USER MOD reduce.3.24.130724 H: found=0, std=0, add=643, rem=0, adj=13 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 279 THR OG1 : rot -99:sc= 0.905 USER MOD Set 1.2: A 280 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 270 GLN : amide:sc= -5.63! C(o=-5.5!,f=-9.6!) USER MOD Set 2.2: A 273 LYS NZ :NH3+ -140:sc= 0.102 (180deg=0) 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 282 GLN : amide:sc= -1.19 K(o=-1.2,f=-0.046) USER MOD Single : A 283 GLN : amide:sc= 0.0596 X(o=0.06,f=0) USER MOD Single : A 286 ASN : amide:sc= -3.8! K(o=-3.8!,f=-0.98) USER MOD Single : A 289 SER OG : rot 180:sc= -2.96 USER MOD Single : A 298 THR OG1 : rot 180:sc= 0 USER MOD Single : A 305 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 306 SER OG : rot -68:sc= 0.686 USER MOD Single : A 307 THR OG1 : rot -30:sc= 0.925 USER MOD Single : A 309 THR OG1 : rot 180:sc= -0.675 USER MOD Single : A 314 HIS : no HD1:sc= -5.44! C(o=-5.4!,f=-3.3!) USER MOD Single : A 315 SER OG : rot 180:sc= 0 USER MOD Single : A 316 LYS NZ :NH3+ 179:sc= 0.00744 (180deg=0.00728) USER MOD Single : A 318 GLN : amide:sc= -1.13 K(o=-1.1,f=0) USER MOD Single : A 321 THR OG1 : rot -64:sc= 1.11 USER MOD Single : A 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 336 ASN : amide:sc= -17.6! C(o=-18!,f=-25!) USER MOD Single : A 341 GLN : amide:sc= -1.48 K(o=-1.5,f=-2.7!) USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 62 N ALA A 268 4.488 13.537 6.048 1.00 0.00 N ATOM 63 CA ALA A 268 5.161 13.599 4.765 1.00 0.00 C ATOM 64 C ALA A 268 6.248 12.541 4.638 1.00 0.00 C ATOM 65 O ALA A 268 6.637 12.173 3.528 1.00 0.00 O ATOM 66 CB ALA A 268 5.756 14.977 4.558 1.00 0.00 C ATOM 0 HA ALA A 268 4.416 13.400 3.995 1.00 0.00 H new ATOM 0 HB1 ALA A 268 6.260 15.015 3.592 1.00 0.00 H new ATOM 0 HB2 ALA A 268 4.962 15.724 4.583 1.00 0.00 H new ATOM 0 HB3 ALA A 268 6.475 15.186 5.350 1.00 0.00 H new ATOM 72 N ARG A 269 6.756 12.068 5.774 1.00 0.00 N ATOM 73 CA ARG A 269 7.820 11.069 5.790 1.00 0.00 C ATOM 74 C ARG A 269 7.436 9.790 5.068 1.00 0.00 C ATOM 75 O ARG A 269 8.095 9.385 4.110 1.00 0.00 O ATOM 76 CB ARG A 269 8.174 10.733 7.238 1.00 0.00 C ATOM 77 CG ARG A 269 9.036 11.789 7.894 1.00 0.00 C ATOM 78 CD ARG A 269 10.403 11.875 7.241 1.00 0.00 C ATOM 79 NE ARG A 269 11.446 11.305 8.090 1.00 0.00 N ATOM 80 CZ ARG A 269 12.460 11.999 8.600 1.00 0.00 C ATOM 81 NH1 ARG A 269 12.584 13.302 8.358 1.00 0.00 N ATOM 82 NH2 ARG A 269 13.358 11.384 9.358 1.00 0.00 N ATOM 0 H ARG A 269 6.445 12.363 6.700 1.00 0.00 H new ATOM 0 HA ARG A 269 8.673 11.499 5.266 1.00 0.00 H new ATOM 0 HB2 ARG A 269 7.256 10.613 7.813 1.00 0.00 H new ATOM 0 HB3 ARG A 269 8.696 9.776 7.267 1.00 0.00 H new ATOM 0 HG2 ARG A 269 8.539 12.757 7.830 1.00 0.00 H new ATOM 0 HG3 ARG A 269 9.151 11.560 8.953 1.00 0.00 H new ATOM 0 HD2 ARG A 269 10.384 11.349 6.286 1.00 0.00 H new ATOM 0 HD3 ARG A 269 10.638 12.917 7.026 1.00 0.00 H new ATOM 0 HE ARG A 269 11.393 10.310 8.306 1.00 0.00 H new ATOM 0 HH11 ARG A 269 11.897 13.780 7.775 1.00 0.00 H new ATOM 0 HH12 ARG A 269 13.366 13.822 8.755 1.00 0.00 H new ATOM 0 HH21 ARG A 269 13.268 10.386 9.546 1.00 0.00 H new ATOM 0 HH22 ARG A 269 14.138 11.909 9.752 1.00 0.00 H new ATOM 96 N GLN A 270 6.384 9.143 5.543 1.00 0.00 N ATOM 97 CA GLN A 270 5.933 7.889 4.957 1.00 0.00 C ATOM 98 C GLN A 270 5.793 7.965 3.439 1.00 0.00 C ATOM 99 O GLN A 270 6.241 7.068 2.720 1.00 0.00 O ATOM 100 CB GLN A 270 4.603 7.508 5.571 1.00 0.00 C ATOM 101 CG GLN A 270 4.663 7.333 7.068 1.00 0.00 C ATOM 102 CD GLN A 270 5.650 6.298 7.533 1.00 0.00 C ATOM 103 OE1 GLN A 270 6.397 5.716 6.747 1.00 0.00 O ATOM 104 NE2 GLN A 270 5.653 6.072 8.837 1.00 0.00 N ATOM 0 H GLN A 270 5.825 9.465 6.333 1.00 0.00 H new ATOM 0 HA GLN A 270 6.689 7.134 5.170 1.00 0.00 H new ATOM 0 HB2 GLN A 270 3.867 8.276 5.332 1.00 0.00 H new ATOM 0 HB3 GLN A 270 4.254 6.580 5.118 1.00 0.00 H new ATOM 0 HG2 GLN A 270 4.917 8.290 7.524 1.00 0.00 H new ATOM 0 HG3 GLN A 270 3.672 7.061 7.430 1.00 0.00 H new ATOM 0 HE21 GLN A 270 5.012 6.583 9.445 1.00 0.00 H new ATOM 0 HE22 GLN A 270 6.296 5.387 9.234 1.00 0.00 H new ATOM 113 N LEU A 271 5.162 9.034 2.958 1.00 0.00 N ATOM 114 CA LEU A 271 4.951 9.224 1.526 1.00 0.00 C ATOM 115 C LEU A 271 6.201 8.932 0.732 1.00 0.00 C ATOM 116 O LEU A 271 6.131 8.635 -0.454 1.00 0.00 O ATOM 117 CB LEU A 271 4.432 10.637 1.227 1.00 0.00 C ATOM 118 CG LEU A 271 2.916 10.726 0.997 1.00 0.00 C ATOM 119 CD1 LEU A 271 2.600 10.723 -0.491 1.00 0.00 C ATOM 120 CD2 LEU A 271 2.196 9.568 1.677 1.00 0.00 C ATOM 0 H LEU A 271 4.788 9.783 3.541 1.00 0.00 H new ATOM 0 HA LEU A 271 4.190 8.508 1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 271 4.699 11.291 2.057 1.00 0.00 H new ATOM 0 HB3 LEU A 271 4.943 11.018 0.343 1.00 0.00 H new ATOM 0 HG LEU A 271 2.566 11.662 1.433 1.00 0.00 H new ATOM 0 HD11 LEU A 271 1.521 10.787 -0.634 1.00 0.00 H new ATOM 0 HD12 LEU A 271 3.080 11.578 -0.967 1.00 0.00 H new ATOM 0 HD13 LEU A 271 2.972 9.802 -0.940 1.00 0.00 H new ATOM 0 HD21 LEU A 271 1.124 9.652 1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 271 2.558 8.624 1.269 1.00 0.00 H new ATOM 0 HD23 LEU A 271 2.391 9.598 2.749 1.00 0.00 H new ATOM 132 N SER A 272 7.335 9.001 1.398 1.00 0.00 N ATOM 133 CA SER A 272 8.605 8.720 0.755 1.00 0.00 C ATOM 134 C SER A 272 8.708 7.249 0.380 1.00 0.00 C ATOM 135 O SER A 272 9.080 6.916 -0.743 1.00 0.00 O ATOM 136 CB SER A 272 9.778 9.106 1.661 1.00 0.00 C ATOM 137 OG SER A 272 10.967 9.263 0.907 1.00 0.00 O ATOM 0 H SER A 272 7.405 9.249 2.385 1.00 0.00 H new ATOM 0 HA SER A 272 8.653 9.321 -0.153 1.00 0.00 H new ATOM 0 HB2 SER A 272 9.549 10.034 2.184 1.00 0.00 H new ATOM 0 HB3 SER A 272 9.923 8.339 2.422 1.00 0.00 H new ATOM 0 HG SER A 272 11.703 9.511 1.505 1.00 0.00 H new ATOM 143 N LYS A 273 8.386 6.370 1.328 1.00 0.00 N ATOM 144 CA LYS A 273 8.458 4.933 1.089 1.00 0.00 C ATOM 145 C LYS A 273 7.263 4.442 0.290 1.00 0.00 C ATOM 146 O LYS A 273 7.395 3.558 -0.555 1.00 0.00 O ATOM 147 CB LYS A 273 8.535 4.166 2.409 1.00 0.00 C ATOM 148 CG LYS A 273 9.553 4.734 3.374 1.00 0.00 C ATOM 149 CD LYS A 273 8.964 4.974 4.753 1.00 0.00 C ATOM 150 CE LYS A 273 10.069 5.129 5.789 1.00 0.00 C ATOM 151 NZ LYS A 273 9.556 5.084 7.188 1.00 0.00 N ATOM 0 H LYS A 273 8.074 6.628 2.264 1.00 0.00 H new ATOM 0 HA LYS A 273 9.364 4.748 0.511 1.00 0.00 H new ATOM 0 HB2 LYS A 273 7.553 4.172 2.882 1.00 0.00 H new ATOM 0 HB3 LYS A 273 8.782 3.125 2.202 1.00 0.00 H new ATOM 0 HG2 LYS A 273 10.396 4.048 3.455 1.00 0.00 H new ATOM 0 HG3 LYS A 273 9.942 5.672 2.979 1.00 0.00 H new ATOM 0 HD2 LYS A 273 8.344 5.870 4.738 1.00 0.00 H new ATOM 0 HD3 LYS A 273 8.315 4.142 5.027 1.00 0.00 H new ATOM 0 HE2 LYS A 273 10.805 4.337 5.651 1.00 0.00 H new ATOM 0 HE3 LYS A 273 10.585 6.075 5.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 273 10.056 5.791 7.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 273 8.537 5.293 7.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 273 9.717 4.137 7.586 1.00 0.00 H new ATOM 165 N LEU A 274 6.095 5.005 0.578 1.00 0.00 N ATOM 166 CA LEU A 274 4.869 4.609 -0.101 1.00 0.00 C ATOM 167 C LEU A 274 4.974 4.779 -1.611 1.00 0.00 C ATOM 168 O LEU A 274 4.745 3.834 -2.362 1.00 0.00 O ATOM 169 CB LEU A 274 3.692 5.430 0.417 1.00 0.00 C ATOM 170 CG LEU A 274 3.040 4.897 1.688 1.00 0.00 C ATOM 171 CD1 LEU A 274 2.492 3.497 1.465 1.00 0.00 C ATOM 172 CD2 LEU A 274 4.028 4.909 2.846 1.00 0.00 C ATOM 0 H LEU A 274 5.972 5.737 1.277 1.00 0.00 H new ATOM 0 HA LEU A 274 4.709 3.552 0.112 1.00 0.00 H new ATOM 0 HB2 LEU A 274 4.033 6.449 0.602 1.00 0.00 H new ATOM 0 HB3 LEU A 274 2.935 5.485 -0.365 1.00 0.00 H new ATOM 0 HG LEU A 274 2.207 5.552 1.943 1.00 0.00 H new ATOM 0 HD11 LEU A 274 2.031 3.136 2.384 1.00 0.00 H new ATOM 0 HD12 LEU A 274 1.746 3.520 0.670 1.00 0.00 H new ATOM 0 HD13 LEU A 274 3.305 2.829 1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 274 3.542 4.525 3.743 1.00 0.00 H new ATOM 0 HD22 LEU A 274 4.884 4.281 2.600 1.00 0.00 H new ATOM 0 HD23 LEU A 274 4.366 5.930 3.025 1.00 0.00 H new ATOM 184 N LYS A 275 5.316 5.983 -2.059 1.00 0.00 N ATOM 185 CA LYS A 275 5.430 6.232 -3.490 1.00 0.00 C ATOM 186 C LYS A 275 6.518 5.366 -4.109 1.00 0.00 C ATOM 187 O LYS A 275 6.502 5.095 -5.308 1.00 0.00 O ATOM 188 CB LYS A 275 5.721 7.712 -3.764 1.00 0.00 C ATOM 189 CG LYS A 275 6.927 8.257 -3.014 1.00 0.00 C ATOM 190 CD LYS A 275 8.238 7.793 -3.627 1.00 0.00 C ATOM 191 CE LYS A 275 8.773 8.786 -4.644 1.00 0.00 C ATOM 192 NZ LYS A 275 10.028 9.439 -4.178 1.00 0.00 N ATOM 0 H LYS A 275 5.516 6.787 -1.464 1.00 0.00 H new ATOM 0 HA LYS A 275 4.476 5.972 -3.948 1.00 0.00 H new ATOM 0 HB2 LYS A 275 5.880 7.848 -4.834 1.00 0.00 H new ATOM 0 HB3 LYS A 275 4.843 8.300 -3.495 1.00 0.00 H new ATOM 0 HG2 LYS A 275 6.892 9.346 -3.015 1.00 0.00 H new ATOM 0 HG3 LYS A 275 6.881 7.938 -1.973 1.00 0.00 H new ATOM 0 HD2 LYS A 275 8.976 7.649 -2.838 1.00 0.00 H new ATOM 0 HD3 LYS A 275 8.091 6.826 -4.107 1.00 0.00 H new ATOM 0 HE2 LYS A 275 8.960 8.274 -5.588 1.00 0.00 H new ATOM 0 HE3 LYS A 275 8.018 9.548 -4.