USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 555 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 290 SER OG : rot 180:sc=-0.00962 USER MOD Set 1.2: A 294 MET CE :methyl 148:sc= -0.0659 (180deg=-1.79!) USER MOD Single : A 293 THR OG1 : rot -169:sc= -0.205 USER MOD Single : A 295 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.0143) USER MOD Single : A 301 THR OG1 : rot 41:sc= -0.0597 USER MOD Single : A 305 GLN : amide:sc= 0 X(o=0,f=-0.0022) USER MOD Single : A 306 THR OG1 : rot 180:sc= 0 USER MOD Single : A 310 HIS : no HD1:sc= -4.81! C(o=-4.8!,f=-8.7!) USER MOD Single : A 311 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 312 CYS SG : rot -82:sc= -4.44! USER MOD Single : A 313 GLN : amide:sc= -0.0575 K(o=-0.058,f=-2.3!) USER MOD Single : A 318 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 323 SER OG : rot -8:sc= 0.324! USER MOD Single : A 325 THR OG1 : rot 180:sc= -0.205 USER MOD Single : A 330 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 LYS NZ :NH3+ -147:sc=-0.00793 (180deg=-0.241) USER MOD Single : A 334 HIS : no HE2:sc= -0.0175 K(o=-0.017,f=-0.68) USER MOD Single : A 336 LYS NZ :NH3+ -163:sc= -0.0191 (180deg=-0.335) USER MOD Single : A 337 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0561) USER MOD Single : A 340 THR OG1 : rot 180:sc= 0 USER MOD Single : A 341 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 342 TYR OH : rot 180:sc= 0 USER MOD Single : A 344 SER OG : rot -40:sc= 0.12 USER MOD Single : A 345 THR OG1 : rot -37:sc= 0.244 USER MOD Single : A 346 ASN : amide:sc= -2.03 K(o=-2,f=-0.57) USER MOD Single : A 350 GLN : amide:sc= 0 K(o=0,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.556 2.979 2.943 1.00 0.00 N ATOM 2 CA PHE A 289 -18.239 2.411 2.532 1.00 0.00 C ATOM 3 C PHE A 289 -17.847 2.994 1.169 1.00 0.00 C ATOM 4 O PHE A 289 -16.894 2.564 0.552 1.00 0.00 O ATOM 5 CB PHE A 289 -18.349 0.882 2.397 1.00 0.00 C ATOM 6 CG PHE A 289 -18.146 0.205 3.737 1.00 0.00 C ATOM 7 CD1 PHE A 289 -18.741 0.724 4.896 1.00 0.00 C ATOM 8 CD2 PHE A 289 -17.364 -0.952 3.815 1.00 0.00 C ATOM 9 CE1 PHE A 289 -18.552 0.086 6.127 1.00 0.00 C ATOM 10 CE2 PHE A 289 -17.175 -1.590 5.047 1.00 0.00 C ATOM 11 CZ PHE A 289 -17.767 -1.071 6.203 1.00 0.00 C ATOM 0 HA PHE A 289 -17.490 2.660 3.284 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -19.328 0.618 1.996 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -17.605 0.521 1.686 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -19.346 1.617 4.838 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -16.905 -1.354 2.924 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -19.012 0.486 7.019 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -16.571 -2.484 5.105 1.00 0.00 H new ATOM 0 HZ PHE A 289 -17.619 -1.562 7.153 1.00 0.00 H new ATOM 21 N SER A 290 -18.595 3.942 0.679 1.00 0.00 N ATOM 22 CA SER A 290 -18.292 4.530 -0.659 1.00 0.00 C ATOM 23 C SER A 290 -17.425 5.792 -0.555 1.00 0.00 C ATOM 24 O SER A 290 -16.592 6.037 -1.404 1.00 0.00 O ATOM 25 CB SER A 290 -19.614 4.859 -1.368 1.00 0.00 C ATOM 26 OG SER A 290 -19.448 4.688 -2.769 1.00 0.00 O ATOM 0 H SER A 290 -19.409 4.338 1.149 1.00 0.00 H new ATOM 0 HA SER A 290 -17.723 3.797 -1.232 