O ATOM 776 OE2 GLU A 311 -10.216 -5.969 6.227 1.00 0.00 O ATOM 0 H GLU A 311 -6.093 -4.240 5.914 1.00 0.00 H new ATOM 0 HA GLU A 311 -4.723 -6.518 5.118 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -7.141 -7.532 5.460 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -6.230 -6.907 6.820 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -7.534 -4.964 6.984 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -8.086 -5.066 5.324 1.00 0.00 H new ATOM 783 N GLU A 312 -6.907 -5.434 2.936 1.00 0.00 N ATOM 784 CA GLU A 312 -7.394 -5.573 1.568 1.00 0.00 C ATOM 785 C GLU A 312 -6.347 -5.131 0.548 1.00 0.00 C ATOM 786 O GLU A 312 -6.050 -5.852 -0.403 1.00 0.00 O ATOM 787 CB GLU A 312 -8.670 -4.747 1.382 1.00 0.00 C ATOM 788 CG GLU A 312 -9.884 -5.328 2.087 1.00 0.00 C ATOM 789 CD GLU A 312 -10.708 -6.224 1.184 1.00 0.00 C ATOM 790 OE1 GLU A 312 -10.286 -7.375 0.943 1.00 0.00 O ATOM 791 OE2 GLU A 312 -11.778 -5.776 0.722 1.00 0.00 O ATOM 0 H GLU A 312 -7.240 -4.597 3.415 1.00 0.00 H new ATOM 0 HA GLU A 312 -7.607 -6.629 1.399 1.00 0.00 H new ATOM 0 HB2 GLU A 312 -8.495 -3.737 1.752 1.00 0.00 H new ATOM 0 HB3 GLU A 312 -8.885 -4.663 0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 312 -9.557 -5.897 2.957 1.00 0.00 H new ATOM 0 HG3 GLU A 312 -10.510 -4.515 2.455 1.00 0.00 H new ATOM 798 N PHE A 313 -5.806 -3.934 0.748 1.00 0.00 N ATOM 799 CA PHE A 313 -4.805 -3.371 -0.154 1.00 0.00 C ATOM 800 C PHE A 313 -3.658 -4.348 -0.397 1.00 0.00 C ATOM 801 O PHE A 313 -3.405 -4.747 -1.531 1.00 0.00 O ATOM 802 CB PHE A 313 -4.264 -2.065 0.438 1.00 0.00 C ATOM 803 CG PHE A 313 -3.247 -1.356 -0.417 1.00 0.00 C ATOM 804 CD1 PHE A 313 -3.644 -0.576 -1.492 1.00 0.00 C ATOM 805 CD2 PHE A 313 -1.893 -1.454 -0.131 1.00 0.00 C ATOM 806 CE1 PHE A 313 -2.711 0.091 -2.262 1.00 0.00 C ATOM 807 CE2 PHE A 313 -0.958 -0.786 -0.900 1.00 0.00 C ATOM 808 CZ PHE A 313 -1.369 -0.013 -1.966 1.00 0.00 C ATOM 0 H PHE A 313 -6.046 -3.330 1.534 1.00 0.00 H new ATOM 0 HA PHE A 313 -5.281 -3.174 -1.114 1.00 0.00 H new ATOM 0 HB2 PHE A 313 -5.101 -1.390 0.617 1.00 0.00 H new ATOM 0 HB3 PHE A 313 -3.815 -2.281 1.408 1.00 0.00 H new ATOM 0 HD1 PHE A 313 -4.694 -0.489 -1.730 1.00 0.00 H new ATOM 0 HD2 PHE A 313 -1.566 -2.059 0.702 1.00 0.00 H new ATOM 0 HE1 PHE A 313 -3.034 0.695 -3.097 1.00 0.00 H new ATOM 0 HE2 PHE A 313 0.093 -0.869 -0.666 1.00 0.00 H new ATOM 0 HZ PHE A 313 -0.640 0.510 -2.568 1.00 0.00 H new ATOM 818 N HIS A 314 -2.967 -4.731 0.668 1.00 0.00 N ATOM 819 CA HIS A 314 -1.844 -5.654 0.553 1.00 0.00 C ATOM 820 C HIS A 314 -2.298 -6.990 -0.003 1.00 0.00 C ATOM 821 O HIS A 314 -1.610 -7.605 -0.817 1.00 0.00 O ATOM 822 CB HIS A 314 -1.187 -5.839 1.912 1.00 0.00 C ATOM 823 CG HIS A 314 -0.204 -4.765 2.214 1.00 0.00 C ATOM 824 ND1 HIS A 314 1.136 -4.872 1.931 1.00 0.00 N ATOM 825 CD2 HIS A 314 -0.372 -3.549 2.776 1.00 0.00 C ATOM 826 CE1 HIS A 314 1.749 -3.770 2.310 1.00 0.00 C ATOM 827 NE2 HIS A 314 0.859 -2.950 2.832 1.00 0.00 N ATOM 0 H HIS A 314 -3.163 -4.419 1.619 1.00 0.00 H new ATOM 0 HA HIS A 314 -1.116 -5.232 -0.139 1.00 0.00 H new ATOM 0 HB2 HIS A 314 -1.955 -5.854 2.685 1.00 0.00 H new ATOM 0 HB3 HIS A 314 -0.686 -6.806 1.942 1.00 0.00 H new ATOM 0 HD1 HIS A 314 1.585 -5.678 1.496 1.00 0.00 H new ATOM 0 HD2 HIS A 314 -1.305 -3.126 3.118 1.00 0.00 H new ATOM 0 HE1 HIS A 314 2.806 -3.571 2.210 1.00 0.00 H new ATOM 836 N SER A 315 -3.460 -7.427 0.444 1.00 0.00 N ATOM 837 CA SER A 315 -4.029 -8.691 -0.008 1.00 0.00 C ATOM 838 C SER A 315 -4.340 -8.656 -1.503 1.00 0.00 C ATOM 839 O SER A 315 -4.058 -9.609 -2.230 1.00 0.00 O ATOM 840 CB SER A 315 -5.307 -8.989 0.764 1.00 0.00 C ATOM 841 OG SER A 315 -5.148 -10.129 1.591 1.00 0.00 O ATOM 0 H SER A 315 -4.034 -6.926 1.123 1.00 0.00 H new ATOM 0 HA SER A 315 -3.293 -9.474 0.174 1.00 0.00 H new ATOM 