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 275 10.360 10.109 -4.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 275 9.845 9.950 -3.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 275 10.757 8.715 -4.017 1.00 0.00 H new ATOM 206 N ARG A 276 7.476 4.948 -3.288 1.00 0.00 N ATOM 207 CA ARG A 276 8.579 4.132 -3.772 1.00 0.00 C ATOM 208 C ARG A 276 8.206 2.658 -3.823 1.00 0.00 C ATOM 209 O ARG A 276 8.335 2.010 -4.861 1.00 0.00 O ATOM 210 CB ARG A 276 9.808 4.321 -2.887 1.00 0.00 C ATOM 211 CG ARG A 276 11.116 4.298 -3.661 1.00 0.00 C ATOM 212 CD ARG A 276 11.912 5.579 -3.456 1.00 0.00 C ATOM 213 NE ARG A 276 13.062 5.376 -2.571 1.00 0.00 N ATOM 214 CZ ARG A 276 13.885 6.354 -2.188 1.00 0.00 C ATOM 215 NH1 ARG A 276 13.687 7.595 -2.609 1.00 0.00 N ATOM 216 NH2 ARG A 276 14.907 6.093 -1.378 1.00 0.00 N ATOM 0 H ARG A 276 7.510 5.160 -2.291 1.00 0.00 H new ATOM 0 HA ARG A 276 8.808 4.460 -4.786 1.00 0.00 H new ATOM 0 HB2 ARG A 276 9.724 5.270 -2.358 1.00 0.00 H new ATOM 0 HB3 ARG A 276 9.827 3.536 -2.131 1.00 0.00 H new ATOM 0 HG2 ARG A 276 11.713 3.443 -3.342 1.00 0.00 H new ATOM 0 HG3 ARG A 276 10.909 4.164 -4.723 1.00 0.00 H new ATOM 0 HD2 ARG A 276 12.258 5.949 -4.421 1.00 0.00 H new ATOM 0 HD3 ARG A 276 11.262 6.346 -3.035 1.00 0.00 H new ATOM 0 HE ARG A 276 13.244 4.433 -2.228 1.00 0.00 H new ATOM 0 HH11 ARG A 276 12.904 7.805 -3.228 1.00 0.00 H new ATOM 0 HH12 ARG A 276 14.318 8.340 -2.314 1.00 0.00 H new ATOM 0 HH21 ARG A 276 15.065 5.141 -1.046 1.00 0.00 H new ATOM 0 HH22 ARG A 276 15.533 6.844 -1.088 1.00 0.00 H new ATOM 230 N PHE A 277 7.762 2.117 -2.698 1.00 0.00 N ATOM 231 CA PHE A 277 7.398 0.708 -2.635 1.00 0.00 C ATOM 232 C PHE A 277 6.404 0.328 -3.725 1.00 0.00 C ATOM 233 O PHE A 277 6.529 -0.724 -4.349 1.00 0.00 O ATOM 234 CB PHE A 277 6.815 0.358 -1.272 1.00 0.00 C ATOM 235 CG PHE A 277 7.080 -1.068 -0.911 1.00 0.00 C ATOM 236 CD1 PHE A 277 8.309 -1.439 -0.404 1.00 0.00 C ATOM 237 CD2 PHE A 277 6.118 -2.047 -1.113 1.00 0.00 C ATOM 238 CE1 PHE A 277 8.579 -2.755 -0.100 1.00 0.00 C ATOM 239 CE2 PHE A 277 6.382 -3.370 -0.813 1.00 0.00 C ATOM 240 CZ PHE A 277 7.614 -3.725 -0.305 1.00 0.00 C ATOM 0 H PHE A 277 7.645 2.627 -1.822 1.00 0.00 H new ATOM 0 HA PHE A 277 8.314 0.139 -2.794 1.00 0.00 H new ATOM 0 HB2 PHE A 277 7.244 1.012 -0.513 1.00 0.00 H new ATOM 0 HB3 PHE A 277 5.740 0.539 -1.278 1.00 0.00 H new ATOM 0 HD1 PHE A 277 9.068 -0.688 -0.244 1.00 0.00 H new ATOM 0 HD2 PHE A 277 5.152 -1.772 -1.509 1.00 0.00 H new ATOM 0 HE1 PHE A 277 9.544 -3.030 0.299 1.00 0.00 H new ATOM 0 HE2 PHE A 277 5.626 -4.124 -0.976 1.00 0.00 H new ATOM 0 HZ PHE A 277 7.825 -4.757 -0.068 1.00 0.00 H new ATOM 250 N LEU A 278 5.415 1.179 -3.937 1.00 0.00 N ATOM 251 CA LEU A 278 4.390 0.919 -4.941 1.00 0.00 C ATOM 252 C LEU A 278 4.991 0.746 -6.336 1.00 0.00 C ATOM 253 O LEU A 278 4.472 -0.019 -7.147 1.00 0.00 O ATOM 254 CB LEU A 278 3.354 2.047 -4.952 1.00 0.00 C ATOM 255 CG LEU A 278 2.712 2.345 -3.594 1.00 0.00 C ATOM 256 CD1 LEU A 278 2.111 3.744 -3.584 1.00 0.00 C ATOM 257 CD2 LEU A 278 1.650 1.306 -3.272 1.00 0.00 C ATOM 0 H LEU A 278 5.297 2.056 -3.429 1.00 0.00 H new ATOM 0 HA LEU A 278 3.900 -0.017 -4.671 1.00 0.00 H new ATOM 0 HB2 LEU A 278 3.831 2.956 -5.319 1.00 0.00 H new ATOM 0 HB3 LEU A 278 2.567 1.791 -5.661 1.00 0.00 H new ATOM 0 HG LEU A 278 3.485 2.298 -2.827 1.00 0.00 H new ATOM 0 HD11 LEU A 278 1.659 3.939 -2.611 1.00 0.00 H new ATOM 0 HD12 LEU A 278 2.894 4.478 -3.774 1.00 0.00 H new ATOM 0 HD13 LEU A 278 1.349 3.818 -4.360 1.00 0.00 H new ATOM 0 HD21 LEU A 278 1.203 1.531 -2.304 1.00 0.00 H new ATOM 0 HD22 LEU A 278 0.878 1.324 -4.041 1.00 0.00 H new ATOM 0 HD23 LEU A 278 2.107 0.317 -3.240 1.00 0.00 H new ATOM 269 N THR A 279 6.078 1.468 -6.617 1.00 0.00 N ATOM 270 CA THR A 279 6.731 1.406 -7.928 1.00 0.00 C ATOM 271 C THR A 279 7.024 -0.029 -8.364 1.00 0.00 C ATOM 272 O THR A 279 6.707 -0.418 -9.486 1.00 0.00 O ATOM 273 CB THR A 279 8.028 2.216 -7.929 1.00 0.00 C ATOM 274 OG1 THR A 279 9.059 1.518 -7.253 1.00 0.00 O ATOM 275 CG2 THR A 279 7.887 3.573 -7.282 1.00 0.00 C ATOM 0 H THR A 279 6.525 2.102 -5.955 1.00 0.00 H new ATOM 0 HA THR A 279 6.032 1.838 -8.644 1.00 0.00 H new ATOM 0 HB THR A 279 8.276 2.360 -8.981 1.00 0.00 H new ATOM 0 HG1 THR A 279 9.143 1.863 -6.340 1.00 0.00 H new ATOM 0 HG21 THR A 279 8.844 4.094 -7.317 1.00 0.00 H new ATOM 0 HG22 THR A 279 7.137 4.155 -7.817 1.00 0.00 H new ATOM 0 HG23 THR A 279 7.578 3.451 -6.244 1.00 0.00 H new ATOM 283 N THR A 280 7.639 -0.809 -7.487 1.00 0.00 N ATOM 284 CA THR A 280 7.972 -2.189 -7.816 1.00 0.00 C ATOM 285 C THR A 280 6.718 -3.039 -7.910 1.00 0.00 C ATOM 286 O THR A 280 6.613 -3.925 -8.757 1.00 0.00 O ATOM 287 CB THR A 280 8.901 -2.780 -6.761 1.00 0.00 C ATOM 288 OG1 THR A 280 9.925 -1.865 -6.415 1.00 0.00 O ATOM 289 CG2 THR A 280 9.556 -4.072 -7.202 1.00 0.00 C ATOM 0 H THR A 280 7.916 -0.515 -6.550 1.00 0.00 H new ATOM 0 HA THR A 280 8.475 -2.188 -8.783 1.00 0.00 H new ATOM 0 HB THR A 280 8.265 -2.990 -5.901 1.00 0.00 H new ATOM 0 HG1 THR A 280 10.506 -2.266 -5.736 1.00 0.00 H new ATOM 0 HG21 THR A 280 10.204 -4.441 -6.407 1.00 0.00 H new ATOM 0 HG22 THR A 280 8.788 -4.814 -7.418 1.00 0.00 H new ATOM 0 HG23 THR A 280 10.148 -3.892 -8.099 1.00 0.00 H new ATOM 297 N LEU A 281 5.771 -2.770 -7.024 1.00 0.00 N ATOM 298 CA LEU A 281 4.529 -3.521 -6.996 1.00 0.00 C ATOM 299 C LEU A 281 3.733 -3.314 -8.282 1.00 0.00 C ATOM 300 O LEU A 281 3.257 -4.274 -8.890 1.00 0.00 O ATOM 301 CB LEU A 281 3.679 -3.112 -5.793 1.00 0.00 C ATOM 302 CG LEU A 281 4.427 -2.981 -4.468 1.00 0.00 C ATOM 303 CD1 LEU A 281 3.617 -2.148 -3.491 1.00 0.00 C ATOM 304 CD2 LEU A 281 4.734 -4.352 -3.872 1.00 0.00 C ATOM 0 H LEU A 281 5.840 -2.038 -6.317 1.00 0.00 H new ATOM 0 HA LEU A 281 4.784 -4.577 -6.910 1.00 0.00 H new ATOM 0 HB2 LEU A 281 3.202 -2.158 -6.016 1.00 0.00 H new ATOM 0 HB3 LEU A 281 2.882 -3.845 -5.668 1.00 0.00 H new ATOM 0 HG LEU A 281 5.375 -2.479 -4.660 1.00 0.00 H new ATOM 0 HD11 LEU A 281 4.160 -2.061 -2.550 1.00 0.00 H new ATOM 0 HD12 LEU A 281 3.453 -1.155 -3.908 1.00 0.00 H new ATOM 0 HD13 LEU A 281 2.656 -2.629 -3.312 1.00 0.00 H new ATOM 0 HD21 LEU A 281 5.267 -4.228 -2.929 1.00 0.00 H new ATOM 0 HD22 LEU A 281 3.802 -4.888 -3.694 1.00 0.00 H new ATOM 0 HD23 LEU A 281 5.353 -4.920 -4.566 1.00 0.00 H new ATOM 316 N GLN A 282 3.588 -2.054 -8.686 1.00 0.00 N ATOM 317 CA GLN A 282 2.839 -1.714 -9.897 1.00 0.00 C ATOM 318 C GLN A 282 3.582 -2.141 -11.159 1.00 0.00 C ATOM 319 O GLN A 282 2.964 -2.536 -12.148 1.00 0.00 O ATOM 320 CB GLN A 282 2.570 -0.205 -9.952 1.00 0.00 C ATOM 321 CG GLN A 282 3.835 0.635 -10.033 1.00 0.00 C ATOM 322 CD GLN A 282 3.556 2.124 -9.985 1.00 0.00 C ATOM 323 OE1 GLN A 282 3.234 2.742 -10.999 1.00 0.00 O ATOM 324 NE2 GLN A 282 3.683 2.706 -8.799 1.00 0.00 N ATOM 0 H GLN A 282 3.979 -1.251 -8.194 1.00 0.00 H new ATOM 0 HA GLN A 282 1.894 -2.255 -9.856 1.00 0.00 H new ATOM 0 HB2 GLN A 282 1.943 0.013 -10.817 1.00 0.00 H new ATOM 0 HB3 GLN A 282 2.005 0.088 -9.067 1.00 0.00 H new ATOM 0 HG2 GLN A 282 4.497 0.367 -9.209 1.00 0.00 H new ATOM 0 HG3 GLN A 282 4.364 0.399 -10.956 1.00 0.00 H new ATOM 0 HE21 GLN A 282 3.952 2.153 -7.986 1.00 0.00 H new ATOM 0 HE22 GLN A 282 3.511 3.707 -8.701 1.00 0.00 H new ATOM 333 N GLN A 283 4.903 -2.045 -11.126 1.00 0.00 N ATOM 334 CA GLN A 283 5.725 -2.406 -12.278 1.00 0.00 C ATOM 335 C GLN A 283 5.719 -3.911 -12.532 1.00 0.00 C ATOM 336 O GLN A 283 5.889 -4.352 -13.669 1.00 0.00 O ATOM 337 CB GLN A 283 7.160 -1.925 -12.071 1.00 0.00 C ATOM 338 CG GLN A 283 7.405 -0.508 -12.560 1.00 0.00 C ATOM 339 CD GLN A 283 8.790 -0.002 -12.209 1.00 0.00 C ATOM 340 OE1 GLN A 283 9.733 -0.151 -12.984 1.00 0.00 O ATOM 341 NE2 GLN A 283 8.918 0.599 -11.032 1.00 0.00 N ATOM 0 H GLN A 283 5.431 -1.721 -10.316 1.00 0.00 H new ATOM 0 HA GLN A 283 5.295 -1.917 -13.152 1.00 0.00 H new ATOM 0 HB2 GLN A 283 7.403 -1.981 -11.010 1.00 0.00 H new ATOM 0 HB3 GLN A 283 7.839 -2.602 -12.590 1.00 0.00 H new ATOM 0 HG2 GLN A 283 7.272 -0.473 -13.641 1.00 0.00 H new ATOM 0 HG3 GLN A 283 6.658 0.157 -12.125 1.00 0.00 H new ATOM 0 HE21 GLN A 283 8.108 0.701 -10.421 1.00 0.00 H new ATOM 0 HE22 GLN A 283 9.826 0.959 -10.739 1.00 0.00 H new ATOM 350 N PHE A 284 5.529 -4.701 -11.482 1.00 0.00 N ATOM 351 CA PHE A 284 5.512 -6.148 -11.638 1.00 0.00 C ATOM 352 C PHE A 284 4.224 -6.602 -12.318 1.00 0.00 C ATOM 353 O PHE A 284 4.261 -7.325 -13.313 1.00 0.00 O ATOM 354 CB PHE A 284 5.674 -6.833 -10.283 1.00 0.00 C ATOM 355 CG PHE A 284 6.313 -8.199 -10.366 1.00 0.00 C ATOM 356 CD1 PHE A 284 7.344 -8.447 -11.260 1.00 0.00 C ATOM 357 CD2 PHE A 284 5.877 -9.238 -9.555 1.00 0.00 C ATOM 358 CE1 PHE A 284 7.926 -9.699 -11.340 1.00 0.00 C ATOM 359 CE2 PHE A 284 6.456 -10.490 -9.637 1.00 0.00 C ATOM 360 CZ PHE A 284 7.481 -10.721 -10.528 1.00 0.00 C ATOM 0 H PHE A 284 5.387 -4.370 -10.528 1.00 0.00 H new ATOM 0 HA PHE A 284 6.351 -6.434 -12.272 1.00 0.00 H new ATOM 0 HB2 PHE A 284 6.278 -6.198 -9.635 1.00 