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.409 4.209 -1.002 1.00 0.00 H new ATOM 0 HB3 SER A 290 -19.914 5.884 -1.148 1.00 0.00 H new ATOM 0 HG SER A 290 -20.290 4.895 -3.226 1.00 0.00 H new ATOM 32 N PRO A 291 -17.625 6.602 0.449 1.00 0.00 N ATOM 33 CA PRO A 291 -16.859 7.858 0.615 1.00 0.00 C ATOM 34 C PRO A 291 -15.557 7.679 1.403 1.00 0.00 C ATOM 35 O PRO A 291 -14.509 8.107 0.980 1.00 0.00 O ATOM 36 CB PRO A 291 -17.842 8.748 1.378 1.00 0.00 C ATOM 37 CG PRO A 291 -18.641 7.801 2.228 1.00 0.00 C ATOM 38 CD PRO A 291 -18.595 6.423 1.537 1.00 0.00 C ATOM 0 HA PRO A 291 -16.530 8.265 -0.341 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.318 9.482 1.990 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -18.484 9.304 0.695 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -18.225 7.742 3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -19.670 8.148 2.328 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.280 5.641 2.228 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.574 6.135 1.155 1.00 0.00 H new ATOM 46 N GLU A 292 -15.623 7.079 2.556 1.00 0.00 N ATOM 47 CA GLU A 292 -14.383 6.908 3.384 1.00 0.00 C ATOM 48 C GLU A 292 -13.656 5.595 3.059 1.00 0.00 C ATOM 49 O GLU A 292 -12.482 5.578 2.731 1.00 0.00 O ATOM 50 CB GLU A 292 -14.766 6.933 4.873 1.00 0.00 C ATOM 51 CG GLU A 292 -15.791 5.828 5.182 1.00 0.00 C ATOM 52 CD GLU A 292 -16.581 6.188 6.444 1.00 0.00 C ATOM 53 OE1 GLU A 292 -15.993 6.764 7.344 1.00 0.00 O ATOM 54 OE2 GLU A 292 -17.762 5.881 6.488 1.00 0.00 O ATOM 0 H GLU A 292 -16.476 6.698 2.966 1.00 0.00 H new ATOM 0 HA GLU A 292 -13.703 7.727 3.152 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -13.876 6.794 5.486 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -15.182 7.907 5.132 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -16.471 5.705 4.339 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -15.281 4.875 5.321 1.00 0.00 H new ATOM 61 N THR A 293 -14.336 4.499 3.188 1.00 0.00 N ATOM 62 CA THR A 293 -13.701 3.174 2.945 1.00 0.00 C ATOM 63 C THR A 293 -13.153 3.056 1.528 1.00 0.00 C ATOM 64 O THR A 293 -12.071 2.547 1.319 1.00 0.00 O ATOM 65 CB THR A 293 -14.751 2.086 3.149 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.384 2.268 4.407 1.00 0.00 O ATOM 67 CG2 THR A 293 -14.101 0.706 3.094 1.00 0.00 C ATOM 0 H THR A 293 -15.320 4.460 3.455 1.00 0.00 H new ATOM 0 HA THR A 293 -12.870 3.065 3.642 1.00 0.00 H new ATOM 0 HB THR A 293 -15.493 2.156 2.354 1.00 0.00 H new ATOM 0 HG1 THR A 293 -15.929 1.481 4.616 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.862 -0.061 3.241 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.627 0.565 2.122 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.349 0.626 3.879 1.00 0.00 H new ATOM 75 N MET A 294 -13.897 3.466 0.550 1.00 0.00 N ATOM 76 CA MET A 294 -13.402 3.304 -0.841 1.00 0.00 C ATOM 77 C MET A 294 -12.098 4.085 -1.028 1.00 0.00 C ATOM 78 O MET A 294 -11.144 3.567 -1.569 1.00 0.00 O ATOM 79 CB MET A 294 -14.475 3.765 -1.837 1.00 0.00 C ATOM 80 CG MET A 294 -14.385 2.916 -3.114 1.00 0.00 C ATOM 81 SD MET A 294 -15.673 3.431 -4.277 1.00 0.00 S ATOM 82 CE MET A 294 -17.006 2.386 -3.631 1.00 0.00 C ATOM 0 H MET A 294 -14.815 3.901 0.647 1.00 0.00 H