0 HB2 SER A 315 -5.576 -8.127 1.375 1.00 0.00 H new ATOM 0 HB3 SER A 315 -6.128 -9.154 0.066 1.00 0.00 H new ATOM 0 HG SER A 315 -5.981 -10.299 2.078 1.00 0.00 H new ATOM 847 N LYS A 316 -4.942 -7.561 -1.947 1.00 0.00 N ATOM 848 CA LYS A 316 -5.311 -7.404 -3.349 1.00 0.00 C ATOM 849 C LYS A 316 -4.106 -7.023 -4.199 1.00 0.00 C ATOM 850 O LYS A 316 -3.878 -7.600 -5.262 1.00 0.00 O ATOM 851 CB LYS A 316 -6.396 -6.342 -3.494 1.00 0.00 C ATOM 852 CG LYS A 316 -7.373 -6.626 -4.621 1.00 0.00 C ATOM 853 CD LYS A 316 -8.813 -6.409 -4.182 1.00 0.00 C ATOM 854 CE LYS A 316 -9.172 -4.932 -4.150 1.00 0.00 C ATOM 855 NZ LYS A 316 -10.619 -4.717 -3.868 1.00 0.00 N ATOM 0 H LYS A 316 -5.186 -6.766 -1.356 1.00 0.00 H new ATOM 0 HA LYS A 316 -5.691 -8.363 -3.701 1.00 0.00 H new ATOM 0 HB2 LYS A 316 -6.947 -6.266 -2.556 1.00 0.00 H new ATOM 0 HB3 LYS A 316 -5.925 -5.374 -3.667 1.00 0.00 H new ATOM 0 HG2 LYS A 316 -7.149 -5.979 -5.469 1.00 0.00 H new ATOM 0 HG3 LYS A 316 -7.247 -7.654 -4.962 1.00 0.00 H new ATOM 0 HD2 LYS A 316 -9.484 -6.932 -4.863 1.00 0.00 H new ATOM 0 HD3 LYS A 316 -8.961 -6.842 -3.193 1.00 0.00 H new ATOM 0 HE2 LYS A 316 -8.575 -4.430 -3.388 1.00 0.00 H new ATOM 0 HE3 LYS A 316 -8.917 -4.476 -5.107 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 -10.822 -3.697 -3.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 -11.189 -5.174 -4.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 -10.858 -5.130 -2.944 1.00 0.00 H new ATOM 869 N LEU A 317 -3.334 -6.060 -3.721 1.00 0.00 N ATOM 870 CA LEU A 317 -2.149 -5.609 -4.437 1.00 0.00 C ATOM 871 C LEU A 317 -1.199 -6.761 -4.692 1.00 0.00 C ATOM 872 O LEU A 317 -0.697 -6.925 -5.800 1.00 0.00 O ATOM 873 CB LEU A 317 -1.430 -4.518 -3.652 1.00 0.00 C ATOM 874 CG LEU A 317 -0.821 -3.412 -4.508 1.00 0.00 C ATOM 875 CD1 LEU A 317 -1.475 -2.084 -4.194 1.00 0.00 C ATOM 876 CD2 LEU A 317 0.676 -3.331 -4.287 1.00 0.00 C ATOM 0 H LEU A 317 -3.506 -5.575 -2.840 1.00 0.00 H new ATOM 0 HA LEU A 317 -2.475 -5.204 -5.395 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -2.134 -4.070 -2.951 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -0.639 -4.977 -3.059 1.00 0.00 H new ATOM 0 HG LEU A 317 -1.000 -3.648 -5.557 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -1.030 -1.304 -4.812 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -2.543 -2.146 -4.401 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -1.323 -1.843 -3.142 1.00 0.00 H new ATOM 0 HD21 LEU A 317 1.093 -2.536 -4.906 1.00 0.00 H new ATOM 0 HD22 LEU A 317 0.878 -3.117 -3.237 1.00 0.00 H new ATOM 0 HD23 LEU A 317 1.136 -4.281 -4.558 1.00 0.00 H new ATOM 888 N GLN A 318 -0.955 -7.561 -3.662 1.00 0.00 N ATOM 889 CA GLN A 318 -0.061 -8.699 -3.791 1.00 0.00 C ATOM 890 C GLN A 318 -0.454 -9.558 -4.985 1.00 0.00 C ATOM 891 O GLN A 318 0.391 -10.183 -5.622 1.00 0.00 O ATOM 892 CB GLN A 318 -0.082 -9.541 -2.522 1.00 0.00 C ATOM 893 CG GLN A 318 -1.420 -10.192 -2.238 1.00 0.00 C ATOM 894 CD GLN A 318 -1.332 -11.707 -2.217 1.00 0.00 C ATOM 895 OE1 GLN A 318 -1.296 -12.325 -1.154 1.00 0.00 O ATOM 896 NE2 GLN A 318 -1.295 -12.315 -3.398 1.00 0.00 N ATOM 0 H GLN A 318 -1.362 -7.442 -2.734 1.00 0.00 H new ATOM 0 HA GLN A 318 0.949 -8.319 -3.948 1.00 0.00 H new ATOM 0 HB2 GLN A 318 0.679 -10.317 -2.600 1.00 0.00 H new ATOM 0 HB3 GLN A 318 0.191 -8.911 -1.675 1.00 0.00 H new ATOM 0 HG2 GLN A 318 -1.796 -9.839 -1.278 1.00 0.00 H new ATOM 0 HG3 GLN A 318 -2.140 -9.883 -2.996 1.00 0.00 H new ATOM 0 HE21 GLN A 318 -1.327 -11.765 -4.256 1.00 0.00 H new ATOM 0 HE22 GLN A 318 -1.234 -13.332 -3.446 1.00 0.00 H new ATOM 905 N GLU A 319 -1.747 -9.576 -5.282 1.00 0.00 N ATOM 906 CA GLU A 319 -2.258 -10.348 -6.401 1.00 0.00 C ATOM 907 C GLU A 319 -1.936 -9.654 -7.716 1.00 0.00 C ATOM 908 O GLU A 319 -1.378 -10.263 -8.630 1.00 0.00 O ATOM 