0.00 H new ATOM 0 HB3 PHE A 284 4.695 -6.928 -9.814 1.00 0.00 H new ATOM 0 HD1 PHE A 284 7.697 -7.653 -11.901 1.00 0.00 H new ATOM 0 HD2 PHE A 284 5.076 -9.066 -8.852 1.00 0.00 H new ATOM 0 HE1 PHE A 284 8.730 -9.877 -12.039 1.00 0.00 H new ATOM 0 HE2 PHE A 284 6.104 -11.289 -9.001 1.00 0.00 H new ATOM 0 HZ PHE A 284 7.935 -11.699 -10.590 1.00 0.00 H new ATOM 370 N GLY A 285 3.080 -6.159 -11.791 1.00 0.00 N ATOM 371 CA GLY A 285 1.806 -6.521 -12.384 1.00 0.00 C ATOM 372 C GLY A 285 1.427 -5.600 -13.529 1.00 0.00 C ATOM 373 O GLY A 285 0.290 -5.618 -14.008 1.00 0.00 O ATOM 0 H GLY A 285 3.017 -5.559 -10.968 1.00 0.00 H new ATOM 0 HA2 GLY A 285 1.854 -7.548 -12.746 1.00 0.00 H new ATOM 0 HA3 GLY A 285 1.029 -6.488 -11.620 1.00 0.00 H new ATOM 377 N ASN A 286 2.389 -4.786 -13.953 1.00 0.00 N ATOM 378 CA ASN A 286 2.194 -3.829 -15.035 1.00 0.00 C ATOM 379 C ASN A 286 1.541 -4.461 -16.264 1.00 0.00 C ATOM 380 O ASN A 286 0.926 -3.762 -17.067 1.00 0.00 O ATOM 381 CB ASN A 286 3.535 -3.190 -15.417 1.00 0.00 C ATOM 382 CG ASN A 286 4.490 -4.140 -16.127 1.00 0.00 C ATOM 383 OD1 ASN A 286 5.216 -3.732 -17.032 1.00 0.00 O ATOM 384 ND2 ASN A 286 4.506 -5.407 -15.724 1.00 0.00 N ATOM 0 H ASN A 286 3.328 -4.772 -13.554 1.00 0.00 H new ATOM 0 HA ASN A 286 1.512 -3.061 -14.670 1.00 0.00 H new ATOM 0 HB2 ASN A 286 3.347 -2.331 -16.061 1.00 0.00 H new ATOM 0 HB3 ASN A 286 4.017 -2.813 -14.515 1.00 0.00 H new ATOM 0 HD21 ASN A 286 5.135 -6.076 -16.169 1.00 0.00 H new ATOM 0 HD22 ASN A 286 3.890 -5.710 -14.970 1.00 0.00 H new ATOM 391 N ASP A 287 1.680 -5.775 -16.423 1.00 0.00 N ATOM 392 CA ASP A 287 1.100 -6.449 -17.577 1.00 0.00 C ATOM 393 C ASP A 287 0.502 -7.809 -17.216 1.00 0.00 C ATOM 394 O ASP A 287 0.640 -8.773 -17.968 1.00 0.00 O ATOM 395 CB ASP A 287 2.156 -6.608 -18.668 1.00 0.00 C ATOM 396 CG ASP A 287 1.785 -5.872 -19.938 1.00 0.00 C ATOM 397 OD1 ASP A 287 1.938 -4.633 -19.970 1.00 0.00 O ATOM 398 OD2 ASP A 287 1.338 -6.532 -20.899 1.00 0.00 O ATOM 0 H ASP A 287 2.182 -6.385 -15.777 1.00 0.00 H new ATOM 0 HA ASP A 287 0.283 -5.828 -17.944 1.00 0.00 H new ATOM 0 HB2 ASP A 287 3.113 -6.236 -18.301 1.00 0.00 H new ATOM 0 HB3 ASP A 287 2.289 -7.667 -18.890 1.00 0.00 H new ATOM 403 N ILE A 288 -0.186 -7.883 -16.083 1.00 0.00 N ATOM 404 CA ILE A 288 -0.820 -9.126 -15.678 1.00 0.00 C ATOM 405 C ILE A 288 -2.133 -9.294 -16.441 1.00 0.00 C ATOM 406 O ILE A 288 -2.552 -10.410 -16.757 1.00 0.00 O ATOM 407 CB ILE A 288 -1.077 -9.150 -14.159 1.00 0.00 C ATOM 408 CG1 ILE A 288 0.206 -9.496 -13.415 1.00 0.00 C ATOM 409 CG2 ILE A 288 -2.204 -10.114 -13.822 1.00 0.00 C ATOM 410 CD1 ILE A 288 0.680 -10.915 -13.626 1.00 0.00 C ATOM 0 H ILE A 288 -0.317 -7.105 -15.436 1.00 0.00 H new ATOM 0 HA ILE A 288 -0.151 -9.954 -15.914 1.00 0.00 H new ATOM 0 HB ILE A 288 -1.392 -8.158 -13.835 1.00 0.00 H new ATOM 0 HG12 ILE A 288 0.993 -8.811 -13.732 1.00 0.00 H new ATOM 0 HG13 ILE A 288 0.050 -9.331 -12.349 1.00 0.00 H new ATOM 0 HG21 ILE A 288 -2.370 -10.117 -12.745 1.00 0.00 H new ATOM 0 HG22 ILE A 288 -3.116 -9.799 -14.329 1.00 0.00 H new ATOM 0 HG23 ILE A 288 -1.934 -11.118 -14.150 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.598 -11.079 -13.062 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.086 -11.610 -13.282 1.00 0.00 H new ATOM 0 HD13 ILE A 288 0.871 -11.081 -14.686 1.00 0.00 H new ATOM 422 N SER A 289 -2.767 -8.161 -16.734 1.00 0.00 N ATOM 423 CA SER A 289 -4.032 -8.135 -17.470 1.00 0.00 C ATOM 424 C SER A 289 -4.475 -6.688 -17.692 1.00 0.00 C ATOM 425 O SER A 289 -4.035 -5.788 -16.979 1.00 0.00 O ATOM 426 CB SER A 289 -5.117 -8.905 -16.714 1.00 0.00 C ATOM 427 OG SER A 289 -5.708 -8.100 -15.713 1.00 0.00 O ATOM 0 H SER A 289 -2.422 -7.238 -16.470 1.00 0.00 H new ATOM 0 HA SER A 289 -3.880 -8.617 -18.436 1.00 0.00 H new ATOM 0 HB2 SER A 289 -5.882 -9.242 -17.413 1.00 0.00 H new ATOM 0 HB3 SER A 289 -4.685 -9.797 -16.260 1.00 0.00 H new ATOM 0 HG SER A 289 -6.399 -8.614 -15.245 1.00 0.00 H new ATOM 433 N PRO A 290 -5.355 -6.434 -18.682 1.00 0.00 N ATOM 434 CA PRO A 290 -5.838 -5.076 -18.970 1.00 0.00 C ATOM 435 C PRO A 290 -6.607 -4.465 -17.802 1.00 0.00 C ATOM 436 O PRO A 290 -7.062 -3.323 -17.878 1.00 0.00 O ATOM 437 CB PRO A 290 -6.758 -5.267 -20.182 1.00 0.00 C ATOM 438 CG PRO A 290 -7.133 -6.708 -20.160 1.00 0.00 C ATOM 439 CD PRO A 290 -5.948 -7.434 -19.587 1.00 0.00 C ATOM 0 HA PRO A 290 -5.013 -4.387 -19.152 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -7.639 -4.629 -20.113 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -6.248 -5.006 -21.109 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -8.022 -6.871 -19.551 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -7.363 -7.067 -21.163 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -6.247 -8.336 -19.052 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -5.248 -7.741 -20.364 1.00 0.00 H new ATOM 447 N GLU A 291 -6.747 -5.228 -16.723 1.00 0.00 N ATOM 448 CA GLU A 291 -7.456 -4.767 -15.545 1.00 0.00 C ATOM 449 C GLU A 291 -6.495 -4.537 -14.385 1.00 0.00 C ATOM 450 O GLU A 291 -6.830 -3.848 -13.423 1.00 0.00 O ATOM 451 CB GLU A 291 -8.524 -5.791 -15.165 1.00 0.00 C ATOM 452 CG GLU A 291 -8.531 -6.177 -13.692 1.00 0.00 C ATOM 453 CD GLU A 291 -9.772 -6.951 -13.294 1.00 0.00 C ATOM 454 OE1 GLU A 291 -10.214 -7.810 -14.085 1.00 0.00 O ATOM 455 OE2 GLU A 291 -10.302 -6.700 -12.190 1.00 0.00 O ATOM 0 H GLU A 291 -6.374 -6.174 -16.645 1.00 0.00 H new ATOM 0 HA GLU A 291 -7.935 -3.814 -15.770 1.00 0.00 H new ATOM 0 HB2 GLU A 291 -9.503 -5.391 -15.428 1.00 0.00 H new ATOM 0 HB3 GLU A 291 -8.376 -6.690 -15.763 1.00 0.00 H new ATOM 0 HG2 GLU A 291 -7.648 -6.778 -13.474 1.00 0.00 H new ATOM 0 HG3 GLU A 291 -8.460 -5.275 -13.084 1.00 0.00 H new ATOM 462 N ILE A 292 -5.297 -5.102 -14.481 1.00 0.00 N ATOM 463 CA ILE A 292 -4.308 -4.923 -13.432 1.00 0.00 C ATOM 464 C ILE A 292 -3.921 -3.471 -13.347 1.00 0.00 C ATOM 465 O ILE A 292 -3.880 -2.877 -12.269 1.00 0.00 O ATOM 466 CB ILE A 292 -3.053 -5.763 -13.661 1.00 0.00 C ATOM 467 CG1 ILE A 292 -3.468 -7.124 -14.203 1.00 0.00 C ATOM 468 CG2 ILE A 292 -2.280 -5.896 -12.346 1.00 0.00 C ATOM 469 CD1 ILE A 292 -4.443 -7.822 -13.296 1.00 0.00 C ATOM 0 H ILE A 292 -4.992 -5.680 -15.264 1.00 0.00 H new ATOM 0 HA ILE A 292 -4.763 -5.256 -12.499 1.00 0.00 H new ATOM 0 HB ILE A 292 -2.397 -5.284 -14.388 1.00 0.00 H new ATOM 0 HG12 ILE A 292 -3.916 -7.000 -15.189 1.00 0.00 H new ATOM 0 HG13 ILE A 292 -2.583 -7.747 -14.331 1.00 0.00 H new ATOM 0 HG21 ILE A 292 -1.384 -6.495 -12.509 1.00 0.00 H new ATOM 0 HG22 ILE A 292 -1.994 -4.906 -11.990 1.00 0.00 H new ATOM 0 HG23 ILE A 292 -2.910 -6.381 -11.601 1.00 0.00 H new ATOM 0 HD11 ILE A 292 -4.710 -8.788 -13.724 1.00 0.00 H new ATOM 0 HD12 ILE A 292 -3.987 -7.972 -12.318 1.00 0.00 H new ATOM 0 HD13 ILE A 292 -5.340 -7.212 -13.188 1.00 0.00 H new ATOM 481 N GLY A 293 -3.671 -2.895 -14.511 1.00 0.00 N ATOM 482 CA GLY A 293 -3.327 -1.493 -14.567 1.00 0.00 C ATOM 483 C GLY A 293 -4.378 -0.672 -13.857 1.00 0.00 C ATOM 484 O GLY A 293 -4.083 0.369 -13.271 1.00 0.00 O ATOM 0 H GLY A 293 -3.700 -3.370 -15.413 1.00 0.00 H new ATOM 0 HA2 GLY A 293 -2.354 -1.331 -14.104 1.00 0.00 H new ATOM 0 HA3 GLY A 293 -3.244 -1.172 -15.605 1.00 0.00 H new ATOM 488 N GLU A 294 -5.616 -1.168 -13.903 1.00 0.00 N ATOM 489 CA GLU A 294 -6.745 -0.516 -13.258 1.00 0.00 C ATOM 490 C GLU A 294 -6.857 -0.930 -11.794 1.00 0.00 C ATOM 491 O GLU A 294 -7.236 -0.124 -10.946 1.00 0.00 O ATOM 492 CB GLU A 294 -8.041 -0.867 -13.989 1.00 0.00 C ATOM 493 CG GLU A 294 -9.218 0.005 -13.593 1.00 0.00 C ATOM 494 CD GLU A 294 -9.991 0.506 -14.795 1.00 0.00 C ATOM 495 OE1 GLU A 294 -9.573 1.524 -15.384 1.00 0.00 O ATOM 496 OE2 GLU A 294 -11.007 -0.124 -15.153 1.00 0.00 O ATOM 0 H GLU A 294 -5.858 -2.032 -14.389 1.00 0.00 H new ATOM 0 HA GLU A 294 -6.581 0.561 -13.301 1.00 0.00 H new ATOM 0 HB2 GLU A 294 -7.878 -0.777 -15.063 1.00 0.00 H new ATOM 0 HB3 GLU A 294 -8.289 -1.910 -13.791 1.00 0.00 H new ATOM 0 HG2 GLU A 294 -9.886 -0.562 -12.945 1.00 0.00 H new ATOM 0 HG3 GLU A 294 -8.859 0.856 -13.014 1.00 0.00 H new ATOM 503 N ARG A 295 -6.541 -2.187 -11.498 1.00 0.00 N ATOM 504 CA ARG A 295 -6.630 -2.667 -10.131 1.00 0.00 C ATOM 505 C ARG A 295 -5.477 -2.148 -9.271 1.00 0.00 C ATOM 506 O ARG A 295 -5.705 -1.572 -8.214 1.00 0.00 O ATOM 507 CB ARG A 295 -6.717 -4.184 -10.107 1.00 0.00 C ATOM 508 CG ARG A 295 -5.401 -4.908 -10.231 1.00 0.00 C ATOM 509 CD ARG A 295 -5.577 -6.359 -9.839 1.00 0.00 C ATOM 510 NE ARG A 295 -6.327 -7.141 -10.821 1.00 0.00 N ATOM 511 CZ ARG A 295 -6.935 -8.292 -10.525 1.00 0.00 C ATOM 512 NH1 ARG A 295 -7.045 -8.681 -9.259 1.00 0.00 N ATOM 513 NH2 ARG A 295 -7.476 -9.033 -11.483 1.00 0.00 N ATOM 0 H ARG A 295 -6.226 -2.879 -12.178 1.00 0.00 H new ATOM 0 HA ARG A 295 -7.546 -2.271 -9.692 1.00 0.00 H new ATOM 0 HB2 ARG A 295 -7.194 -4.489 -9.176 1.00 0.00 H new ATOM 0 HB3 ARG A 295 -7.368 -4.507 -10.919 1.00 0.00 H new ATOM 0 HG2 ARG A 295 -5.033 -4.840 -11.255 1.00 0.00 H new ATOM 0 HG3 ARG A 295 -4.654 -4.437 -9.592 