new ATOM 0 HA MET A 294 -13.195 2.251 -1.031 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.465 3.668 -1.392 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.335 4.819 -2.077 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.402 3.030 -3.570 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.502 1.860 -2.870 1.00 0.00 H new ATOM 0 HE1 MET A 294 -17.962 2.891 -3.767 1.00 0.00 H new ATOM 0 HE2 MET A 294 -17.017 1.437 -4.168 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.841 2.200 -2.570 1.00 0.00 H new ATOM 92 N LYS A 295 -12.030 5.312 -0.575 1.00 0.00 N ATOM 93 CA LYS A 295 -10.758 6.086 -0.724 1.00 0.00 C ATOM 94 C LYS A 295 -9.598 5.201 -0.288 1.00 0.00 C ATOM 95 O LYS A 295 -8.546 5.192 -0.896 1.00 0.00 O ATOM 96 CB LYS A 295 -10.812 7.344 0.153 1.00 0.00 C ATOM 97 CG LYS A 295 -12.020 8.212 -0.243 1.00 0.00 C ATOM 98 CD LYS A 295 -11.646 9.134 -1.406 1.00 0.00 C ATOM 99 CE LYS A 295 -12.900 9.818 -1.959 1.00 0.00 C ATOM 100 NZ LYS A 295 -13.616 8.876 -2.865 1.00 0.00 N ATOM 0 H LYS A 295 -12.792 5.808 -0.113 1.00 0.00 H new ATOM 0 HA LYS A 295 -10.624 6.388 -1.763 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -10.885 7.062 1.203 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -9.891 7.916 0.040 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -12.857 7.575 -0.528 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -12.347 8.805 0.611 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -10.931 9.885 -1.070 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -11.158 8.560 -2.194 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -13.553 10.121 -1.141 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -12.626 10.723 -2.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -13.900 9.376 -3.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -12.986 8.086 -3.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -14.462 8.508 -2.385 1.00 0.00 H new ATOM 114 N ALA A 296 -9.793 4.422 0.739 1.00 0.00 N ATOM 115 CA ALA A 296 -8.706 3.509 1.168 1.00 0.00 C ATOM 116 C ALA A 296 -8.396 2.578 -0.008 1.00 0.00 C ATOM 117 O ALA A 296 -7.254 2.300 -0.313 1.00 0.00 O ATOM 118 CB ALA A 296 -9.168 2.698 2.374 1.00 0.00 C ATOM 0 H ALA A 296 -10.649 4.380 1.292 1.00 0.00 H new ATOM 0 HA ALA A 296 -7.815 4.069 1.453 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.369 2.027 2.689 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.419 3.373 3.192 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -10.047 2.113 2.104 1.00 0.00 H new ATOM 124 N ARG A 297 -9.418 2.115 -0.685 1.00 0.00 N ATOM 125 CA ARG A 297 -9.203 1.222 -1.860 1.00 0.00 C ATOM 126 C ARG A 297 -8.571 2.034 -2.987 1.00 0.00 C ATOM 127 O ARG A 297 -7.603 1.629 -3.599 1.00 0.00 O ATOM 128 CB ARG A 297 -10.545 0.666 -2.334 1.00 0.00 C ATOM 129 CG ARG A 297 -11.244 0.003 -1.156 1.00 0.00 C ATOM 130 CD ARG A 297 -12.502 -0.729 -1.636 1.00 0.00 C ATOM 131 NE ARG A 297 -12.125 -1.844 -2.551 1.00 0.00 N ATOM 132 CZ ARG A 297 -12.985 -2.793 -2.807 1.00 0.00 C ATOM 133 NH1 ARG A 297 -14.155 -2.782 -2.228 1.00 0.00 N ATOM 134 NH2 ARG A 297 -12.674 -3.758 -3.629 1.00 0.00 N ATOM 0 H ARG A 297 -10.394 2.319 -0.472 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.549 0.397 -1.579 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.164 1.467 -2.738 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -10.392 -0.055 -3.137 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -10.567 -0.700 -0.670 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -11.512 0.754 -0.412 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -13.054 -1.120 -0.781 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -13.164 -0.033 -2.151 1.00 0.00 H new ATOM 0 HE ARG A 297 -11.198 -1.866 -2.976 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -14.395 -2.034 -1.578 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -14.829 -3.522 -2.426 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -11.756 -3.773 -4.074 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -13.349 -4.497 -3.826 1.00 0.00 H new ATOM 148 N ARG A 298 -9.111 3.189 -3.258 1.00 0.00 N ATOM 149 CA ARG A 298 -8.547 4.044 -4.332 1.00 0.00 C ATOM 150 C ARG A 298 -7.045 4.197 -4.082 1.00 0.00 C ATOM 151 O ARG A 298 -6.235 4.021 -4.971 1.00 0.00 O ATOM 152 CB ARG A 298 -9.255 5.414 -4.288 1.00 0.00 C ATOM 153 CG ARG A 298 -9.423 5.985 -5.703 1.00 0.00 C ATOM 154 CD ARG A 298 -8.053 6.315 -6.297 1.00 0.00 C ATOM 155 NE ARG A 298 -8.238 7.065 -7.572 1.00 0.00 N ATOM 156 CZ ARG A 298 -7.239 7.719 -8.096 1.00 0.00 C ATOM 157 NH1 ARG A 298 -6.079 7.727 -7.498 1.00 0.00 N ATOM 158 NH2 ARG A 298 -7.400 8.369 -9.217 1.00 0.00 N ATOM 0 H ARG A 298 -9.923 3.577 -2.778 1.00 0.00 H new ATOM 0 HA ARG A 298 -8.700 3.601 -5.316 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.231 5.309 -3.815 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -8.677 6.108 -3.677 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -9.940 5.264 -6.337 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -10.041 6.882 -5.672 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -7.472 6.910 -5.592 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.492 5.398 -6.479 1.00 0.00 H new ATOM 0 HE ARG A 298 -9.147 7.067 -8.035 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -5.954 7.222 -6.621 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -5.297 8.239 -7.908 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -8.307 8.365 -9.683 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -6.618 8.881 -9.627 1.00 0.00 H new ATOM 172 N ALA A 299 -6.670 4.497 -2.868 1.00 0.00 N ATOM 173 CA ALA A 299 -5.221 4.629 -2.555 1.00 0.00 C ATOM 174 C ALA A 299 -4.563 3.269 -2.788 1.00 0.00 C ATOM 175 O ALA A 299 -3.412 3.177 -3.164 1.00 0.00 O ATOM 176 CB ALA A 299 -5.040 5.051 -1.094 1.00 0.00 C ATOM 0 H ALA A 299 -7.302 4.656 -2.083 1.00 0.00 H new ATOM 0 HA ALA A 299 -4.763 5.386 -3.192 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -3.977 5.146 -0.872 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -5.532 6.009 -0.928 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.482 4.299 -0.441 1.00 0.00 H new ATOM 182 N TRP A 300 -5.305 2.209 -2.593 1.00 0.00 N ATOM 183 CA TRP A 300 -4.745 0.849 -2.827 1.00 0.00 C ATOM 184 C TRP A 300 -4.736 0.580 -4.330 1.00 0.00 C ATOM 185 O TRP A 300 -4.089 -0.333 -4.798 1.00 0.00 O ATOM 186 CB TRP A 300 -5.604 -0.213 -2.136 1.00 0.00 C ATOM 187 CG TRP A 300 -5.722 -0.004 -0.637 