909 CB GLU A 319 -3.768 -10.537 -6.265 1.00 0.00 C ATOM 910 CG GLU A 319 -4.334 -11.613 -7.173 1.00 0.00 C ATOM 911 CD GLU A 319 -5.779 -11.934 -6.852 1.00 0.00 C ATOM 912 OE1 GLU A 319 -6.602 -10.995 -6.825 1.00 0.00 O ATOM 913 OE2 GLU A 319 -6.088 -13.123 -6.625 1.00 0.00 O ATOM 0 H GLU A 319 -2.459 -9.064 -4.762 1.00 0.00 H new ATOM 0 HA GLU A 319 -1.777 -11.326 -6.396 1.00 0.00 H new ATOM 0 HB2 GLU A 319 -4.002 -10.788 -5.230 1.00 0.00 H new ATOM 0 HB3 GLU A 319 -4.264 -9.592 -6.484 1.00 0.00 H new ATOM 0 HG2 GLU A 319 -4.258 -11.287 -8.210 1.00 0.00 H new ATOM 0 HG3 GLU A 319 -3.733 -12.518 -7.079 1.00 0.00 H new ATOM 920 N ALA A 320 -2.288 -8.376 -7.806 1.00 0.00 N ATOM 921 CA ALA A 320 -2.033 -7.603 -9.011 1.00 0.00 C ATOM 922 C ALA A 320 -0.540 -7.457 -9.254 1.00 0.00 C ATOM 923 O ALA A 320 -0.078 -7.583 -10.382 1.00 0.00 O ATOM 924 CB ALA A 320 -2.695 -6.239 -8.915 1.00 0.00 C ATOM 0 H ALA A 320 -2.750 -7.856 -7.059 1.00 0.00 H new ATOM 0 HA ALA A 320 -2.463 -8.138 -9.858 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -2.495 -5.673 -9.825 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -3.771 -6.364 -8.795 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -2.295 -5.700 -8.056 1.00 0.00 H new ATOM 930 N THR A 321 0.212 -7.203 -8.186 1.00 0.00 N ATOM 931 CA THR A 321 1.665 -7.053 -8.285 1.00 0.00 C ATOM 932 C THR A 321 2.357 -8.405 -8.471 1.00 0.00 C ATOM 933 O THR A 321 3.519 -8.573 -8.099 1.00 0.00 O ATOM 934 CB THR A 321 2.226 -6.360 -7.044 1.00 0.00 C ATOM 935 OG1 THR A 321 3.603 -6.077 -7.222 1.00 0.00 O ATOM 936 CG2 THR A 321 2.087 -7.180 -5.778 1.00 0.00 C ATOM 0 H THR A 321 -0.159 -7.096 -7.242 1.00 0.00 H new ATOM 0 HA THR A 321 1.865 -6.437 -9.162 1.00 0.00 H new ATOM 0 HB THR A 321 1.639 -5.449 -6.927 1.00 0.00 H new ATOM 0 HG1 THR A 321 4.095 -6.324 -6.411 1.00 0.00 H new ATOM 0 HG21 THR A 321 2.506 -6.626 -4.938 1.00 0.00 H new ATOM 0 HG22 THR A 321 1.033 -7.382 -5.589 1.00 0.00 H new ATOM 0 HG23 THR A 321 2.622 -8.123 -5.894 1.00 0.00 H new ATOM 1049 N PHE A 328 5.840 -8.835 6.661 1.00 0.00 N ATOM 1050 CA PHE A 328 6.040 -7.558 7.347 1.00 0.00 C ATOM 1051 C PHE A 328 5.757 -6.367 6.430 1.00 0.00 C ATOM 1052 O PHE A 328 6.017 -5.221 6.799 1.00 0.00 O ATOM 1053 CB PHE A 328 7.463 -7.458 7.900 1.00 0.00 C ATOM 1054 CG PHE A 328 8.524 -7.668 6.863 1.00 0.00 C ATOM 1055 CD1 PHE A 328 8.926 -6.628 6.041 1.00 0.00 C ATOM 1056 CD2 PHE A 328 9.119 -8.908 6.710 1.00 0.00 C ATOM 1057 CE1 PHE A 328 9.904 -6.823 5.086 1.00 0.00 C ATOM 1058 CE2 PHE A 328 10.098 -9.109 5.756 1.00 0.00 C ATOM 1059 CZ PHE A 328 10.491 -8.065 4.943 1.00 0.00 C ATOM 0 HA PHE A 328 5.329 -7.525 8.173 1.00 0.00 H new ATOM 0 HB2 PHE A 328 7.599 -6.477 8.354 1.00 0.00 H new ATOM 0 HB3 PHE A 328 7.589 -8.196 8.692 1.00 0.00 H new ATOM 0 HD1 PHE A 328 8.470 -5.655 6.148 1.00 0.00 H new ATOM 0 HD2 PHE A 328 8.815 -9.728 7.344 1.00 0.00 H new ATOM 0 HE1 PHE A 328 10.210 -6.005 4.451 1.00 0.00 H new ATOM 0 HE2 PHE A 328 10.555 -10.081 5.647 1.00 0.00 H new ATOM 0 HZ PHE A 328 11.256 -8.219 4.196 1.00 0.00 H new ATOM 1069 N VAL A 329 5.211 -6.638 5.248 1.00 0.00 N ATOM 1070 CA VAL A 329 4.878 -5.585 4.301 1.00 0.00 C ATOM 1071 C VAL A 329 3.553 -4.910 4.671 1.00 0.00 C ATOM 1072 O VAL A 329 3.486 -3.688 4.797 1.00 0.00 O ATOM 1073 CB VAL A 329 4.793 -6.142 2.865 1.00 0.00 C ATOM 1074 CG1 VAL A 329 4.645 -5.017 1.850 1.00 0.00 C ATOM 1075 CG2 VAL A 329 6.023 -6.977 2.558 1.00 0.00 C ATOM 0 H VAL A 329 4.991 -7.580 4.925 1.00 0.00 H new ATOM 0 HA VAL A 329 5.674 -4.842 4.345 1.00 0.00 H new ATOM 0 HB VAL A 329 3.909 -6.775 2.794 1.00 0.00 H new ATOM 0 HG11 VAL A 329 4.587 -5.438 0.846 1.00 0.00 H new ATOM 0 HG12 VAL A 329 3.735 -4.454 2.060 1.00 0.00 H new ATOM 0 HG13 VAL A 329 5.506 -4.352 1.916 1.00 0.00 H new ATOM 0 HG21 VAL A 329 5.954 -7.366 1.542 1.00 0.00 H new ATOM 0 HG22 VAL A 329 6.915 -6.358 2.650 1.00 0.00 H new ATOM 0 HG23 VAL A 329 6.084 -7.808 3.261 1.00 0.00 H new ATOM 1085 N ILE A 330 2.501 -5.716 4.841 1.00 0.00 N ATOM 1086 CA ILE A 330 1.178 -5.194 5.185 1.00 0.00 C ATOM 1087 C ILE A 330 1.190 -4.334 6.450 1.00 0.00 C ATOM 1088 O ILE A 330 0.460 -3.348 6.523 1.00 0.00 O ATOM 1089 CB ILE A 330 0.120 -6.327 5.309 1.00 0.00 C ATOM 1090 CG1 ILE A 330 -1.299 -5.773 5.187 1.00 0.00 C ATOM 1091 CG2 ILE A 330 0.251 -7.108 6.611 1.00 0.00 C ATOM 1092 CD1 ILE A 330 -2.330 -6.861 5.042 1.00 0.00 C ATOM 0 H ILE A 330 2.541 -6.731 4.746 1.00 0.00 H new ATOM 0 HA ILE A 330 0.892 -4.548 4.355 1.00 0.00 H new ATOM 0 HB ILE A 330 0.313 -7.014 4.485 1.00 0.00 H new ATOM 0 HG12 ILE A 330 -1.529 -5.173 6.068 1.00 0.00 H new ATOM 0 HG13 ILE A 330 -1.353 -5.108 4.325 1.00 0.00 H new ATOM 0 HG21 ILE A 330 -0.511 -7.886 6.647 1.00 0.00 H new ATOM 0 HG22 ILE A 330 1.239 -7.565 6.663 1.00 0.00 H new ATOM 0 HG23 ILE A 330 0.119 -6.432 7.456 1.00 0.00 H new ATOM 0 HD11 ILE A 330 -3.321 -6.415 4.959 1.00 0.00 H new ATOM 0 HD12 ILE A 330 -2.119 -7.445 4.146 1.00 0.00 H new ATOM 0 HD13 ILE A 330 -2.297 -7.512 5.916 1.00 0.00 H new ATOM 1104 N PRO A 331 2.013 -4.679 7.462 1.00 0.00 N ATOM 1105 CA PRO A 331 2.093 -3.916 8.714 1.00 0.00 C ATOM 1106 C PRO A 331 2.748 -2.550 8.538 1.00 0.00 C ATOM 1107 O PRO A 331 2.371 -1.584 9.201 1.00 0.00 O ATOM 1108 CB PRO A 331 2.934 -4.812 9.640 1.00 0.00 C ATOM 1109 CG PRO A 331 3.018 -6.131 8.946 1.00 0.00 C ATOM 1110 CD PRO A 331 2.927 -5.823 7.483 1.00 0.00 C ATOM 0 HA PRO A 331 1.101 -3.694 9.108 1.00 0.00 H new ATOM 0 HB2 PRO A 331 3.926 -4.389 9.801 1.00 0.00 H new ATOM 0 HB3 PRO A 331 2.467 -4.913 10.620 1.00 0.00 H new ATOM 0 HG2 PRO A 331 3.953 -6.639 9.182 1.00 0.00 H new ATOM 0 HG3 PRO A 331 2.209 -6.791 9.259 1.00 0.00 H new ATOM 0 HD2 PRO A 331 3.900 -5.574 7.058 1.00 0.00 H new ATOM 0 HD3 PRO A 331 2.537 -6.666 6.913 1.00 0.00 H new ATOM 1118 N PHE A 332 3.729 -2.468 7.649 1.00 0.00 N ATOM 1119 CA PHE A 332 4.429 -1.211 7.403 1.00 0.00 C ATOM 1120 C PHE A 332 3.463 -0.130 6.937 1.00 0.00 C ATOM 1121 O PHE A 332 3.436 0.971 7.485 1.00 0.00 O ATOM 1122 CB PHE A 332 5.551 -1.432 6.383 1.00 0.00 C ATOM 1123 CG PHE A 332 5.485 -0.568 5.149 1.00 0.00 C ATOM 1124 CD1 PHE A 332 4.772 -0.974 4.033 1.00 0.00 C ATOM 1125 CD2 PHE A 332 6.169 0.635 5.101 1.00 0.00 C ATOM 1126 CE1 PHE A 332 4.741 -0.195 2.894 1.00 0.00 C ATOM 1127 CE2 PHE A 332 6.141 1.418 3.967 1.00 0.00 C ATOM 1128 CZ PHE A 332 5.429 1.003 2.861 1.00 0.00 C ATOM 0 H PHE A 332 4.058 -3.253 7.087 1.00 0.00 H new ATOM 0 HA PHE A 332 4.873 -0.867 8.337 1.00 0.00 H new ATOM 0 HB2 PHE A 332 6.507 -1.258 6.877 1.00 0.00 H new ATOM 0 HB3 PHE A 332 5.537 -2.477 6.075 1.00 0.00 H new ATOM 0 HD1 PHE A 332 4.234 -1.910 4.054 1.00 0.00 H new ATOM 0 HD2 PHE A 332 6.731 0.964 5.963 1.00 0.00 H new ATOM 0 HE1 PHE A 332 4.180 -0.521 2.030 1.00 0.00 H new ATOM 0 HE2 PHE A 332 6.676 2.356 3.944 1.00 0.00 H new ATOM 0 HZ PHE A 332 5.409 1.614 1.970 1.00 0.00 H new ATOM 1138 N LEU A 333 2.672 -0.453 5.924 1.00 0.00 N ATOM 1139 CA LEU A 333 1.700 0.491 5.389 1.00 0.00 C ATOM 1140 C LEU A 333 0.762 0.968 6.499 1.00 0.00 C ATOM 1141 O LEU A 333 0.335 2.118 6.506 1.00 0.00 O ATOM 1142 CB LEU A 333 0.911 -0.162 4.250 1.00 0.00 C ATOM 1143 CG LEU A 333 0.527 0.741 3.069 1.00 0.00 C ATOM 1144 CD1 LEU A 333 -0.331 -0.027 2.071 1.00 0.00 C ATOM 1145 CD2 LEU A 333 -0.212 1.975 3.546 1.00 0.00 C ATOM 0 H LEU A 333 2.684 -1.359 5.456 1.00 0.00 H new ATOM 0 HA LEU A 333 2.225 1.359 4.991 1.00 0.00 H new ATOM 0 HB2 LEU A 333 1.498 -0.995 3.864 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -0.004 -0.583 4.668 1.00 0.00 H new ATOM 0 HG LEU A 333 1.446 1.060 2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 