1.00 0.00 H new ATOM 0 HD2 ARG A 295 -4.595 -6.811 -9.699 1.00 0.00 H new ATOM 0 HD3 ARG A 295 -6.090 -6.408 -8.879 1.00 0.00 H new ATOM 0 HE ARG A 295 -6.388 -6.791 -11.777 1.00 0.00 H new ATOM 0 HH11 ARG A 295 -6.665 -8.100 -8.512 1.00 0.00 H new ATOM 0 HH12 ARG A 295 -7.510 -9.561 -9.034 1.00 0.00 H new ATOM 0 HH21 ARG A 295 -7.429 -8.725 -12.454 1.00 0.00 H new ATOM 0 HH22 ARG A 295 -7.939 -9.911 -11.249 1.00 0.00 H new ATOM 527 N VAL A 296 -4.238 -2.329 -9.721 1.00 0.00 N ATOM 528 CA VAL A 296 -3.093 -1.844 -8.949 1.00 0.00 C ATOM 529 C VAL A 296 -3.229 -0.356 -8.684 1.00 0.00 C ATOM 530 O VAL A 296 -3.007 0.111 -7.567 1.00 0.00 O ATOM 531 CB VAL A 296 -1.739 -2.097 -9.644 1.00 0.00 C ATOM 532 CG1 VAL A 296 -0.599 -1.838 -8.658 1.00 0.00 C ATOM 533 CG2 VAL A 296 -1.677 -3.510 -10.212 1.00 0.00 C ATOM 0 H VAL A 296 -4.002 -2.797 -10.596 1.00 0.00 H new ATOM 0 HA VAL A 296 -3.100 -2.408 -8.016 1.00 0.00 H new ATOM 0 HB VAL A 296 -1.633 -1.408 -10.482 1.00 0.00 H new ATOM 0 HG11 VAL A 296 0.356 -2.017 -9.151 1.00 0.00 H new ATOM 0 HG12 VAL A 296 -0.642 -0.804 -8.315 1.00 0.00 H new ATOM 0 HG13 VAL A 296 -0.698 -2.508 -7.804 1.00 0.00 H new ATOM 0 HG21 VAL A 296 -0.713 -3.665 -10.697 1.00 0.00 H new ATOM 0 HG22 VAL A 296 -1.797 -4.232 -9.405 1.00 0.00 H new ATOM 0 HG23 VAL A 296 -2.476 -3.644 -10.941 1.00 0.00 H new ATOM 543 N ARG A 297 -3.601 0.382 -9.720 1.00 0.00 N ATOM 544 CA ARG A 297 -3.776 1.820 -9.604 1.00 0.00 C ATOM 545 C ARG A 297 -4.935 2.144 -8.670 1.00 0.00 C ATOM 546 O ARG A 297 -4.860 3.078 -7.870 1.00 0.00 O ATOM 547 CB ARG A 297 -4.026 2.429 -10.979 1.00 0.00 C ATOM 548 CG ARG A 297 -3.441 3.821 -11.151 1.00 0.00 C ATOM 549 CD ARG A 297 -3.164 4.125 -12.615 1.00 0.00 C ATOM 550 NE ARG A 297 -2.264 5.263 -12.786 1.00 0.00 N ATOM 551 CZ ARG A 297 -1.624 5.538 -13.922 1.00 0.00 C ATOM 552 NH1 ARG A 297 -1.777 4.760 -14.987 1.00 0.00 N ATOM 553 NH2 ARG A 297 -0.820 6.588 -13.993 1.00 0.00 N ATOM 0 H ARG A 297 -3.787 0.007 -10.650 1.00 0.00 H new ATOM 0 HA ARG A 297 -2.865 2.248 -9.186 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -3.604 1.772 -11.739 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -5.101 2.473 -11.156 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -4.132 4.561 -10.748 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -2.517 3.903 -10.579 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -2.728 3.246 -13.090 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -4.105 4.329 -13.125 1.00 0.00 H new ATOM 0 HE ARG A 297 -2.117 5.883 -11.990 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -2.388 3.945 -14.939 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -1.283 4.978 -15.853 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -0.690 7.187 -13.178 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -0.331 6.798 -14.863 1.00 0.00 H new ATOM 567 N THR A 298 -6.009 1.357 -8.768 1.00 0.00 N ATOM 568 CA THR A 298 -7.176 1.578 -7.922 1.00 0.00 C ATOM 569 C THR A 298 -6.881 1.199 -6.473 1.00 0.00 C ATOM 570 O THR A 298 -7.449 1.779 -5.545 1.00 0.00 O ATOM 571 CB THR A 298 -8.411 0.822 -8.435 1.00 0.00 C ATOM 572 OG1 THR A 298 -9.577 1.343 -7.832 1.00 0.00 O ATOM 573 CG2 THR A 298 -8.400 -0.667 -8.173 1.00 0.00 C ATOM 0 H THR A 298 -6.092 0.573 -9.416 1.00 0.00 H new ATOM 0 HA THR A 298 -7.402 2.643 -7.964 1.00 0.00 H new ATOM 0 HB THR A 298 -8.394 0.965 -9.515 1.00 0.00 H new ATOM 0 HG1 THR A 298 -10.361 0.858 -8.164 1.00 0.00 H new ATOM 0 HG21 THR A 298 -9.311 -1.113 -8.571 1.00 0.00 H new ATOM 0 HG22 THR A 298 -7.534 -1.116 -8.660 1.00 0.00 H new ATOM 0 HG23 THR A 298 -8.347 -0.847 -7.099 1.00 0.00 H new ATOM 581 N LEU A 299 -5.991 0.229 -6.275 1.00 0.00 N ATOM 582 CA LEU A 299 -5.634 -0.216 -4.935 1.00 0.00 C ATOM 583 C LEU A 299 -5.064 0.935 -4.111 1.00 0.00 C ATOM 584 O LEU A 299 -5.493 1.180 -2.985 1.00 0.00 O ATOM 585 CB LEU A 299 -4.632 -1.373 -5.020 1.00 0.00 C ATOM 586 CG LEU A 299 -5.125 -2.594 -5.800 1.00 0.00 C ATOM 587 CD1 LEU A 299 -3.989 -3.568 -6.069 1.00 0.00 C ATOM 588 CD2 LEU A 299 -6.267 -3.271 -5.054 1.00 0.00 C ATOM 0 H LEU A 299 -5.506 -0.262 -7.026 1.00 0.00 H new ATOM 0 HA LEU A 299 -6.535 -0.568 -4.433 1.00 0.00 H new ATOM 0 HB2 LEU A 299 -3.716 -1.008 -5.485 1.00 0.00 H new ATOM 0 HB3 LEU A 299 -4.373 -1.686 -4.008 1.00 0.00 H new ATOM 0 HG LEU A 299 -5.500 -2.256 -6.766 1.00 0.00 H new ATOM 0 HD11 LEU A 299 -4.369 -4.425 -6.624 1.00 0.00 H new ATOM 0 HD12 LEU A 299 -3.214 -3.071 -6.653 1.00 0.00 H new ATOM 0 HD13 LEU A 299 -3.568 -3.907 -5.122 1.00 0.00 H new ATOM 0 HD21 LEU A 299 -6.608 -4.138 -5.620 1.00 0.00 H new ATOM 0 HD22 LEU A 299 -5.920 -3.592 -4.072 1.00 0.00 H new ATOM 0 HD23 LEU A 299 -7.091 -2.568 -4.935 1.00 0.00 H new ATOM 600 N VAL A 300 -4.095 1.642 -4.684 1.00 0.00 N ATOM 601 CA VAL A 300 -3.468 2.772 -4.003 1.00 0.00 C ATOM 602 C VAL A 300 -4.433 3.938 -3.819 1.00 0.00 C ATOM 603 O VAL A 300 -4.530 4.494 -2.728 1.00 0.00 O ATOM 604 CB VAL A 300 -2.208 3.258 -4.743 1.00 0.00 C ATOM 605 CG1 VAL A 300 -1.503 4.339 -3.936 1.00 0.00 C ATOM 606 CG2 VAL A 300 -1.271 2.089 -5.015 1.00 0.00 C ATOM 0 H VAL A 300 -3.727 1.454 -5.616 1.00 0.00 H new ATOM 0 HA VAL A 300 -3.177 2.406 -3.018 1.00 0.00 H new ATOM 0 HB VAL A 300 -2.507 3.687 -5.699 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -0.614 4.672 -4.472 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -2.177 5.183 -3.791 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -1.212 3.937 -2.966 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -0.385 2.447 -5.539 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -0.975 1.633 -4.070 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -1.782 1.349 -5.631 1.00 0.00 H new ATOM 616 N LEU A 301 -5.145 4.310 -4.871 1.00 0.00 N ATOM 617 CA LEU A 301 -6.085 5.413 -4.774 1.00 0.00 C ATOM 618 C LEU A 301 -7.224 5.061 -3.837 1.00 0.00 C ATOM 619 O LEU A 301 -7.749 5.920 -3.133 1.00 0.00 O ATOM 620 CB LEU A 301 -6.630 5.776 -6.151 1.00 0.00 C ATOM 621 CG LEU A 301 -7.353 4.652 -6.887 1.00 0.00 C ATOM 622 CD1 LEU A 301 -8.813 4.590 -6.461 1.00 0.00 C ATOM 623 CD2 LEU A 301 -7.243 4.852 -8.395 1.00 0.00 C ATOM 0 H LEU A 301 -5.091 3.871 -5.790 1.00 0.00 H new ATOM 0 HA LEU A 301 -5.556 6.277 -4.371 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -7.316 6.616 -6.041 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -5.802 6.120 -6.771 1.00 0.00 H new ATOM 0 HG LEU A 301 -6.880 3.705 -6.628 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -9.314 3.783 -6.995 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -8.872 4.406 -5.388 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -9.300 5.537 -6.694 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -7.763 4.043 -8.908 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -7.694 5.805 -8.669 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -6.193 4.851 -8.687 1.00 0.00 H new ATOM 635 N GLY A 302 -7.597 3.789 -3.828 1.00 0.00 N ATOM 636 CA GLY A 302 -8.673 3.349 -2.969 1.00 0.00 C ATOM 637 C GLY A 302 -8.298 3.408 -1.507 1.00 0.00 C ATOM 638 O GLY A 302 -9.058 3.906 -0.680 1.00 0.00 O ATOM 0 H GLY A 302 -7.174 3.057 -4.399 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -9.551 3.971 -3.142 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -8.949 2.328 -3.230 1.00 0.00 H new ATOM 642 N LEU A 303 -7.117 2.894 -1.194 1.00 0.00 N ATOM 643 CA LEU A 303 -6.612 2.872 0.171 1.00 0.00 C ATOM 644 C LEU A 303 -6.557 4.279 0.752 1.00 0.00 C ATOM 645 O LEU A 303 -6.693 4.471 1.962 1.00 0.00 O ATOM 646 CB LEU A 303 -5.226 2.225 0.181 1.00 0.00 C ATOM 647 CG LEU A 303 -4.461 2.301 1.506 1.00 0.00 C ATOM 648 CD1 LEU A 303 -4.448 0.945 2.198 1.00 0.00 C ATOM 649 CD2 LEU A 303 -3.039 2.788 1.267 1.00 0.00 C ATOM 0 H LEU A 303 -6.483 2.481 -1.878 1.00 0.00 H new ATOM 0 HA LEU A 303 -7.287 2.287 0.795 1.00 0.00 H new ATOM 0 HB2 LEU A 303 -5.334 1.176 -0.094 1.00 0.00 H new ATOM 0 HB3 LEU A 303 -4.621 2.697 -0.593 1.00 0.00 H new ATOM 0 HG LEU A 303 -4.970 3.012 2.157 1.00 0.00 H new ATOM 0 HD11 LEU A 303 -3.900 1.021 3.137 1.00 0.00 H new ATOM 0 HD12 LEU A 303 -5.472 0.630 2.400 1.00 0.00 H new ATOM 0 HD13 LEU A 303 -3.963 0.212 1.553 1.00 0.00 H new ATOM 0 HD21 LEU A 303 -2.507 2.837 2.217 1.00 0.00 H new ATOM 0 HD22 LEU A 303 -2.525 2.097 0.599 1.00 0.00 H new ATOM 0 HD23 LEU A 303 -3.065 3.779 0.814 1.00 0.00 H new ATOM 661 N VAL A 304 -6.357 5.263 -0.120 1.00 0.00 N ATOM 662 CA VAL A 304 -6.280 6.656 0.295 1.00 0.00 C ATOM 663 C VAL A 304 -7.626 7.364 0.140 1.00 0.00 C ATOM 664 O VAL A 304 -7.965 8.237 0.937 1.00 0.00 O ATOM 665 CB VAL A 304 -5.208 7.414 -0.505 1.00 0.00 C ATOM 666 CG1 VAL A 304 -3.835 6.799 -0.262 1.00 0.00 C ATOM 667 CG2 VAL A 304 -5.550 7.416 -1.987 1.00 0.00 C ATOM 0 H VAL A 304 -6.245 5.118 -1.123 1.00 0.00 H new ATOM 0 HA VAL A 304 -6.005 6.657 1.350 1.00 0.00 H new ATOM 0 HB VAL A 304 -5.184 8.449 -0.164 1.00 0.00 H new ATOM 0 HG11 VAL A 304 -3.085 7.345 -0.834 1.00 0.00 H new ATOM 0 HG12 VAL A 304 -3.594 6.856 0.799 1.00 0.00 H new ATOM 0 HG13 VAL