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.699 -0.575 0.116 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.888 0.766 0.314 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.519 -0.232 1.438 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.429 0.585 1.616 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.736 1.586 0.203 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.858 1.177 2.742 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.167 2.179 1.341 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.724 1.972 2.604 1.00 0.00 C ATOM 0 H TRP A 300 -6.276 2.229 -2.281 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.735 0.802 -2.419 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.601 -0.208 -2.577 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -5.176 -1.197 -2.327 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.493 -1.201 -0.263 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -7.124 -0.548 2.196 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.292 1.756 -0.767 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -5.294 1.019 3.717 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.290 2.801 1.238 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.275 2.429 3.474 1.00 0.00 H new ATOM 206 N THR A 301 -5.447 1.369 -5.090 1.00 0.00 N ATOM 207 CA THR A 301 -5.481 1.162 -6.568 1.00 0.00 C ATOM 208 C THR A 301 -4.230 1.770 -7.218 1.00 0.00 C ATOM 209 O THR A 301 -3.474 1.097 -7.892 1.00 0.00 O ATOM 210 CB THR A 301 -6.724 1.847 -7.141 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.831 1.601 -6.287 1.00 0.00 O ATOM 212 CG2 THR A 301 -7.020 1.298 -8.537 1.00 0.00 C ATOM 0 H THR A 301 -6.008 2.151 -4.750 1.00 0.00 H new ATOM 0 HA THR A 301 -5.509 0.093 -6.777 1.00 0.00 H new ATOM 0 HB THR A 301 -6.547 2.920 -7.210 1.00 0.00 H new ATOM 0 HG1 THR A 301 -7.545 1.670 -5.352 1.00 0.00 H new ATOM 0 HG21 THR A 301 -7.906 1.789 -8.941 1.00 0.00 H new ATOM 0 HG22 THR A 301 -6.169 1.489 -9.191 1.00 0.00 H new ATOM 0 HG23 THR A 301 -7.196 0.224 -8.476 1.00 0.00 H new ATOM 220 N ASP A 302 -4.020 3.044 -7.032 1.00 0.00 N ATOM 221 CA ASP A 302 -2.835 3.707 -7.650 1.00 0.00 C ATOM 222 C ASP A 302 -1.555 2.974 -7.243 1.00 0.00 C ATOM 223 O ASP A 302 -0.685 2.731 -8.055 1.00 0.00 O ATOM 224 CB ASP A 302 -2.764 5.163 -7.179 1.00 0.00 C ATOM 225 CG ASP A 302 -4.161 5.787 -7.239 1.00 0.00 C ATOM 226 OD1 ASP A 302 -4.752 5.765 -8.305 1.00 0.00 O ATOM 227 OD2 ASP A 302 -4.614 6.276 -6.218 1.00 0.00 O ATOM 0 H ASP A 302 -4.619 3.656 -6.478 1.00 0.00 H new ATOM 0 HA ASP A 302 -2.932 3.677 -8.735 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -2.377 5.209 -6.161 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -2.075 5.727 -7.808 1.00 0.00 H new ATOM 232 N VAL A 303 -1.425 2.633 -5.993 1.00 0.00 N ATOM 233 CA VAL A 303 -0.197 1.933 -5.535 1.00 0.00 C ATOM 234 C VAL A 303 -0.211 0.469 -5.997 1.00 0.00 C ATOM 235 O VAL A 303 0.823 -0.154 -6.125 1.00 0.00 O ATOM 236 CB VAL A 303 -0.143 1.988 -4.010 1.00 0.00 C ATOM 237 CG1 VAL A 303 -0.246 3.445 -3.547 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.308 1.178 -3.436 1.00 0.00 C ATOM 0 H VAL A 303 -2.119 2.810 -5.267 1.00 0.00 H new ATOM 0 HA VAL A 303 0.679 