333 -0.595 0.627 1.240 1.00 0.00 H new ATOM 0 HD12 LEU A 333 0.227 -0.884 1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 333 -1.240 -0.373 2.563 1.00 0.00 H new ATOM 0 HD21 LEU A 333 -0.472 2.597 2.690 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -1.122 1.676 4.067 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.425 2.541 4.225 1.00 0.00 H new ATOM 1157 N LYS A 334 0.460 0.076 7.446 1.00 0.00 N ATOM 1158 CA LYS A 334 -0.419 0.410 8.570 1.00 0.00 C ATOM 1159 C LYS A 334 0.217 1.453 9.481 1.00 0.00 C ATOM 1160 O LYS A 334 -0.469 2.313 10.029 1.00 0.00 O ATOM 1161 CB LYS A 334 -0.752 -0.838 9.391 1.00 0.00 C ATOM 1162 CG LYS A 334 -1.382 -1.948 8.578 1.00 0.00 C ATOM 1163 CD LYS A 334 -0.945 -3.317 9.068 1.00 0.00 C ATOM 1164 CE LYS A 334 -2.087 -4.113 9.666 1.00 0.00 C ATOM 1165 NZ LYS A 334 -1.714 -4.671 10.990 1.00 0.00 N ATOM 0 H LYS A 334 0.811 -0.882 7.457 1.00 0.00 H new ATOM 0 HA LYS A 334 -1.336 0.822 8.149 1.00 0.00 H new ATOM 0 HB2 LYS A 334 0.161 -1.212 9.855 1.00 0.00 H new ATOM 0 HB3 LYS A 334 -1.430 -0.561 10.199 1.00 0.00 H new ATOM 0 HG2 LYS A 334 -2.468 -1.870 8.635 1.00 0.00 H new ATOM 0 HG3 LYS A 334 -1.109 -1.832 7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 334 -0.513 -3.875 8.237 1.00 0.00 H new ATOM 0 HD3 LYS A 334 -0.160 -3.198 9.814 1.00 0.00 H new ATOM 0 HE2 LYS A 334 -2.964 -3.474 9.771 1.00 0.00 H new ATOM 0 HE3 LYS A 334 -2.362 -4.923 8.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 334 -2.514 -5.211 11.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 334 -0.892 -5.299 10.883 1.00 0.00 H new ATOM 0 HZ3 LYS A 334 -1.475 -3.894 11.639 1.00 0.00 H new ATOM 1179 N ALA A 335 1.530 1.365 9.643 1.00 0.00 N ATOM 1180 CA ALA A 335 2.253 2.300 10.490 1.00 0.00 C ATOM 1181 C ALA A 335 2.453 3.624 9.777 1.00 0.00 C ATOM 1182 O ALA A 335 2.400 4.689 10.389 1.00 0.00 O ATOM 1183 CB ALA A 335 3.599 1.719 10.884 1.00 0.00 C ATOM 0 H ALA A 335 2.114 0.656 9.199 1.00 0.00 H new ATOM 0 HA ALA A 335 1.662 2.473 11.389 1.00 0.00 H new ATOM 0 HB1 ALA A 335 4.130 2.429 11.518 1.00 0.00 H new ATOM 0 HB2 ALA A 335 3.448 0.788 11.430 1.00 0.00 H new ATOM 0 HB3 ALA A 335 4.187 1.523 9.987 1.00 0.00 H new ATOM 1189 N ASN A 336 2.714 3.542 8.483 1.00 0.00 N ATOM 1190 CA ASN A 336 2.957 4.722 7.685 1.00 0.00 C ATOM 1191 C ASN A 336 1.658 5.299 7.112 1.00 0.00 C ATOM 1192 O ASN A 336 1.644 6.417 6.601 1.00 0.00 O ATOM 1193 CB ASN A 336 3.909 4.360 6.550 1.00 0.00 C ATOM 1194 CG ASN A 336 5.174 3.678 7.035 1.00 0.00 C ATOM 1195 OD1 ASN A 336 5.378 3.488 8.234 1.00 0.00 O ATOM 1196 ND2 ASN A 336 6.030 3.307 6.094 1.00 0.00 N ATOM 0 H ASN A 336 2.762 2.665 7.965 1.00 0.00 H new ATOM 0 HA ASN A 336 3.399 5.487 8.324 1.00 0.00 H new ATOM 0 HB2 ASN A 336 3.395 3.704 5.847 1.00 0.00 H new ATOM 0 HB3 ASN A 336 4.177 5.265 6.004 1.00 0.00 H new ATOM 0 HD21 ASN A 336 6.901 2.843 6.351 1.00 0.00 H new ATOM 0 HD22 ASN A 336 5.818 3.486 5.112 1.00 0.00 H new ATOM 1203 N LEU A 337 0.572 4.530 7.197 1.00 0.00 N ATOM 1204 CA LEU A 337 -0.730 4.966 6.678 1.00 0.00 C ATOM 1205 C LEU A 337 -1.171 6.306 7.268 1.00 0.00 C ATOM 1206 O LEU A 337 -1.690 7.158 6.552 1.00 0.00 O ATOM 1207 CB LEU A 337 -1.811 3.919 6.975 1.00 0.00 C ATOM 1208 CG LEU A 337 -3.023 3.913 6.024 1.00 0.00 C ATOM 1209 CD1 LEU A 337 -3.909 5.131 6.237 1.00 0.00 C ATOM 1210 CD2 LEU A 337 -2.570 3.841 4.578 1.00 0.00 C ATOM 0 H LEU A 337 0.566 3.602 7.620 1.00 0.00 H new ATOM 0 HA LEU A 337 -0.608 5.085 5.601 1.00 0.00 H new ATOM 0 HB2 LEU A 337 -1.350 2.932 6.950 1.00 0.00 H new ATOM 0 HB3 LEU A 337 -2.172 4.076 7.991 1.00 0.00 H new ATOM 0 HG LEU A 337 -3.613 3.025 6.254 1.00 0.00 H new ATOM 0 HD11 LEU A 337 -4.753 5.092 5.549 1.00 0.00 H new ATOM 0 HD12 LEU A 337 -4.277 5.138 7.263 1.00 0.00 H new ATOM 0 HD13 LEU A 337 -3.332 6.037 6.052 1.00 0.00 H new ATOM 0 HD21 LEU A 337 -3.442 3.838 3.923 1.00 0.00 H new ATOM 0 HD22 LEU A 337 -1.947 4.705 4.348 1.00 0.00 H new ATOM 0 HD23 LEU A 337 -1.996 2.928 4.422 1.00 0.00 H new ATOM 1222 N PRO A 338 -0.992 6.504 8.590 1.00 0.00 N ATOM 1223 CA PRO A 338 -1.400 7.743 9.264 1.00 0.00 C ATOM 1224 C PRO A 338 -0.791 8.968 8.617 1.00 0.00 C ATOM 1225 O PRO A 338 -1.384 10.044 8.617 1.00 0.00 O ATOM 1226 CB PRO A 338 -0.870 7.573 10.690 1.00 0.00 C ATOM 1227 CG PRO A 338 -0.748 6.103 10.876 1.00 0.00 C ATOM 1228 CD PRO A 338 -0.386 5.545 9.529 1.00 0.00 C ATOM 0 HA PRO A 338 -2.478 7.896 9.217 1.00 0.00 H new ATOM 0 HB2 PRO A 338 0.092 8.069 10.816 1.00 0.00 H new ATOM 0 HB3 PRO A 338 -1.552 8.009 11.420 1.00 0.00 H new ATOM 0 HG2 PRO A 338 0.017 5.865 11.615 1.00 0.00 H new ATOM 0 HG3 PRO A 338 -1.684 5.676 11.237 1.00 0.00 H new ATOM 0 HD2 PRO A 338 0.694 5.481 9.397 1.00 0.00 H new ATOM 0 HD3 PRO A 338 -0.784 4.540 9.390 1.00 0.00 H new ATOM 1236 N LEU A 339 0.397 8.797 8.068 1.00 0.00 N ATOM 1237 CA LEU A 339 1.086 9.891 7.418 1.00 0.00 C ATOM 1238 C LEU A 339 0.524 10.129 6.027 1.00 0.00 C ATOM 1239 O LEU A 339 0.212 11.263 5.660 1.00 0.00 O ATOM 1240 CB LEU A 339 2.590 9.596 7.355 1.00 0.00 C ATOM 1241 CG LEU A 339 3.317 9.454 8.710 1.00 0.00 C ATOM 1242 CD1 LEU A 339 4.728 10.042 8.652 1.00 0.00 C ATOM 1243 CD2 LEU A 339 2.559 10.105 9.852 1.00 0.00 C ATOM 0 H LEU A 339 0.903 7.911 8.060 1.00 0.00 H new ATOM 0 HA LEU A 339 0.932 10.799 8.000 1.00 0.00 H new ATOM 0 HB2 LEU A 339 2.734 8.674 6.791 1.00 0.00 H new ATOM 0 HB3 LEU A 339 3.072 10.394 6.790 1.00 0.00 H new ATOM 0 HG LEU A 339 3.374 8.383 8.903 1.00 0.00 H new ATOM 0 HD11 LEU A 339 5.211 9.925 9.622 1.00 0.00 H new ATOM 0 HD12 LEU A 339 5.309 9.519 7.892 1.00 0.00 H new ATOM 0 HD13 LEU A 339 4.671 11.101 8.400 1.00 0.00 H new ATOM 0 HD21 LEU A 339 3.116 9.974 10.780 1.00 0.00 H new ATOM 0 HD22 LEU A 339 2.438 11.169 9.648 1.00 0.00 H new ATOM 0 HD23 LEU A 339 1.578 9.640 9.949 1.00 0.00 H new ATOM 1255 N LEU A 340 0.388 9.064 5.261 1.00 0.00 N ATOM 1256 CA LEU A 340 -0.149 9.171 3.906 1.00 0.00 C ATOM 1257 C LEU A 340 -1.564 9.736 3.909 1.00 0.00 C ATOM 1258 O LEU A 340 -1.888 10.633 3.130 1.00 0.00 O ATOM 1259 CB LEU A 340 -0.140 7.813 3.190 1.00 0.00 C ATOM 1260 CG LEU A 340 0.519 6.667 3.960 1.00 0.00 C ATOM 1261 CD1 LEU A 340 0.100 5.323 3.394 1.00 0.00 C ATOM 1262 CD2 LEU A 340 2.030 6.830 3.941 1.00 0.00 C ATOM 0 H LEU A 340 0.638 8.117 5.546 1.00 0.00 H new ATOM 0 HA LEU A 340 0.501 9.858 3.364 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -1.169 7.533 2.967 1.00 0.00 H new ATOM 0 HB3 LEU A 340 0.373 7.929 2.235 1.00 0.00 H new ATOM 0 HG LEU A 340 0.184 6.701 4.997 1.00 0.00 H new ATOM 0 HD11 LEU A 340 0.582 4.524 3.958 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -0.982 5.218 3.469 1.00 0.00 H new ATOM 0 HD13 LEU A 340 0.399 5.260 2.348 1.00 0.00 H new ATOM 0 HD21 LEU A 340 2.491 6.010 4.491 1.00 0.00 H new ATOM 0 HD22 LEU A 340 2.384 6.820 2.910 1.00 0.00 H new ATOM 0 HD23 LEU A 340 2.300 7.777 4.408 1.00 0.00 H new ATOM 1274 N GLN A 341 -2.412 9.189 4.766 1.00 0.00 N ATOM 1275 CA GLN A 341 -3.799 9.623 4.844 1.00 0.00 C ATOM 1276 C GLN A 341 -3.923 11.044 5.381 1.00 0.00 C ATOM 1277 O GLN A 341 -4.635 11.872 4.817 1.00 0.00 O ATOM 1278 CB GLN A 341 -4.595 8.663 5.720 1.00 0.00 C ATOM 1279 CG GLN A 341 -6.076 8.649 5.394 1.00 0.00 C ATOM 1280 CD GLN A 341 -6.619 7.246 5.226 1.00 0.00 C ATOM 1281 OE1 GLN A 341 -7.588 6.862 5.881 1.00 0.00 O ATOM 1282 NE2 GLN A 341 -5.994 6.469 4.348 1.00 0.00 N ATOM 0 H GLN A 341 -2.165 8.444 5.417 1.00 0.00 H new ATOM 0 HA GLN A 341 -4.204 9.618 3.832 1.00 0.00 H new ATOM 0 HB2 GLN A 341 -4.194 7.656 5.603 1.00 0.00 H new ATOM 0 HB3 GLN A 341 -4.462 8.940 6.766 1.00 0.00 H new ATOM 0 