A 304 -3.843 5.756 -0.577 1.00 0.00 H new ATOM 0 HG21 VAL A 304 -4.780 7.957 -2.537 1.00 0.00 H new ATOM 0 HG22 VAL A 304 -5.602 6.389 -2.350 1.00 0.00 H new ATOM 0 HG23 VAL A 304 -6.513 7.903 -2.137 1.00 0.00 H new ATOM 677 N ASN A 305 -8.395 6.986 -0.882 1.00 0.00 N ATOM 678 CA ASN A 305 -9.705 7.603 -1.117 1.00 0.00 C ATOM 679 C ASN A 305 -10.728 7.180 -0.058 1.00 0.00 C ATOM 680 O ASN A 305 -11.921 7.450 -0.203 1.00 0.00 O ATOM 681 CB ASN A 305 -10.236 7.252 -2.512 1.00 0.00 C ATOM 682 CG ASN A 305 -10.195 8.434 -3.463 1.00 0.00 C ATOM 683 OD1 ASN A 305 -10.781 9.481 -3.192 1.00 0.00 O ATOM 684 ND2 ASN A 305 -9.499 8.274 -4.584 1.00 0.00 N ATOM 0 H ASN A 305 -8.139 6.264 -1.555 1.00 0.00 H new ATOM 0 HA ASN A 305 -9.564 8.682 -1.049 1.00 0.00 H new ATOM 0 HB2 ASN A 305 -9.646 6.435 -2.927 1.00 0.00 H new ATOM 0 HB3 ASN A 305 -11.262 6.893 -2.427 1.00 0.00 H new ATOM 0 HD21 ASN A 305 -9.436 9.037 -5.258 1.00 0.00 H new ATOM 0 HD22 ASN A 305 -9.028 7.389 -4.770 1.00 0.00 H new ATOM 691 N SER A 306 -10.266 6.520 1.005 1.00 0.00 N ATOM 692 CA SER A 306 -11.151 6.074 2.074 1.00 0.00 C ATOM 693 C SER A 306 -12.175 5.069 1.545 1.00 0.00 C ATOM 694 O SER A 306 -13.373 5.196 1.801 1.00 0.00 O ATOM 695 CB SER A 306 -11.866 7.274 2.708 1.00 0.00 C ATOM 696 OG SER A 306 -13.042 7.611 1.993 1.00 0.00 O ATOM 0 H SER A 306 -9.284 6.284 1.146 1.00 0.00 H new ATOM 0 HA SER A 306 -10.547 5.581 2.835 1.00 0.00 H new ATOM 0 HB2 SER A 306 -12.121 7.043 3.742 1.00 0.00 H new ATOM 0 HB3 SER A 306 -11.193 8.131 2.729 1.00 0.00 H new ATOM 0 HG SER A 306 -12.799 7.957 1.109 1.00 0.00 H new ATOM 702 N THR A 307 -11.693 4.077 0.800 1.00 0.00 N ATOM 703 CA THR A 307 -12.564 3.055 0.227 1.00 0.00 C ATOM 704 C THR A 307 -11.903 1.676 0.248 1.00 0.00 C ATOM 705 O THR A 307 -12.469 0.702 -0.247 1.00 0.00 O ATOM 706 CB THR A 307 -12.942 3.438 -1.211 1.00 0.00 C ATOM 707 OG1 THR A 307 -13.810 2.474 -1.789 1.00 0.00 O ATOM 708 CG2 THR A 307 -11.743 3.588 -2.128 1.00 0.00 C ATOM 0 H THR A 307 -10.704 3.960 0.579 1.00 0.00 H new ATOM 0 HA THR A 307 -13.465 3.000 0.838 1.00 0.00 H new ATOM 0 HB THR A 307 -13.438 4.405 -1.124 1.00 0.00 H new ATOM 0 HG1 THR A 307 -13.622 1.592 -1.405 1.00 0.00 H new ATOM 0 HG21 THR A 307 -12.081 3.859 -3.128 1.00 0.00 H new ATOM 0 HG22 THR A 307 -11.086 4.368 -1.743 1.00 0.00 H new ATOM 0 HG23 THR A 307 -11.199 2.645 -2.173 1.00 0.00 H new ATOM 716 N LEU A 308 -10.703 1.591 0.824 1.00 0.00 N ATOM 717 CA LEU A 308 -9.984 0.326 0.904 1.00 0.00 C ATOM 718 C LEU A 308 -9.652 -0.009 2.356 1.00 0.00 C ATOM 719 O LEU A 308 -10.271 0.501 3.288 1.00 0.00 O ATOM 720 CB LEU A 308 -8.699 0.382 0.056 1.00 0.00 C ATOM 721 CG LEU A 308 -8.525 -0.744 -0.979 1.00 0.00 C ATOM 722 CD1 LEU A 308 -7.803 -0.218 -2.215 1.00 0.00 C ATOM 723 CD2 LEU A 308 -7.764 -1.925 -0.376 1.00 0.00 C ATOM 0 H LEU A 308 -10.212 2.383 1.240 1.00 0.00 H new ATOM 0 HA LEU A 308 -10.625 -0.461 0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 308 -8.674 1.337 -0.468 1.00 0.00 H new ATOM 0 HB3 LEU A 308 -7.842 0.366 0.729 1.00 0.00 H new ATOM 0 HG LEU A 308 -9.514 -1.094 -1.274 1.00 0.00 H new ATOM 0 HD11 LEU A 308 -7.686 -1.024 -2.939 1.00 0.00 H new ATOM 0 HD12 LEU A 308 -8.385 0.589 -2.661 1.00 0.00 H new ATOM 0 HD13 LEU A 308 -6.821 0.158 -1.930 1.00 0.00 H new ATOM 0 HD21 LEU A 308 -7.654 -2.708 -1.126 1.00 0.00 H new ATOM 0 HD22 LEU A 308 -6.778 -1.594 -0.049 1.00 0.00 H new ATOM 0 HD23 LEU A 308 -8.317 -2.316 0.478 1.00 0.00 H new ATOM 735 N THR A 309 -8.669 -0.868 2.529 1.00 0.00 N ATOM 736 CA THR A 309 -8.229 -1.292 3.836 1.00 0.00 C ATOM 737 C THR A 309 -6.875 -1.944 3.705 1.00 0.00 C ATOM 738 O THR A 309 -6.513 -2.434 2.639 1.00 0.00 O ATOM 739 CB THR A 309 -9.236 -2.261 4.461 1.00 0.00 C ATOM 740 OG1 THR A 309 -10.480 -2.195 3.790 1.00 0.00 O ATOM 741 CG2 THR A 309 -9.493 -1.986 5.927 1.00 0.00 C ATOM 0 H THR A 309 -8.151 -1.293 1.760 1.00 0.00 H new ATOM 0 HA THR A 309 -8.156 -0.425 4.493 1.00 0.00 H new ATOM 0 HB THR A 309 -8.787 -3.249 4.362 1.00 0.00 H new ATOM 0 HG1 THR A 309 -11.109 -2.823 4.204 1.00 0.00 H new ATOM 0 HG21 THR A 309 -10.215 -2.706 6.311 1.00 0.00 H new ATOM 0 HG22 THR A 309 -8.560 -2.076 6.483 1.00 0.00 H new ATOM 0 HG23 THR A 309 -9.889 -0.977 6.044 1.00 0.00 H new ATOM 749 N ILE A 310 -6.130 -1.928 4.785 1.00 0.00 N ATOM 750 CA ILE A 310 -4.808 -2.498 4.804 1.00 0.00 C ATOM 751 C ILE A 310 -4.852 -3.968 4.441 1.00 0.00 C ATOM 752 O ILE A 310 -4.177 -4.413 3.513 1.00 0.00 O ATOM 753 CB ILE A 310 -4.205 -2.292 6.201 1.00 0.00 C ATOM 754 CG1 ILE A 310 -3.269 -1.100 6.176 1.00 0.00 C ATOM 755 CG2 ILE A 310 -3.503 -3.533 6.732 1.00 0.00 C ATOM 756 CD1 ILE A 310 -3.634 -0.068 7.206 1.00 0.00 C ATOM 0 H ILE A 310 -6.424 -1.520 5.672 1.00 0.00 H new ATOM 0 HA ILE A 310 -4.182 -2.001 4.063 1.00 0.00 H new ATOM 0 HB ILE A 310 -5.026 -2.097 6.891 1.00 0.00 H new ATOM 0 HG12 ILE A 310 -2.248 -1.439 6.350 1.00 0.00 H new ATOM 0 HG13 ILE A 310 -3.290 -0.645 5.186 1.00 0.00 H new ATOM 0 HG21 ILE A 310 -3.097 -3.326 7.722 1.00 0.00 H new ATOM 0 HG22 ILE A 310 -4.216 -4.355 6.797 1.00 0.00 H new ATOM 0 HG23 ILE A 310 -2.692 -3.809 6.058 1.00 0.00 H new ATOM 0 HD11 ILE A 310 -2.935 0.766 7.149 1.00 0.00 H new ATOM 0 HD12 ILE A 310 -4.645 0.293 7.017 1.00 0.00 H new ATOM 0 HD13 ILE A 310 -3.587 -0.513 8.200 1.00 0.00 H new ATOM 768 N GLU A 311 -5.659 -4.707 5.178 1.00 0.00 N ATOM 769 CA GLU A 311 -5.812 -6.138 4.941 1.00 0.00 C ATOM 770 C GLU A 311 -6.197 -6.395 3.494 1.00 0.00 C ATOM 771 O GLU A 311 -5.800 -7.394 2.912 1.00 0.00 O ATOM 772 CB GLU A 311 -6.874 -6.736 5.863 1.00 0.00 C ATOM 773 CG GLU A 311 -8.038 -5.800 6.153 1.00 0.00 C ATOM 774 CD GLU A 311 -9.183 -6.499 6.855 1.00 0.00 C ATOM 775 OE1 GLU A 311 -9.651 -7.535 6.338 1.00 0.00 O ATOM 776 OE2 GLU A 311 -9.614 -6.010 7.919 1.00 0.00 O ATOM 0 H GLU A 311 -6.221 -4.344 5.948 1.00 0.00 H new ATOM 0 HA GLU A 311 -4.855 -6.615 5.153 1.00 0.00 H new ATOM 0 HB2 GLU A 311 -7.260 -7.650 5.412 1.00 0.00 H new ATOM 0 HB3 GLU A 311 -6.405 -7.019 6.805 1.00 0.00 H new ATOM 0 HG2 GLU A 311 -7.689 -4.972 6.770 1.00 0.00 H new ATOM 0 HG3 GLU A 311 -8.397 -5.371 5.217 1.00 0.00 H new ATOM 783 N GLU A 312 -6.984 -5.483 2.935 1.00 0.00 N ATOM 784 CA GLU A 312 -7.452 -5.601 1.559 1.00 0.00 C ATOM 785 C GLU A 312 -6.382 -5.173 0.560 1.00 0.00 C ATOM 786 O GLU A 312 -6.087 -5.890 -0.393 1.00 0.00 O ATOM 787 CB GLU A 312 -8.709 -4.752 1.372 1.00 0.00 C ATOM 788 CG GLU A 312 -9.946 -5.361 2.010 1.00 0.00 C ATOM 789 CD GLU A 312 -11.030 -5.684 1.000 1.00 0.00 C ATOM 790 OE1 GLU A 312 -10.950 -6.757 0.366 1.00 0.00 O ATOM 791 OE2 GLU A 312 -11.957 -4.863 0.843 1.00 0.00 O ATOM 0 H GLU A 312 -7.314 -4.647 3.418 1.00 0.00 H new ATOM 0 HA GLU A 312 -7.681 -6.650 1.369 1.00 0.00 H new ATOM 0 HB2 GLU A 312 -8.538 -3.763 1.798 1.00 0.00 H new ATOM 0 HB3 GLU A 312 -8.890 -4.613 0.306 1.00 0.00 H new ATOM 0 HG2 GLU A 312 -9.665 -6.272 2.539 1.00 0.00 H new ATOM 0 HG3 GLU A 312 -10.343 -4.670 2.754 1.00 0.00 H new ATOM 798 N PHE A 313 -5.812 -3.993 0.783 1.00 0.00 N ATOM 799 CA PHE A 313 -4.784 -3.450 -0.101 1.00 0.00 C ATOM 800 C PHE A 313 -3.687 -4.474 -0.343 1.00 0.00 C ATOM 801 O PHE A 313 -3.470 -4.894 -1.474 1.00 0.00 O ATOM 802 CB PHE A 313 -4.197 -2.175 0.518 1.00 0.00 C ATOM 803 CG PHE A 313 -3.174 -1.471 -0.336 1.00 0.00 C ATOM 804 CD1 PHE A 313 -3.566 -0.628 -1.364 1.00 0.00 C ATOM 805 CD2 PHE A 313 -1.820 -1.637 -0.097 1.00 0.00 C ATOM 806 CE1 PHE A 313 -2.628 0.031 -2.135 1.00 0.00 C ATOM 807 CE2 PHE A 313 -0.878 -0.977 -0.864 1.00 0.00 C ATOM 808 CZ PHE A 313 -1.283 -0.141 -1.883 1.00 0.00 C ATOM 0 H PHE A 313 -6.046 -3.391 1.573 1.00 0.00 H new ATOM 0 HA PHE A 313 -5.237 -3.208 -1.062 1.00 0.00 H new ATOM 0 HB2 PHE A 313 -5.012 -1.482 0.730 1.00 0.00 H new ATOM 0 HB3 PHE A 313 -3.739 -2.430 1.474 1.00 0.00 H new ATOM 0 HD1 PHE A 313 -4.617 -0.485 -1.565 1.00 0.00 H new ATOM 0 HD2 PHE A 313 -1.496 -2.291 0.699 1.00 0.00 H new ATOM 0 HE1 PHE A 313 -2.948 0.681 -2.936 1.00 0.00 H new ATOM 0 HE2 PHE A 313 0.174 -1.116 -0.665 1.00 0.00 H new ATOM 0 HZ PHE A 313 -0.549 0.378 -2.482 1.00 0.00 H new ATOM 818 N HIS A 314 -3.008 -4.889 0.718 1.00 0.00 N ATOM 819 CA HIS A 314 -1.942 -5.876 0.581 1.00 0.00 C ATOM 820 C HIS A 314 -2.476 -7.153 -0.051 1.00 0.00 C ATOM 821 O HIS A 314 -1.829 -7.757 -0.904 1.00 0.00 O ATOM 822 CB HIS A 314 -1.306 -6.206 1.932 1.00 0.00 C ATOM 823 CG HIS A 314 -0.230 -7.242 1.829 1.00 0.00 C ATOM 824 ND1 HIS A 314 0.617 -7.329 0.743 1.00 0.00 N ATOM 825 CD2 HIS A 314 0.144 -8.232 2.674 1.00 0.00 C ATOM 826 CE1 HIS A 314 1.463 -8.323 0.926 1.00 0.00 C ATOM 827 NE2 HIS A 314 1.198 -8.887 2.088 1.00 0.00 N ATOM 0 H HIS A 314 -3.172 -4.564 1.671 1.00 0.00 H new ATOM 0 HA HIS A 314 -1.178 -5.441 -0.064 1.00 0.00 H new ATOM 0 HB2 HIS A 314 -0.888 -5.296 2.364 1.00 0.00 H new ATOM 0 HB3 HIS A 314 -2.078 -6.558 2.616 1.00 0.00 H new ATOM 0 HD2 HIS A 314 -0.303 -8.463 3.630 1.00 0.00 H new ATOM 0 HE1 HIS A 314 2.241 -8.624 0.240 1.00 0.00 H new ATOM 0 HE2 HIS A 314 1.696 -9.682 2.487 1.00 0.00 H new