2.422 -5.961 1.00 0.00 H new ATOM 0 HB VAL A 303 0.799 1.567 -3.659 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -0.207 3.484 -2.458 1.00 0.00 H new ATOM 0 HG12 VAL A 303 0.584 4.018 -3.960 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -1.188 3.871 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.274 1.214 -2.347 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.251 1.600 -3.784 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.230 0.143 -3.768 1.00 0.00 H new ATOM 248 N ILE A 304 -1.368 -0.091 -6.245 1.00 0.00 N ATOM 249 CA ILE A 304 -1.421 -1.517 -6.691 1.00 0.00 C ATOM 250 C ILE A 304 -0.583 -1.677 -7.969 1.00 0.00 C ATOM 251 O ILE A 304 0.242 -2.561 -8.071 1.00 0.00 O ATOM 252 CB ILE A 304 -2.910 -1.929 -6.921 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.380 -2.866 -5.793 1.00 0.00 C ATOM 254 CG2 ILE A 304 -3.113 -2.647 -8.266 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.910 -3.012 -5.808 1.00 0.00 C ATOM 0 H ILE A 304 -2.272 0.373 -6.159 1.00 0.00 H new ATOM 0 HA ILE A 304 -1.003 -2.174 -5.928 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.495 -1.009 -6.927 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.915 -3.845 -5.910 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -3.057 -2.473 -4.829 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -4.164 -2.914 -8.381 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.815 -1.986 -9.080 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.504 -3.551 -8.292 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -5.220 -3.678 -5.003 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.370 -2.034 -5.667 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -5.226 -3.427 -6.765 1.00 0.00 H new ATOM 267 N GLN A 305 -0.796 -0.841 -8.944 1.00 0.00 N ATOM 268 CA GLN A 305 -0.018 -0.966 -10.210 1.00 0.00 C ATOM 269 C GLN A 305 1.411 -0.459 -10.001 1.00 0.00 C ATOM 270 O GLN A 305 2.339 -0.912 -10.643 1.00 0.00 O ATOM 271 CB GLN A 305 -0.693 -0.137 -11.305 1.00 0.00 C ATOM 272 CG GLN A 305 -0.905 1.293 -10.805 1.00 0.00 C ATOM 273 CD GLN A 305 -1.493 2.148 -11.929 1.00 0.00 C ATOM 274 OE1 GLN A 305 -0.866 2.340 -12.952 1.00 0.00 O ATOM 275 NE2 GLN A 305 -2.680 2.671 -11.782 1.00 0.00 N ATOM 0 H GLN A 305 -1.473 -0.078 -8.922 1.00 0.00 H new ATOM 0 HA GLN A 305 0.014 -2.015 -10.506 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.077 -0.132 -12.204 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.649 -0.584 -11.577 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -1.576 1.293 -9.946 1.00 0.00 H new ATOM 0 HG3 GLN A 305 0.042 1.716 -10.470 1.00 0.00 H new ATOM 0 HE21 GLN A 305 -3.206 2.509 -10.923 1.00 0.00 H new ATOM 0 HE22 GLN A 305 -3.082 3.241 -12.526 1.00 0.00 H new ATOM 284 N THR A 306 1.596 0.485 -9.119 1.00 0.00 N ATOM 285 CA THR A 306 2.964 1.032 -8.880 1.00 0.00 C ATOM 286 C THR A 306 3.735 0.115 -7.912 1.00 0.00 C ATOM 287 O THR A 306 4.942 0.079 -7.920 1.00 0.00 O ATOM 288 CB THR A 306 2.832 2.469 -8.331 1.00 0.00 C ATOM 289 OG1 THR A 306 3.010 3.388 -9.400 1.00 0.00 O ATOM 290 CG2 THR A 306 3.872 2.766 -7.241 1.00 0.00 C ATOM 0 H THR A 306 0.858 0.902 -8.552 1.00 0.00 H new ATOM 0 HA THR A 306 3.530 1.067 -9.811 1.00 0.00 H new ATOM 