HG2 GLN A 341 -6.625 9.155 6.189 1.00 0.00 H new ATOM 0 HG3 GLN A 341 -6.249 9.214 4.478 1.00 0.00 H new ATOM 0 HE21 GLN A 341 -5.195 6.829 3.827 1.00 0.00 H new ATOM 0 HE22 GLN A 341 -6.314 5.513 4.195 1.00 0.00 H new ATOM 1291 N ARG A 342 -3.245 11.324 6.481 1.00 0.00 N ATOM 1292 CA ARG A 342 -3.303 12.648 7.083 1.00 0.00 C ATOM 1293 C ARG A 342 -2.804 13.722 6.118 1.00 0.00 C ATOM 1294 O ARG A 342 -3.445 14.757 5.943 1.00 0.00 O ATOM 1295 CB ARG A 342 -2.490 12.676 8.374 1.00 0.00 C ATOM 1296 CG ARG A 342 -2.850 13.835 9.284 1.00 0.00 C ATOM 1297 CD ARG A 342 -3.327 13.344 10.640 1.00 0.00 C ATOM 1298 NE ARG A 342 -2.212 12.975 11.506 1.00 0.00 N ATOM 1299 CZ ARG A 342 -2.317 12.134 12.533 1.00 0.00 C ATOM 1300 NH1 ARG A 342 -3.484 11.574 12.825 1.00 0.00 N ATOM 1301 NH2 ARG A 342 -1.252 11.850 13.269 1.00 0.00 N ATOM 0 H ARG A 342 -2.651 10.658 6.974 1.00 0.00 H new ATOM 0 HA ARG A 342 -4.346 12.866 7.314 1.00 0.00 H new ATOM 0 HB2 ARG A 342 -2.642 11.740 8.912 1.00 0.00 H new ATOM 0 HB3 ARG A 342 -1.430 12.733 8.127 1.00 0.00 H new ATOM 0 HG2 ARG A 342 -1.982 14.482 9.414 1.00 0.00 H new ATOM 0 HG3 ARG A 342 -3.630 14.438 8.818 1.00 0.00 H new ATOM 0 HD2 ARG A 342 -3.918 14.123 11.121 1.00 0.00 H new ATOM 0 HD3 ARG A 342 -3.983 12.484 10.505 1.00 0.00 H new ATOM 0 HE ARG A 342 -1.298 13.385 11.313 1.00 0.00 H new ATOM 0 HH11 ARG A 342 -4.307 11.787 12.261 1.00 0.00 H new ATOM 0 HH12 ARG A 342 -3.558 10.931 13.613 1.00 0.00 H new ATOM 0 HH21 ARG A 342 -0.352 12.276 13.049 1.00 0.00 H new ATOM 0 HH22 ARG A 342 -1.333 11.206 14.056 1.00 0.00 H new ATOM 1315 N GLU A 343 -1.653 13.474 5.499 1.00 0.00 N ATOM 1316 CA GLU A 343 -1.073 14.429 4.556 1.00 0.00 C ATOM 1317 C GLU A 343 -1.991 14.655 3.359 1.00 0.00 C ATOM 1318 O GLU A 343 -2.147 15.783 2.896 1.00 0.00 O ATOM 1319 CB GLU A 343 0.293 13.944 4.069 1.00 0.00 C ATOM 1320 CG GLU A 343 1.449 14.781 4.577 1.00 0.00 C ATOM 1321 CD GLU A 343 1.674 16.036 3.760 1.00 0.00 C ATOM 1322 OE1 GLU A 343 2.256 15.929 2.658 1.00 0.00 O ATOM 1323 OE2 GLU A 343 1.278 17.125 4.223 1.00 0.00 O ATOM 0 H GLU A 343 -1.105 12.624 5.632 1.00 0.00 H new ATOM 0 HA GLU A 343 -0.952 15.375 5.083 1.00 0.00 H new ATOM 0 HB2 GLU A 343 0.437 12.911 4.385 1.00 0.00 H new ATOM 0 HB3 GLU A 343 0.304 13.948 2.979 1.00 0.00 H new ATOM 0 HG2 GLU A 343 1.262 15.058 5.614 1.00 0.00 H new ATOM 0 HG3 GLU A 343 2.358 14.180 4.567 1.00 0.00 H new ATOM 1746 N GLU B 16 14.598 1.580 0.793 1.00 0.00 N ATOM 1747 CA GLU B 16 13.191 1.594 1.181 1.00 0.00 C ATOM 1748 C GLU B 16 12.429 0.395 0.620 1.00 0.00 C ATOM 1749 O GLU B 16 11.630 -0.227 1.320 1.00 0.00 O ATOM 1750 CB GLU B 16 12.533 2.893 0.715 1.00 0.00 C ATOM 1751 CG GLU B 16 11.789 3.627 1.818 1.00 0.00 C ATOM 1752 CD GLU B 16 12.703 4.069 2.943 1.00 0.00 C ATOM 1753 OE1 GLU B 16 13.351 5.127 2.800 1.00 0.00 O ATOM 1754 OE2 GLU B 16 12.773 3.356 3.966 1.00 0.00 O ATOM 0 HA GLU B 16 13.151 1.530 2.268 1.00 0.00 H new ATOM 0 HB2 GLU B 16 13.298 3.551 0.304 1.00 0.00 H new ATOM 0 HB3 GLU B 16 11.838 2.669 -0.094 1.00 0.00 H new ATOM 0 HG2 GLU B 16 11.290 4.499 1.396 1.00 0.00 H new ATOM 0 HG3 GLU B 16 11.011 2.978 2.220 1.00 0.00 H new ATOM 1761 N LEU B 17 12.660 0.089 -0.650 1.00 0.00 N ATOM 1762 CA LEU B 17 11.974 -1.019 -1.306 1.00 0.00 C ATOM 1763 C LEU B 17 12.384 -2.371 -0.727 1.00 0.00 C ATOM 1764 O LEU B 17 11.603 -3.318 -0.721 1.00 0.00 O ATOM 1765 CB LEU B 17 12.251 -0.986 -2.809 1.00 0.00 C ATOM 1766 CG LEU B 17 11.072 -0.520 -3.661 1.00 0.00 C ATOM 1767 CD1 LEU B 17 9.913 -1.486 -3.514 1.00 0.00 C ATOM 1768 CD2 LEU B 17 10.639 0.885 -3.266 1.00 0.00 C ATOM 0 H LEU B 17 13.317 0.592 -1.247 1.00 0.00 H new ATOM 0 HA LEU B 17 10.906 -0.898 -1.127 1.00 0.00 H new ATOM 0 HB2 LEU B 17 13.100 -0.328 -2.995 1.00 0.00 H new ATOM 0 HB3 LEU B 17 12.545 -1.984 -3.133 