ATOM 836 N SER A 315 -3.662 -7.559 0.385 1.00 0.00 N ATOM 837 CA SER A 315 -4.300 -8.770 -0.123 1.00 0.00 C ATOM 838 C SER A 315 -4.512 -8.705 -1.633 1.00 0.00 C ATOM 839 O SER A 315 -4.202 -9.651 -2.356 1.00 0.00 O ATOM 840 CB SER A 315 -5.641 -8.975 0.568 1.00 0.00 C ATOM 841 OG SER A 315 -5.685 -10.222 1.243 1.00 0.00 O ATOM 0 H SER A 315 -4.205 -7.065 1.093 1.00 0.00 H new ATOM 0 HA SER A 315 -3.637 -9.609 0.090 1.00 0.00 H new ATOM 0 HB2 SER A 315 -5.814 -8.167 1.279 1.00 0.00 H new ATOM 0 HB3 SER A 315 -6.443 -8.929 -0.168 1.00 0.00 H new ATOM 0 HG SER A 315 -6.556 -10.327 1.679 1.00 0.00 H new ATOM 847 N LYS A 316 -5.057 -7.590 -2.098 1.00 0.00 N ATOM 848 CA LYS A 316 -5.319 -7.409 -3.520 1.00 0.00 C ATOM 849 C LYS A 316 -4.038 -7.027 -4.266 1.00 0.00 C ATOM 850 O LYS A 316 -3.733 -7.586 -5.318 1.00 0.00 O ATOM 851 CB LYS A 316 -6.391 -6.339 -3.730 1.00 0.00 C ATOM 852 CG LYS A 316 -7.651 -6.553 -2.902 1.00 0.00 C ATOM 853 CD LYS A 316 -8.666 -5.441 -3.134 1.00 0.00 C ATOM 854 CE LYS A 316 -9.566 -5.243 -1.927 1.00 0.00 C ATOM 855 NZ LYS A 316 -10.943 -4.839 -2.321 1.00 0.00 N ATOM 0 H LYS A 316 -5.326 -6.798 -1.514 1.00 0.00 H new ATOM 0 HA LYS A 316 -5.681 -8.355 -3.923 1.00 0.00 H new ATOM 0 HB2 LYS A 316 -5.969 -5.364 -3.486 1.00 0.00 H new ATOM 0 HB3 LYS A 316 -6.662 -6.313 -4.785 1.00 0.00 H new ATOM 0 HG2 LYS A 316 -8.097 -7.514 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 316 -7.390 -6.594 -1.844 1.00 0.00 H new ATOM 0 HD2 LYS A 316 -8.143 -4.511 -3.355 1.00 0.00 H new ATOM 0 HD3 LYS A 316 -9.274 -5.679 -4.007 1.00 0.00 H new ATOM 0 HE2 LYS A 316 -9.610 -6.168 -1.351 1.00 0.00 H new ATOM 0 HE3 LYS A 316 -9.137 -4.482 -1.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 316 -11.530 -4.731 -1.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 316 -10.906 -3.935 -2.834 1.00 0.00 H new ATOM 0 HZ3 LYS A 316 -11.356 -5.569 -2.936 1.00 0.00 H new ATOM 869 N LEU A 317 -3.290 -6.073 -3.713 1.00 0.00 N ATOM 870 CA LEU A 317 -2.043 -5.618 -4.326 1.00 0.00 C ATOM 871 C LEU A 317 -1.062 -6.771 -4.496 1.00 0.00 C ATOM 872 O LEU A 317 -0.358 -6.850 -5.499 1.00 0.00 O ATOM 873 CB LEU A 317 -1.396 -4.516 -3.479 1.00 0.00 C ATOM 874 CG LEU A 317 -0.852 -3.320 -4.266 1.00 0.00 C ATOM 875 CD1 LEU A 317 -1.730 -2.112 -4.048 1.00 0.00 C ATOM 876 CD2 LEU A 317 0.581 -3.002 -3.856 1.00 0.00 C ATOM 0 H LEU A 317 -3.526 -5.600 -2.841 1.00 0.00 H new ATOM 0 HA LEU A 317 -2.287 -5.218 -5.310 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -2.132 -4.153 -2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -0.579 -4.954 -2.905 1.00 0.00 H new ATOM 0 HG LEU A 317 -0.856 -3.580 -5.324 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -1.334 -1.268 -4.612 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -2.742 -2.332 -4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -1.749 -1.863 -2.987 1.00 0.00 H new ATOM 0 HD21 LEU A 317 0.943 -2.149 -4.430 1.00 0.00 H new ATOM 0 HD22 LEU A 317 0.611 -2.763 -2.793 1.00 0.00 H new ATOM 0 HD23 LEU A 317 1.216 -3.866 -4.051 1.00 0.00 H new ATOM 888 N GLN A 318 -1.009 -7.663 -3.513 1.00 0.00 N ATOM 889 CA GLN A 318 -0.094 -8.794 -3.584 1.00 0.00 C ATOM 890 C GLN A 318 -0.362 -9.638 -4.818 1.00 0.00 C ATOM 891 O GLN A 318 0.556 -10.217 -5.398 1.00 0.00 O ATOM 892 CB GLN A 318 -0.184 -9.667 -2.329 1.00 0.00 C ATOM 893 CG GLN A 318 -1.510 -10.396 -2.172 1.00 0.00 C ATOM 894 CD GLN A 318 -1.404 -11.624 -1.288 1.00 0.00 C ATOM 895 OE1 GLN A 318 -0.970 -12.688 -1.729 1.00 0.00 O ATOM 896 NE2 GLN A 318 -1.801 -11.480 -0.030 1.00 0.00 N ATOM 0 H GLN A 318 -1.581 -7.626 -2.669 1.00 0.00 H new ATOM 0 HA GLN A 318 0.915 -8.386 -3.649 1.00 0.00 H new ATOM 0 HB2 GLN A 318 0.621 -10.401 -2.352 1.00 0.00 H new ATOM 0 HB3 GLN A 318 -0.020 -9.041 -1.452 1.00 0.00 H new ATOM 0 HG2 GLN A 318 -2.247 -9.713 -1.750 1.00 0.00 H new ATOM 0 HG3 GLN A 318 -1.875 -10.692 -3.155 1.00 0.00 H new ATOM 0 HE21 GLN A 318 -2.154 -10.579 0.293 1.00 0.00 H new ATOM 0 HE22 GLN A 318 -1.753 -12.270 0.614 1.00 0.00 H new ATOM 905 N GLU A 319 -1.627 -9.701 -5.216 1.00 0.00 N ATOM 906 CA GLU A 319 -2.014 -10.474 -6.385 1.00 0.00 C ATOM 907 C GLU A 319 -1.613 -9.752 -7.658 1.00 0.00 C ATOM 908 O GLU A 319 -0.936 -10.316 -8.521 1.00 0.00 O ATOM 909 CB GLU A 319 -3.520 -10.710 -6.398 1.00 0.00 C ATOM 910 CG GLU A 319 -3.953 -11.767 -7.398 1.00 0.00 C ATOM 911 CD GLU A 319 -3.745 -13.173 -6.875 1.00 0.00 C ATOM 912 OE1 GLU A 319 -2.594 -13.657 -6.915 1.00 0.00 O ATOM 913 OE2 GLU A 319 -4.734 -13.790 -6.429 1.00 0.00 O ATOM 0 H GLU A 319 -2.399 -9.227 -4.747 1.00 0.00 H new ATOM 0 HA GLU A 319 -1.499 -11.434 -6.336 1.00 0.00 H new ATOM 0 HB2 GLU A 319 -3.843 -11.009 -5.401 1.00 0.00 H new ATOM 0 HB3 GLU A 319 -4.026 -9.772 -6.629 1.00 0.00 H new ATOM 0 HG2 GLU A 319 -5.006 -11.624 -7.641 1.00 0.00 H new ATOM 0 HG3 GLU A 319 -3.392 -11.639 -8.324 1.00 0.00 H new ATOM 920 N ALA A 320 -2.042 -8.493 -7.770 1.00 0.00 N ATOM 921 CA ALA A 320 -1.739 -7.677 -8.938 1.00 0.00 C ATOM 922 C ALA A 320 -0.253 -7.417 -9.069 1.00 0.00 C ATOM 923 O ALA A 320 0.337 -7.608 -10.129 1.00 0.00 O ATOM 924 CB ALA A 320 -2.445 -6.330 -8.828 1.00 0.00 C ATOM 0 H ALA A 320 -2.602 -8.019 -7.061 1.00 0.00 H new ATOM 0 HA ALA A 320 -2.084 -8.227 -9.813 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -2.214 -5.725 -9.705 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -3.522 -6.487 -8.770 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -2.105 -5.813 -7.931 1.00 0.00 H new ATOM 930 N THR A 321 0.334 -6.964 -7.977 1.00 0.00 N ATOM 931 CA THR A 321 1.743 -6.630 -7.940 1.00 0.00 C ATOM 932 C THR A 321 2.605 -7.869 -7.955 1.00 0.00 C ATOM 933 O THR A 321 3.759 -7.817 -8.362 1.00 0.00 O ATOM 934 CB THR A 321 2.025 -5.794 -6.697 1.00 0.00 C ATOM 935 OG1 THR A 321 2.110 -6.614 -5.541 1.00 0.00 O ATOM 936 CG2 THR A 321 0.958 -4.749 -6.440 1.00 0.00 C ATOM 0 H THR A 321 -0.153 -6.818 -7.093 1.00 0.00 H new ATOM 0 HA THR A 321 1.991 -6.055 -8.832 1.00 0.00 H new ATOM 0 HB THR A 321 2.974 -5.294 -6.890 1.00 0.00 H new ATOM 0 HG1 THR A 321 1.242 -7.039 -5.377 1.00 0.00 H new ATOM 0 HG21 THR A 321 1.211 -4.184 -5.543 1.00 0.00 H new ATOM 0 HG22 THR A 321 0.900 -4.071 -7.292 1.00 0.00 H new ATOM 0 HG23 THR A 321 -0.005 -5.239 -6.300 1.00 0.00 H new ATOM 1049 N PHE A 328 4.809 -9.089 5.708 1.00 0.00 N ATOM 1050 CA PHE A 328 5.511 -8.084 6.500 1.00 0.00 C ATOM 1051 C PHE A 328 5.338 -6.684 5.912 1.00 0.00 C ATOM 1052 O PHE A 328 5.641 -5.687 6.571 1.00 0.00 O ATOM 1053 CB PHE A 328 6.997 -8.421 6.609 1.00 0.00 C ATOM 1054 CG PHE A 328 7.566 -8.122 7.959 1.00 0.00 C ATOM 1055 CD1 PHE A 328 7.856 -6.820 8.329 1.00 0.00 C ATOM 1056 CD2 PHE A 328 7.808 -9.142 8.858 1.00 0.00 C ATOM 1057 CE1 PHE A 328 8.384 -6.542 9.576 1.00 0.00 C ATOM 1058 CE2 PHE A 328 8.333 -8.874 10.105 1.00 0.00 C ATOM 1059 CZ PHE A 328 8.624 -7.572 10.465 1.00 0.00 C ATOM 0 HA PHE A 328 5.070 -8.092 7.497 1.00 0.00 H new ATOM 0 HB2 PHE A 328 7.142 -9.478 6.386 1.00 0.00 H new ATOM 0 HB3 PHE A 328 7.548 -7.858 5.856 1.00 0.00 H new ATOM 0 HD1 PHE A 328 7.668 -6.013 7.636 1.00 0.00 H new ATOM 0 HD2 PHE A 328 7.584 -10.162 8.581 1.00 0.00 H new ATOM 0 HE1 PHE A 328 8.608 -5.523 9.854 1.00 0.00 H new ATOM 0 HE2 PHE A 328 8.516 -9.681 10.799 1.00 0.00 H new ATOM 0 HZ PHE A 328 9.038 -7.360 11.440 1.00 0.00 H new ATOM 1069 N VAL A 329 4.854 -6.614 4.668 1.00 0.00 N ATOM 1070 CA VAL A 329 4.624 -5.336 3.993 1.00 0.00 C ATOM 1071 C VAL A 329 3.300 -4.693 4.415 1.00 0.00 C ATOM 1072 O VAL A 329 3.174 -3.472 4.448 1.00 0.00 O ATOM 1073 CB VAL A 329 4.630 -5.481 2.458 1.00 0.00 C ATOM 1074 CG1 VAL A 329 3.467 -6.347 1.992 1.00 0.00 C ATOM 1075 CG2 VAL A 329 4.579 -4.108 1.802 1.00 0.00 C ATOM 0 H VAL A 329 4.614 -7.432 4.108 1.00 0.00 H new ATOM 0 HA VAL A 329 5.450 -4.693 4.297 1.00 0.00 H new ATOM 0 HB VAL A 329 5.555 -5.974 2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 329 3.491 -6.435 0.906 1.00 0.00 H new ATOM 0 HG12 VAL A 329 3.549 -7.338 2.439 1.00 0.00 H new ATOM 0 HG13 VAL A 329 2.527 -5.888 2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 329 4.584 -4.222 0.718 1.00 0.00 H new ATOM 0 HG22 VAL A 329 3.669 -3.592 2.109 1.00 0.00 H new ATOM 0 HG23 VAL A 329 5.448 -3.526 2.109 1.00 0.00 H new ATOM 1085 N ILE A 330 2.302 -5.527 4.697 1.00 0.00 N ATOM 1086 CA ILE A 330 0.979 -5.040 5.075 1.00 0.00 C ATOM 1087 C ILE A 330 1.004 -4.167 6.326 1.00 0.00 C ATOM 1088 O ILE A 330 0.217 -3.231 6.431 1.00 0.00 O ATOM 1089 CB ILE A 330 -0.019 -6.208 5.266 1.00 0.00 C ATOM 1090 CG1 ILE A 330 -1.458 -5.724 5.105 1.00 0.00 C ATOM 1091 CG2 ILE A 330 0.149 -6.914 6.610 1.00 0.00 C ATOM 1092 CD1 ILE A 330 -2.452 -6.857 5.112 1.00 0.00 C ATOM 0 H ILE A 330 2.385 -6.543 4.671 1.00 0.00 H new ATOM 0 HA ILE A 330 0.643 -4.416 4.247 1.00 0.00 H new ATOM 0 HB ILE A 330 0.206 -6.937 4.487 1.00 0.00 H new ATOM 0 HG12 ILE A 330 -1.697 -5.030 5.911 1.00 0.00 H new ATOM 0 HG13 ILE A 330 -1.549 -5.170 4.170 1.00 0.00 H new ATOM 0 HG21 ILE A 330 -0.576 -7.724 6.689 1.00 0.00 H new ATOM 0 HG22 ILE A 330 