0 HB THR A 306 1.842 2.570 -7.887 1.00 0.00 H new ATOM 0 HG1 THR A 306 2.926 4.304 -9.061 1.00 0.00 H new ATOM 0 HG21 THR A 306 3.743 3.787 -6.883 1.00 0.00 H new ATOM 0 HG22 THR A 306 3.738 2.071 -6.412 1.00 0.00 H new ATOM 0 HG23 THR A 306 4.874 2.650 -7.653 1.00 0.00 H new ATOM 298 N LEU A 307 3.065 -0.621 -7.079 1.00 0.00 N ATOM 299 CA LEU A 307 3.813 -1.509 -6.142 1.00 0.00 C ATOM 300 C LEU A 307 4.778 -2.386 -6.965 1.00 0.00 C ATOM 301 O LEU A 307 5.947 -2.511 -6.655 1.00 0.00 O ATOM 302 CB LEU A 307 2.803 -2.402 -5.368 1.00 0.00 C ATOM 303 CG LEU A 307 2.772 -2.071 -3.852 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.192 -2.124 -3.238 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.150 -0.682 -3.646 1.00 0.00 C ATOM 0 H LEU A 307 2.048 -0.651 -7.002 1.00 0.00 H new ATOM 0 HA LEU A 307 4.381 -0.917 -5.424 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.806 -2.268 -5.788 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.069 -3.450 -5.504 1.00 0.00 H new ATOM 0 HG LEU A 307 2.165 -2.820 -3.343 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.138 -1.888 -2.175 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.607 -3.124 -3.367 1.00 0.00 H new ATOM 0 HD13 LEU A 307 4.832 -1.398 -3.739 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.127 -0.448 -2.582 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.747 0.065 -4.169 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.134 -0.676 -4.040 1.00 0.00 H new ATOM 317 N ARG A 308 4.284 -3.007 -8.001 1.00 0.00 N ATOM 318 CA ARG A 308 5.150 -3.895 -8.832 1.00 0.00 C ATOM 319 C ARG A 308 6.194 -3.093 -9.624 1.00 0.00 C ATOM 320 O ARG A 308 7.069 -3.667 -10.240 1.00 0.00 O ATOM 321 CB ARG A 308 4.277 -4.696 -9.804 1.00 0.00 C ATOM 322 CG ARG A 308 3.285 -3.763 -10.499 1.00 0.00 C ATOM 323 CD ARG A 308 2.653 -4.488 -11.690 1.00 0.00 C ATOM 324 NE ARG A 308 1.788 -3.545 -12.451 1.00 0.00 N ATOM 325 CZ ARG A 308 1.397 -3.849 -13.661 1.00 0.00 C ATOM 326 NH1 ARG A 308 1.778 -4.972 -14.209 1.00 0.00 N ATOM 327 NH2 ARG A 308 0.628 -3.029 -14.324 1.00 0.00 N ATOM 0 H ARG A 308 3.314 -2.938 -8.310 1.00 0.00 H new ATOM 0 HA ARG A 308 5.683 -4.568 -8.160 1.00 0.00 H new ATOM 0 HB2 ARG A 308 4.903 -5.193 -10.545 1.00 0.00 H new ATOM 0 HB3 ARG A 308 3.740 -5.477 -9.266 1.00 0.00 H new ATOM 0 HG2 ARG A 308 2.511 -3.450 -9.798 1.00 0.00 H new ATOM 0 HG3 ARG A 308 3.794 -2.860 -10.837 1.00 0.00 H new ATOM 0 HD2 ARG A 308 3.432 -4.887 -12.340 1.00 0.00 H new ATOM 0 HD3 ARG A 308 2.064 -5.336 -11.341 1.00 0.00 H new ATOM 0 HE ARG A 308 1.501 -2.662 -12.029 1.00 0.00 H new ATOM 0 HH11 ARG A 308 2.381 -5.613 -13.693 1.00 0.00 H new ATOM 0 HH12 ARG A 308 1.472 -5.208 -15.153 1.00 0.00 H new ATOM 0 HH21 ARG A 308 0.332 -2.151 -13.898 1.00 0.00 H new ATOM 0 HH22 ARG A 308 0.323 -3.266 -15.268 1.00 0.00 H new ATOM 341 N GLU A 309 6.127 -1.786 -9.637 1.00 0.00 N ATOM 342 CA GLU A 309 7.149 -1.028 -10.424 1.00 0.00 C ATOM 343 C GLU A 309 8.547 -1.414 -9.926 1.00 0.00 C ATOM 344 O GLU A 309 9.544 -1.020 -10.497 1.00 0.00 O ATOM 345 CB GLU A 309 6.935 0.491 -10.274 1.00 0.00 C ATOM 346 CG GLU A 309 5.840 0.966 -11.245 1.00 0.00 C ATOM 347 CD GLU A 309 6.434 1.190 -12.641 1.00 0.00 C ATOM 348 OE1 GLU A 309 