1.00 0.00 H new ATOM 0 HG LEU B 17 11.388 -0.498 -4.704 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.077 -1.146 -4.125 1.00 0.00 H new ATOM 0 HD12 LEU B 17 10.223 -2.478 -3.842 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.605 -1.529 -2.469 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.798 1.195 -3.887 1.00 0.00 H new ATOM 0 HD22 LEU B 17 10.339 0.892 -2.218 1.00 0.00 H new ATOM 0 HD23 LEU B 17 11.470 1.576 -3.410 1.00 0.00 H new ATOM 1780 N SER B 18 13.611 -2.459 -0.255 1.00 0.00 N ATOM 1781 CA SER B 18 14.119 -3.702 0.316 1.00 0.00 C ATOM 1782 C SER B 18 13.619 -3.902 1.742 1.00 0.00 C ATOM 1783 O SER B 18 13.304 -5.021 2.148 1.00 0.00 O ATOM 1784 CB SER B 18 15.646 -3.717 0.288 1.00 0.00 C ATOM 1785 OG SER B 18 16.150 -4.981 0.675 1.00 0.00 O ATOM 0 H SER B 18 14.279 -1.688 -0.253 1.00 0.00 H new ATOM 0 HA SER B 18 13.744 -4.525 -0.293 1.00 0.00 H new ATOM 0 HB2 SER B 18 15.997 -3.474 -0.715 1.00 0.00 H new ATOM 0 HB3 SER B 18 16.033 -2.948 0.956 1.00 0.00 H new ATOM 0 HG SER B 18 17.129 -4.965 0.647 1.00 0.00 H new ATOM 1791 N ASP B 19 13.554 -2.810 2.500 1.00 0.00 N ATOM 1792 CA ASP B 19 13.099 -2.865 3.887 1.00 0.00 C ATOM 1793 C ASP B 19 11.646 -3.324 3.992 1.00 0.00 C ATOM 1794 O ASP B 19 11.121 -3.494 5.094 1.00 0.00 O ATOM 1795 CB ASP B 19 13.262 -1.495 4.547 1.00 0.00 C ATOM 1796 CG ASP B 19 14.447 -1.450 5.489 1.00 0.00 C ATOM 1797 OD1 ASP B 19 14.296 -1.880 6.652 1.00 0.00 O ATOM 1798 OD2 ASP B 19 15.526 -0.990 5.063 1.00 0.00 O ATOM 0 H ASP B 19 13.810 -1.877 2.177 1.00 0.00 H new ATOM 0 HA ASP B 19 13.716 -3.598 4.407 1.00 0.00 H new ATOM 0 HB2 ASP B 19 13.384 -0.735 3.776 1.00 0.00 H new ATOM 0 HB3 ASP B 19 12.354 -1.248 5.097 1.00 0.00 H new ATOM 1803 N LEU B 20 10.995 -3.526 2.851 1.00 0.00 N ATOM 1804 CA LEU B 20 9.609 -3.964 2.839 1.00 0.00 C ATOM 1805 C LEU B 20 9.394 -5.077 1.816 1.00 0.00 C ATOM 1806 O LEU B 20 8.645 -6.018 2.063 1.00 0.00 O ATOM 1807 CB LEU B 20 8.698 -2.780 2.541 1.00 0.00 C ATOM 1808 CG LEU B 20 8.989 -1.528 3.357 1.00 0.00 C ATOM 1809 CD1 LEU B 20 8.390 -0.308 2.670 1.00 0.00 C ATOM 1810 CD2 LEU B 20 8.456 -1.680 4.773 1.00 0.00 C ATOM 0 H LEU B 20 11.406 -3.393 1.927 1.00 0.00 H new ATOM 0 HA LEU B 20 9.363 -4.365 3.822 1.00 0.00 H new ATOM 0 HB2 LEU B 20 8.781 -2.534 1.482 1.00 0.00 H new ATOM 0 HB3 LEU B 20 7.665 -3.080 2.719 1.00 0.00 H new ATOM 0 HG LEU B 20 10.068 -1.388 3.421 1.00 0.00 H new ATOM 0 HD11 LEU B 20 8.603 0.583 3.260 1.00 0.00 H new ATOM 0 HD12 LEU B 20 8.827 -0.198 1.677 1.00 0.00 H new ATOM 0 HD13 LEU B 20 7.311 -0.434 2.580 1.00 0.00 H new ATOM 0 HD21 LEU B 20 8.673 -0.776 5.342 1.00 0.00 H new ATOM 0 HD22 LEU B 20 7.378 -1.839 4.741 1.00 0.00 H new ATOM 0 HD23 LEU B 20 8.935 -2.534 5.252 1.00 0.00 H new ATOM 1822 N LEU B 21 10.052 -4.968 0.667 1.00 0.00 N ATOM 1823 CA LEU B 21 9.923 -5.975 -0.382 1.00 0.00 C ATOM 1824 C LEU B 21 11.072 -6.970 -0.321 1.00 0.00 C ATOM 1825 O LEU B 21 10.928 -8.125 -0.722 1.00 0.00 O ATOM 1826 CB LEU B 21 9.885 -5.317 -1.764 1.00 0.00 C ATOM 1827 CG LEU B 21 8.637 -5.624 -2.585 1.00 0.00 C ATOM 1828 CD1 LEU B 21 8.283 -4.452 -3.485 1.00 0.00 C ATOM 1829 CD2 LEU B 21 8.845 -6.888 -3.402 1.00 0.00 C ATOM 0 H LEU B 21 10.678 -4.196 0.438 1.00 0.00 H new ATOM 0 HA LEU B 21 8.986 -6.507 -0.217 1.00 0.00 H new ATOM 0 HB2 LEU B 21 9.964 -4.237 -1.639 1.00 0.00 H new ATOM 0 HB3 LEU B 21 10.761 -5.637 -2.328 1.00 0.00 H new ATOM 0 HG LEU B 21 7.803 -5.786 -1.902 1.00 0.00 H new ATOM 0 HD11 LEU B 21 7.390 -4.693 -4.061 1.00 0.00 H new ATOM 0 HD12 LEU B 21 8.094 -3.569 -2.875 1.00 0.00 H new ATOM 0 HD13 LEU B 21 9.111 -4.253 -4.165 1.00 0.00 H new ATOM 0 HD21 LEU B 21 7.947 -7.097 -3.984 1.00 0.00 H new ATOM 0 HD22 LEU B 21 9.691 -6.751 -4.076 1.00 0.00 H new ATOM 0 HD23 LEU B 21 9.047 -7.725 -2.733 1.00 0.00 H new