1.157 -7.322 6.683 1.00 0.00 H new ATOM 0 HG23 ILE A 330 -0.014 -6.201 7.418 1.00 0.00 H new ATOM 0 HD11 ILE A 330 -3.459 -6.458 4.994 1.00 0.00 H new ATOM 0 HD12 ILE A 330 -2.233 -7.538 4.290 1.00 0.00 H new ATOM 0 HD13 ILE A 330 -2.383 -7.396 6.057 1.00 0.00 H new ATOM 1104 N PRO A 331 1.878 -4.466 7.304 1.00 0.00 N ATOM 1105 CA PRO A 331 1.956 -3.704 8.552 1.00 0.00 C ATOM 1106 C PRO A 331 2.612 -2.345 8.391 1.00 0.00 C ATOM 1107 O PRO A 331 2.172 -1.360 8.987 1.00 0.00 O ATOM 1108 CB PRO A 331 2.789 -4.597 9.479 1.00 0.00 C ATOM 1109 CG PRO A 331 2.937 -5.900 8.761 1.00 0.00 C ATOM 1110 CD PRO A 331 2.830 -5.576 7.304 1.00 0.00 C ATOM 0 HA PRO A 331 0.960 -3.480 8.934 1.00 0.00 H new ATOM 0 HB2 PRO A 331 3.762 -4.150 9.683 1.00 0.00 H new ATOM 0 HB3 PRO A 331 2.293 -4.734 10.440 1.00 0.00 H new ATOM 0 HG2 PRO A 331 3.896 -6.365 8.989 1.00 0.00 H new ATOM 0 HG3 PRO A 331 2.161 -6.604 9.063 1.00 0.00 H new ATOM 0 HD2 PRO A 331 3.792 -5.288 6.879 1.00 0.00 H new ATOM 0 HD3 PRO A 331 2.467 -6.424 6.724 1.00 0.00 H new ATOM 1118 N PHE A 332 3.657 -2.290 7.586 1.00 0.00 N ATOM 1119 CA PHE A 332 4.355 -1.043 7.349 1.00 0.00 C ATOM 1120 C PHE A 332 3.359 -0.010 6.833 1.00 0.00 C ATOM 1121 O PHE A 332 3.284 1.108 7.344 1.00 0.00 O ATOM 1122 CB PHE A 332 5.517 -1.277 6.368 1.00 0.00 C ATOM 1123 CG PHE A 332 5.495 -0.437 5.123 1.00 0.00 C ATOM 1124 CD1 PHE A 332 4.770 -0.836 4.017 1.00 0.00 C ATOM 1125 CD2 PHE A 332 6.210 0.741 5.063 1.00 0.00 C ATOM 1126 CE1 PHE A 332 4.753 -0.071 2.870 1.00 0.00 C ATOM 1127 CE2 PHE A 332 6.201 1.515 3.917 1.00 0.00 C ATOM 1128 CZ PHE A 332 5.469 1.108 2.818 1.00 0.00 C ATOM 0 H PHE A 332 4.039 -3.093 7.087 1.00 0.00 H new ATOM 0 HA PHE A 332 4.787 -0.661 8.274 1.00 0.00 H new ATOM 0 HB2 PHE A 332 6.454 -1.092 6.893 1.00 0.00 H new ATOM 0 HB3 PHE A 332 5.516 -2.327 6.076 1.00 0.00 H new ATOM 0 HD1 PHE A 332 4.210 -1.759 4.051 1.00 0.00 H new ATOM 0 HD2 PHE A 332 6.783 1.062 5.920 1.00 0.00 H new ATOM 0 HE1 PHE A 332 4.180 -0.394 2.013 1.00 0.00 H new ATOM 0 HE2 PHE A 332 6.765 2.435 3.881 1.00 0.00 H new ATOM 0 HZ PHE A 332 5.457 1.710 1.922 1.00 0.00 H new ATOM 1138 N LEU A 333 2.567 -0.409 5.841 1.00 0.00 N ATOM 1139 CA LEU A 333 1.556 0.476 5.285 1.00 0.00 C ATOM 1140 C LEU A 333 0.640 0.993 6.396 1.00 0.00 C ATOM 1141 O LEU A 333 0.236 2.150 6.381 1.00 0.00 O ATOM 1142 CB LEU A 333 0.752 -0.229 4.184 1.00 0.00 C ATOM 1143 CG LEU A 333 0.339 0.678 3.015 1.00 0.00 C ATOM 1144 CD1 LEU A 333 -0.443 -0.108 1.980 1.00 0.00 C ATOM 1145 CD2 LEU A 333 -0.479 1.862 3.505 1.00 0.00 C ATOM 0 H LEU A 333 2.607 -1.333 5.411 1.00 0.00 H new ATOM 0 HA LEU A 333 2.056 1.330 4.827 1.00 0.00 H new ATOM 0 HB2 LEU A 333 1.344 -1.057 3.793 1.00 0.00 H new ATOM 0 HB3 LEU A 333 -0.146 -0.660 4.627 1.00 0.00 H new ATOM 0 HG LEU A 333 1.248 1.060 2.551 1.00 0.00 H new ATOM 0 HD11 LEU A 333 -0.727 0.552 1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 333 0.175 -0.919 1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 333 -1.341 -0.522 2.439 1.00 0.00 H new ATOM 0 HD21 LEU A 333 -0.758 2.487 2.657 1.00 0.00 H new ATOM 0 HD22 LEU A 333 -1.380 1.501 4.002 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.113 2.447 4.208 1.00 0.00 H new ATOM 1157 N LYS A 334 0.348 0.128 7.373 1.00 0.00 N ATOM 1158 CA LYS A 334 -0.500 0.495 8.514 1.00 0.00 C ATOM 1159 C LYS A 334 0.148 1.585 9.355 1.00 0.00 C ATOM 1160 O LYS A 334 -0.526 2.495 9.830 1.00 0.00 O ATOM 1161 CB LYS A 334 -0.787 -0.726 9.404 1.00 0.00 C ATOM 1162 CG LYS A 334 -1.094 -1.989 8.627 1.00 0.00 C ATOM 1163 CD LYS A 334 -1.627 -3.101 9.522 1.00 0.00 C ATOM 1164 CE LYS A 334 -0.595 -3.563 10.537 1.00 0.00 C ATOM 1165 NZ LYS A 334 -1.197 -4.376 11.625 1.00 0.00 N ATOM 0 H LYS A 334 0.687 -0.834 7.397 1.00 0.00 H new ATOM 0 HA LYS A 334 -1.439 0.871 8.107 1.00 0.00 H new ATOM 0 HB2 LYS A 334 0.075 -0.906 10.047 1.00 0.00 H new ATOM 0 HB3 LYS A 334 -1.630 -0.498 10.057 1.00 0.00 H new ATOM 0 HG2 LYS A 334 -1.827 -1.767 7.851 1.00 0.00 H new ATOM 0 HG3 LYS A 334 -0.190 -2.332 8.123 1.00 0.00 H new ATOM 0 HD2 LYS A 334 -2.517 -2.750 10.045 1.00 0.00 H new ATOM 0 HD3 LYS A 334 -1.932 -3.947 8.906 1.00 0.00 H new ATOM 0 HE2 LYS A 334 0.172 -4.149 10.031 1.00 0.00 H new ATOM 0 HE3 LYS A 334 -0.099 -2.694 10.968 1.00 0.00 H new ATOM 0 HZ1 LYS A 334 -0.454 -4.668 12.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 334 -1.911 -3.810 12.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 334 -1.648 -5.220 11.219 1.00 0.00 H new ATOM 1179 N ALA A 335 1.457 1.485 9.549 1.00 0.00 N ATOM 1180 CA ALA A 335 2.179 2.466 10.343 1.00 0.00 C ATOM 1181 C ALA A 335 2.329 3.774 9.591 1.00 0.00 C ATOM 1182 O ALA A 335 2.282 4.851 10.184 1.00 0.00 O ATOM 1183 CB ALA A 335 3.546 1.931 10.724 1.00 0.00 C ATOM 0 H ALA A 335 2.037 0.737 9.168 1.00 0.00 H new ATOM 0 HA ALA A 335 1.602 2.655 11.248 1.00 0.00 H new ATOM 0 HB1 ALA A 335 4.076 2.676 11.318 1.00 0.00 H new ATOM 0 HB2 ALA A 335 3.430 1.017 11.307 1.00 0.00 H new ATOM 0 HB3 ALA A 335 4.117 1.715 9.821 1.00 0.00 H new ATOM 1189 N ASN A 336 2.548 3.674 8.290 1.00 0.00 N ATOM 1190 CA ASN A 336 2.739 4.848 7.471 1.00 0.00 C ATOM 1191 C ASN A 336 1.418 5.381 6.931 1.00 0.00 C ATOM 1192 O ASN A 336 1.340 6.515 6.469 1.00 0.00 O ATOM 1193 CB ASN A 336 3.681 4.507 6.328 1.00 0.00 C ATOM 1194 CG ASN A 336 3.174 3.365 5.483 1.00 0.00 C ATOM 1195 OD1 ASN A 336 2.032 3.372 5.027 1.00 0.00 O ATOM 1196 ND2 ASN A 336 4.029 2.386 5.257 1.00 0.00 N ATOM 0 H ASN A 336 2.597 2.790 7.784 1.00 0.00 H new ATOM 0 HA ASN A 336 3.173 5.635 8.088 1.00 0.00 H new ATOM 0 HB2 ASN A 336 3.818 5.387 5.699 1.00 0.00 H new ATOM 0 HB3 ASN A 336 4.660 4.249 6.733 1.00 0.00 H new ATOM 0 HD21 ASN A 336 3.753 1.590 4.682 1.00 0.00 H new ATOM 0 HD22 ASN A 336 4.966 2.425 5.657 1.00 0.00 H new ATOM 1203 N LEU A 337 0.385 4.558 6.992 1.00 0.00 N ATOM 1204 CA LEU A 337 -0.932 4.941 6.506 1.00 0.00 C ATOM 1205 C LEU A 337 -1.401 6.296 7.061 1.00 0.00 C ATOM 1206 O LEU A 337 -1.964 7.103 6.326 1.00 0.00 O ATOM 1207 CB LEU A 337 -1.949 3.871 6.884 1.00 0.00 C ATOM 1208 CG LEU A 337 -3.207 3.834 6.020 1.00 0.00 C ATOM 1209 CD1 LEU A 337 -4.102 5.013 6.346 1.00 0.00 C ATOM 1210 CD2 LEU A 337 -2.846 3.825 4.540 1.00 0.00 C ATOM 0 H LEU A 337 0.433 3.614 7.376 1.00 0.00 H new ATOM 0 HA LEU A 337 -0.855 5.038 5.423 1.00 0.00 H new ATOM 0 HB2 LEU A 337 -1.463 2.897 6.832 1.00 0.00 H new ATOM 0 HB3 LEU A 337 -2.245 4.025 7.922 1.00 0.00 H new ATOM 0 HG LEU A 337 -3.750 2.915 6.240 1.00 0.00 H new ATOM 0 HD11 LEU A 337 -4.996 4.975 5.723 1.00 0.00 H new ATOM 0 HD12 LEU A 337 -4.390 4.972 7.396 1.00 0.00 H new ATOM 0 HD13 LEU A 337 -3.565 5.942 6.153 1.00 0.00 H new ATOM 0 HD21 LEU A 337 -3.758 3.798 3.943 1.00 0.00 H new ATOM 0 HD22 LEU A 337 -2.280 4.725 4.298 1.00 0.00 H new ATOM 0 HD23 LEU A 337 -2.242 2.945 4.318 1.00 0.00 H new ATOM 1222 N PRO A 338 -1.186 6.563 8.372 1.00 0.00 N ATOM 1223 CA PRO A 338 -1.608 7.826 9.011 1.00 0.00 C ATOM 1224 C PRO A 338 -0.955 9.042 8.370 1.00 0.00 C ATOM 1225 O PRO A 338 -1.547 10.118 8.286 1.00 0.00 O ATOM 1226 CB PRO A 338 -1.132 7.669 10.469 1.00 0.00 C ATOM 1227 CG PRO A 338 -0.951 6.202 10.662 1.00 0.00 C ATOM 1228 CD PRO A 338 -0.519 5.665 9.330 1.00 0.00 C ATOM 0 HA PRO A 338 -2.681 7.992 8.915 1.00 0.00 H new ATOM 0 HB2 PRO A 338 -0.200 8.207 10.639 1.00 0.00 H new ATOM 0 HB3 PRO A 338 -1.865 8.071 11.169 1.00 0.00 H new ATOM 0 HG2 PRO A 338 -0.202 5.998 11.427 1.00 0.00 H new ATOM 0 HG3 PRO A 338 -1.879 5.733 10.990 1.00 0.00 H new ATOM 0 HD2 PRO A 338 0.565 5.690 9.218 1.00 0.00 H new ATOM 0 HD3 PRO A 338 -0.829 4.629 9.194 1.00 0.00 H new ATOM 1236 N LEU A 339 0.273 8.864 7.920 1.00 0.00 N ATOM 1237 CA LEU A 339 1.023 9.938 7.293 1.00 0.00 C ATOM 1238 C LEU A 339 0.479 10.247 5.904 1.00 0.00 C ATOM 1239 O LEU A 339 0.160 11.392 5.587 1.00 0.00 O ATOM 1240 CB LEU A 339 2.506 9.544 7.237 1.00 0.00 C ATOM 1241 CG LEU A 339 3.227 9.417 8.590 1.00 0.00 C ATOM 1242 CD1 LEU A 339 4.615 10.053 8.529 1.00 0.00 C ATOM 1243 CD2 LEU A 339 2.443 10.031 9.735 1.00 0.00 C ATOM 0 H LEU A 339 0.776 7.979 7.978 1.00 0.00 H new ATOM 0 HA LEU A 339 0.917 10.847 7.885 1.00 0.00 H new ATOM 0 HB2 LEU A 339 2.588 8.591 6.715 1.00 0.00 H new ATOM 0 HB3 LEU A 339 3.034 10.284 6.635 1.00 0.00 H new ATOM 0 HG LEU A 339 3.318 8.348 8.785 1.00 0.00 H new ATOM 0 HD11 LEU A 339 5.105 9.951 9.497 1.00 0.00 H new ATOM 0 HD12 LEU A 339 5.211 9.553 7.766 1.00 0.00 H new ATOM 0 HD13 LEU A 339 4.520 11.110 8.280 1.00 0.00 H new ATOM 0 HD21 LEU A 339 3.001 9.911 10.664 1.00 0.00 H new ATOM 0 HD22 LEU A 339 2.286 11.092 9.541 1.00 0.00 H new ATOM 0 HD23 LEU A 339 1.478 9.532 9.824 1.00 0.00 H new ATOM 1255 N LEU A 340 0.372 9.217 5.089 1.00 0.00 N ATOM 1256 CA LEU A 340 -0.141 9.365 3.720 1.00 0.00 C ATOM 1257 C LEU A 340 -1.519 10.010 3.687 1.00 0.00 C ATOM 1258 O LEU A 340 -1.816 10.786 2.783 1.00 0.00 O ATOM 1259 CB LEU A 340 -0.208 8.013 3.004 1.00 0.00 C ATOM 1260 CG LEU A 340 0.445 6.862 3.756 1.00 0.00 C ATOM 1261 CD1 LEU A 340 0.062 5.529 3.149 1.00 0.00 C ATOM 1262 CD2 LEU A 340 1.951 7.047 3.780 1.00 0.00 C ATOM 0 H LEU A 340 0.631 8.263 5.341 1.00 0.00 H new ATOM 0 HA LEU A 340 0.561 10.019 3.203 1.00 0.00 H new ATOM 0 HB2 LEU A 340 -1.254 7.764 2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 340 0.270 8.109 2.029 1.00 0.00 H new ATOM 0 HG LEU A 340 0.082 6.865 4.784 1.00 0.00 H new ATOM 0 HD11 LEU A 340 0.542 4.724 3.706 1.00 0.00 H new ATOM 0 HD12 LEU A 340 -1.020 5.406 3.194 1.00 0.00 H new ATOM 0 HD13 LEU A 340 0.388 5.496 2.109 1.00 0.00 H new ATOM 0 HD21 LEU A 340 2.411 6.219 4.320 1.00 0.00 H new ATOM 0 HD22 LEU A 340 2.331 7.070 2.759 1.00 0.00 H new ATOM 0 HD23 LEU A 340 2.194 7.985 4.279 1.00 0.00 H new ATOM 1274 N GLN A 341 -2.362 9.682 4.660 1.00 0.00 N ATOM 1275 CA GLN A 341 -3.714 10.234 4.714 1.00 0.00 C ATOM 1276 C GLN A 341 -3.715 11.626 5.321 1.00 0.00 C ATOM 1277 O GLN A 341 -4.238 12.574 4.735 1.00 0.00 O ATOM 1278 CB GLN A 341 -4.635 9.320 5.522 1.00 0.00 C ATOM 1279 CG GLN A 341 -4.581 7.878 5.076 1.00 0.00 C ATOM 1280 CD GLN A 341 -5.888 7.399 4.482 1.00 0.00 C ATOM 1281 OE1 GLN A 341 -6.949 7.966 4.746 1.00 0.00 O ATOM 1282 NE2 GLN A 341 -5.816 6.350 3.674 1.00 0.00 N ATOM 0 H GLN A 341 -2.136 9.040 5.420 1.00 0.00 H new ATOM 0 HA GLN A 341 -4.084 10.302 3.691 1.00 0.00 H new ATOM 0 HB2 GLN A 341 -4.361 9.378 6.575 1.00 0.00 H new ATOM 0 HB3 GLN A 341 -5.660 9.682 5.438 1.00 0.00 H new ATOM 0 HG2 GLN A 341 -3.787 7.760 4.339 1.00 0.00 H new ATOM 0 HG3 GLN A 341 -4.322 7.249 5.927 1.00 0.00 H new ATOM 0 HE21 GLN A 341 -4.914 5.913 3.485 1.00 0.00 H new ATOM 0 HE22 GLN A 341 -6.663 5.980 3.242 1.00 0.00 H new ATOM 1291 N ARG A 342 -3.130 11.741 6.506 1.00 0.00 N ATOM 1292 CA ARG A 342 -3.068 13.016 7.206 1.00 0.00 C ATOM 1293 C ARG A 342 -2.505 14.118 6.310 1.00 0.00 C ATOM 1294 O ARG A 342 -3.147 15.147 6.101 1.00 0.00 O ATOM 1295 CB ARG A 342 -2.225 12.893 8.480 1.00 0.00 C ATOM 1296 CG ARG A 342 -2.802 13.655 9.660 1.00 0.00 C ATOM 1297 CD ARG A 342 -1.793 14.626 10.245 1.00 0.00 C ATOM 1298 NE ARG A 342 -2.426 15.853 10.719 1.00 0.00 N ATOM 1299 CZ ARG A 342 -1.755 16.871 11.249 1.00 0.00 C ATOM 1300 NH1 ARG A 342 -0.436 16.812 11.376 1.00 0.00 N ATOM 1301 NH2 ARG A 342 -2.406 17.953 11.654 1.00 0.00 N ATOM 0 H ARG A 342 -2.691 10.965 7.003 1.00 0.00 H new ATOM 0 HA ARG A 342 -4.087 13.289 7.481 1.00 0.00 H new ATOM 0 HB2 ARG A 342 -2.134 11.840 8.746 1.00 0.00 H new ATOM 0 HB3 ARG A 342 -1.218 13.259 8.278 1.00 0.00 H new ATOM 0 HG2 ARG A 342 -3.691 14.200 9.342 1.00 0.00 H new ATOM 0 HG3 ARG A 342 -3.118 12.951 10.429 1.00 0.00 H new ATOM 0 HD2 ARG A 342 -1.266 14.148 11.071 1.00 0.00 H new ATOM 0 HD3 ARG A 342 -1.046 14.872 9.490 1.00 0.00 H new ATOM 0 HE ARG A 342 -3.440 15.934 10.639 1.00 0.00 H new ATOM 0 HH11 ARG A 342 0.070 15.982 11.066 1.00 0.00 H new ATOM 0 HH12 ARG A 342 0.073 17.597 11.783 1.00 0.00 H new ATOM 0 HH21 ARG A 342 -3.420 18.003 11.559 1.00 0.00 H new ATOM 0 HH22 ARG A 342 -1.892 18.735 12.061 1.00 0.00 H new ATOM 1315 N GLU A 343 -1.306 13.898 5.785 1.00 0.00 N ATOM 1316 CA GLU A 343 -0.667 14.879 4.917 1.00 0.00 C ATOM 1317 C GLU A 343 -1.507 15.155 3.676 1.00 0.00 C ATOM 1318 O GLU A 343 -1.607 16.297 3.226 1.00 0.00 O ATOM 1319 CB GLU A 343 0.725 14.409 4.505 1.00 0.00 C ATOM 1320 CG GLU A 343 1.834 15.144 5.231 1.00 0.00 C ATOM 1321 CD GLU A 343 2.508 16.191 4.369 1.00 0.00 C ATOM 1322 OE1 GLU A 343 2.814 15.887 3.199 1.00 0.00 O ATOM 1323 OE2 GLU A 343 2.728 17.316 4.866 1.00 0.00 O ATOM 0 H GLU A 343 -0.758 13.052 5.944 1.00 0.00 H new ATOM 0 HA GLU A 343 -0.577 15.806 5.483 1.00 0.00 H new ATOM 0 HB2 GLU A 343 0.815 13.341 4.701 1.00 0.00 H new ATOM 0 HB3 GLU A 343 0.847 14.547 3.431 1.00 0.00 H new ATOM 0 HG2 GLU A 343 1.425 15.622 6.121 1.00 0.00 H new ATOM 0 HG3 GLU A 343 2.579 14.424 5.570 1.00 0.00 H new ATOM 1746 N GLU B 16 14.648 0.913 2.169 1.00 0.00 N ATOM 1747 CA GLU B 16 13.223 1.225 2.199 1.00 0.00 C ATOM 1748 C GLU B 16 12.390 0.144 1.502 1.00 0.00 C ATOM 1749 O GLU B 16 11.472 -0.422 2.097 1.00 0.00 O ATOM 1750 CB GLU B 16 12.983 2.579 1.530 1.00 0.00 C ATOM 1751 CG GLU B 16 11.536 3.036 1.563 1.00 0.00 C ATOM 1752 CD GLU B 16 10.918 3.094 0.183 1.00 0.00 C ATOM 1753 OE1 GLU B 16 11.411 3.883 -0.651 1.00 0.00 O ATOM 1754 OE2 GLU B 16 9.940 2.358 -0.065 1.00 0.00 O ATOM 0 HA GLU B 16 12.908 1.264 3.242 1.00 0.00 H new ATOM 0 HB2 GLU B 16 13.602 3.330 2.021 1.00 0.00 H new ATOM 0 HB3 GLU B 16 13.312 2.523 0.492 1.00 0.00 H new ATOM 0 HG2 GLU B 16 10.957 2.357 2.189 1.00 0.00 H new ATOM 0 HG3 GLU B 16 11.479 4.022 2.025 1.00 0.00 H new ATOM 1761 N LEU B 17 12.712 -0.130 0.239 1.00 0.00 N ATOM 1762 CA LEU B 17 11.993 -1.131 -0.546 1.00 0.00 C ATOM 1763 C LEU B 17 12.301 -2.546 -0.055 1.00 0.00 C ATOM 1764 O LEU B 17 11.480 -3.452 -0.184 1.00 0.00 O ATOM 1765 CB LEU B 17 12.360 -0.992 -2.026 1.00 0.00 C ATOM 1766 CG LEU B 17 11.217 -0.530 -2.936 1.00 0.00 C ATOM 1767 CD1 LEU B 17 10.158 -1.614 -3.043 1.00 0.00 C ATOM 1768 CD2 LEU B 17 10.601 0.763 -2.412 1.00 0.00 C ATOM 0 H LEU B 17 13.470 0.330 -0.264 1.00 0.00 H new ATOM 0 HA LEU B 17 10.924 -0.960 -0.422 1.00 0.00 H new ATOM 0 HB2 LEU B 17 13.184 -0.284 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU B 17 12.725 -1.954 -2.386 1.00 0.00 H new ATOM 0 HG LEU B 17 11.624 -0.338 -3.929 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.352 -1.272 -3.692 1.00 0.00 H new ATOM 0 HD12 LEU B 17 10.603 -2.517 -3.461 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.758 -1.831 -2.052 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.791 1.074 -3.072 1.00 0.00 H new ATOM 0 HD22 LEU B 17 10.208 0.598 -1.409 1.00 0.00 H new ATOM 0 HD23 LEU B 17 11.363 1.542 -2.380 1.00 0.00 H new ATOM 1780 N SER B 18 13.492 -2.732 0.502 1.00 0.00 N ATOM 1781 CA SER B 18 13.902 -4.043 1.010 1.00 0.00 C ATOM 1782 C SER B 18 13.301 -4.319 2.387 1.00 0.00 C ATOM 1783 O SER B 18 13.072 -5.472 2.749 1.00 0.00 O ATOM 1784 CB SER B 18 15.427 -4.158 1.076 1.00 0.00 C ATOM 1785 OG SER B 18 15.907 -5.104 0.138 1.00 0.00 O ATOM 0 H SER B 18 14.191 -1.997 0.615 1.00 0.00 H new ATOM 0 HA SER B 18 13.525 -4.790 0.312 1.00 0.00 H new ATOM 0 HB2 SER B 18 15.877 -3.185 0.879 1.00 0.00 H new ATOM 0 HB3 SER B 18 15.730 -4.452 2.081 1.00 0.00 H new ATOM 0 HG SER B 18 16.884 -5.158 0.198 1.00 0.00 H new ATOM 1791 N ASP B 19 13.050 -3.263 3.155 1.00 0.00 N ATOM 1792 CA ASP B 19 12.478 -3.415 4.488 1.00 0.00 C ATOM 1793 C ASP B 19 11.057 -3.970 4.432 1.00 0.00 C ATOM 1794 O ASP B 19 10.417 -4.158 5.469 1.00 0.00 O ATOM 1795 CB ASP B 19 12.492 -2.082 5.238 1.00 0.00 C ATOM 1796 CG ASP B 19 13.074 -2.223 6.629 1.00 0.00 C ATOM 1797 OD1 ASP B 19 14.311 -2.118 6.770 1.00 0.00 O ATOM 1798 OD2 ASP B 19 12.292 -2.443 7.579 1.00 0.00 O ATOM 0 H ASP B 19 13.233 -2.298 2.879 1.00 0.00 H new ATOM 0 HA ASP B 19 13.098 -4.132 5.027 1.00 0.00 H new ATOM 0 HB2 ASP B 19 13.074 -1.354 4.673 1.00 0.00 H new ATOM 0 HB3 ASP B 19 11.476 -1.694 5.307 1.00 0.00 H new ATOM 1803 N LEU B 20 10.556 -4.216 3.224 1.00 0.00 N ATOM 1804 CA LEU B 20 9.202 -4.734 3.055 1.00 0.00 C ATOM 1805 C LEU B 20 9.127 -5.725 1.903 1.00 0.00 C ATOM 1806 O LEU B 20 8.389 -6.711 1.967 1.00 0.00 O ATOM 1807 CB LEU B 20 8.241 -3.577 2.832 1.00 0.00 C ATOM 1808 CG LEU B 20 8.559 -2.337 3.650 1.00 0.00 C ATOM 1809 CD1 LEU B 20 7.878 -1.114 3.060 1.00 0.00 C ATOM 1810 CD2 LEU B 20 8.152 -2.563 5.098 1.00 0.00 C ATOM 0 H LEU B 20 11.064 -4.066 2.353 1.00 0.00 H new ATOM 0 HA LEU B 20 8.919 -5.268 3.962 1.00 0.00 H new ATOM 0 HB2 LEU B 20 8.248 -3.313 1.775 1.00 0.00 H new ATOM 0 HB3 LEU B 20 7.230 -3.907 3.072 1.00 0.00 H new ATOM 0 HG LEU B 20 9.633 -2.152 3.621 1.00 0.00 H new ATOM 0 HD11 LEU B 20 8.119 -0.238 3.661 1.00 0.00 H new ATOM 0 HD12 LEU B 20 8.227 -0.961 2.039 1.00 0.00 H new ATOM 0 HD13 LEU B 20 6.799 -1.265 3.056 1.00 0.00 H new ATOM 0 HD21 LEU B 20 8.381 -1.673 5.683 1.00 0.00 H new ATOM 0 HD22 LEU B 20 7.082 -2.765 5.148 1.00 0.00 H new ATOM 0 HD23 LEU B 20 8.701 -3.414 5.502 1.00 0.00 H new ATOM 1822 N LEU B 21 9.901 -5.474 0.856 1.00 0.00 N ATOM 1823 CA LEU B 21 9.935 -6.360 -0.294 1.00 0.00 C ATOM 1824 C LEU B 21 11.206 -7.203 -0.247 1.00 0.00 C ATOM 1825 O LEU B 21 11.941 -7.185 0.743 1.00 0.00 O ATOM 1826 CB LEU B 21 9.869 -5.557 -1.605 1.00 0.00 C ATOM 1827 CG LEU B 21 8.631 -5.812 -2.486 1.00 0.00 C ATOM 1828 CD1 LEU B 21 8.614 -4.864 -3.681 1.00 0.00 C ATOM 1829 CD2 LEU B 21 8.585 -7.260 -2.961 1.00 0.00 C ATOM 0 H LEU B 21 10.514 -4.662 0.782 1.00 0.00 H new ATOM 0 HA LEU B 21 9.066 -7.017 -0.261 1.00 0.00 H new ATOM 0 HB2 LEU B 21 9.905 -4.495 -1.361 1.00 0.00 H new ATOM 0 HB3 LEU B 21 10.761 -5.780 -2.191 1.00 0.00 H new ATOM 0 HG LEU B 21 7.746 -5.623 -1.879 1.00 0.00 H new ATOM 0 HD11 LEU B 21 7.732 -5.061 -4.290 1.00 0.00 H new ATOM 0 HD12 LEU B 21 8.588 -3.833 -3.327 1.00 0.00 H new ATOM 0 HD13 LEU B 21 9.511 -5.019 -4.281 1.00 0.00 H new ATOM 0 HD21 LEU B 21 7.701 -7.412 -3.581 1.00 0.00 H new ATOM 0 HD22 LEU B 21 9.479 -7.480 -3.544 1.00 0.00 H new ATOM 0 HD23 LEU B 21 8.542 -7.925 -2.098 1.00 0.00 H new