7.606 0.907 -12.821 1.00 0.00 O ATOM 349 OE2 GLU A 309 5.702 1.643 -13.507 1.00 0.00 O ATOM 0 H GLU A 309 5.429 -1.222 -9.151 1.00 0.00 H new ATOM 0 HA GLU A 309 7.049 -1.281 -11.480 1.00 0.00 H new ATOM 0 HB2 GLU A 309 6.651 0.727 -9.249 1.00 0.00 H new ATOM 0 HB3 GLU A 309 7.866 1.020 -10.476 1.00 0.00 H new ATOM 0 HG2 GLU A 309 5.042 0.225 -11.296 1.00 0.00 H new ATOM 0 HG3 GLU A 309 5.394 1.891 -10.878 1.00 0.00 H new ATOM 356 N HIS A 310 8.625 -2.215 -8.884 1.00 0.00 N ATOM 357 CA HIS A 310 9.959 -2.668 -8.365 1.00 0.00 C ATOM 358 C HIS A 310 9.926 -4.189 -8.156 1.00 0.00 C ATOM 359 O HIS A 310 10.121 -4.951 -9.081 1.00 0.00 O ATOM 360 CB HIS A 310 10.308 -1.949 -7.049 1.00 0.00 C ATOM 361 CG HIS A 310 9.085 -1.755 -6.190 1.00 0.00 C ATOM 362 ND1 HIS A 310 8.854 -2.517 -5.054 1.00 0.00 N ATOM 363 CD2 HIS A 310 8.048 -0.857 -6.254 1.00 0.00 C ATOM 364 CE1 HIS A 310 7.723 -2.062 -4.484 1.00 0.00 C ATOM 365 NE2 HIS A 310 7.190 -1.053 -5.177 1.00 0.00 N ATOM 0 H HIS A 310 7.820 -2.574 -8.371 1.00 0.00 H new ATOM 0 HA HIS A 310 10.730 -2.418 -9.093 1.00 0.00 H new ATOM 0 HB2 HIS A 310 11.051 -2.529 -6.502 1.00 0.00 H new ATOM 0 HB3 HIS A 310 10.758 -0.981 -7.269 1.00 0.00 H new ATOM 0 HD2 HIS A 310 7.918 -0.111 -7.024 1.00 0.00 H new ATOM 0 HE1 HIS A 310 7.298 -2.464 -3.576 1.00 0.00 H new ATOM 0 HE2 HIS A 310 6.337 -0.537 -4.963 1.00 0.00 H new ATOM 373 N LYS A 311 9.680 -4.640 -6.954 1.00 0.00 N ATOM 374 CA LYS A 311 9.637 -6.115 -6.704 1.00 0.00 C ATOM 375 C LYS A 311 8.733 -6.395 -5.513 1.00 0.00 C ATOM 376 O LYS A 311 9.172 -6.755 -4.442 1.00 0.00 O ATOM 377 CB LYS A 311 11.062 -6.636 -6.441 1.00 0.00 C ATOM 378 CG LYS A 311 11.659 -5.973 -5.178 1.00 0.00 C ATOM 379 CD LYS A 311 13.180 -5.820 -5.321 1.00 0.00 C ATOM 380 CE LYS A 311 13.832 -7.200 -5.415 1.00 0.00 C ATOM 381 NZ LYS A 311 15.304 -7.042 -5.584 1.00 0.00 N ATOM 0 H LYS A 311 9.507 -4.055 -6.136 1.00 0.00 H new ATOM 0 HA LYS A 311 9.237 -6.629 -7.578 1.00 0.00 H new ATOM 0 HB2 LYS A 311 11.042 -7.719 -6.315 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.696 -6.427 -7.302 1.00 0.00 H new ATOM 0 HG2 LYS A 311 11.202 -4.996 -5.022 1.00 0.00 H new ATOM 0 HG3 LYS A 311 11.429 -6.576 -4.300 1.00 0.00 H new ATOM 0 HD2 LYS A 311 13.414 -5.236 -6.211 1.00 0.00 H new ATOM 0 HD3 LYS A 311 13.582 -5.275 -4.467 1.00 0.00 H new ATOM 0 HE2 LYS A 311 13.618 -7.777 -4.516 1.00 0.00 H new ATOM 0 HE3 LYS A 311 13.416 -7.754 -6.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 15.749 -7.980 -5.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 15.498 -6.507 -6.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 15.694 -6.529 -4.768 1.00 0.00 H new ATOM 395 N CYS A 312 7.457 -6.229 -5.698 1.00 0.00 N ATOM 396 CA CYS A 312 6.509 -6.476 -4.585 1.00 0.00 C ATOM 397 C CYS A 312 5.149 -6.851 -5.149 1.00 0.00 C ATOM 398 O CYS A 312 4.468 -6.056 -5.766 1.00 0.00 O ATOM 399 CB CYS A 312 6.385 -5.209 -3.748 1.00 0.00 C ATOM 400 SG CYS A 312 4.893 -5.265 -2.722 1.00 0.00 S ATOM 0 H CYS A 312 7.029 -5.932 -6.575 1.00 0.00 H new ATOM 0 HA CYS A 312 6.875 -7.293 -3.963 1.00 0.00 H new ATOM 0 HB2 CYS A 312 7.265 -5.098 -3.114 1.00 0.00 H new ATOM 0 HB3 CYS A 312 6.351 -4.337 -4.401 1.00 0.00 H new ATOM 0 HG CYS A 312 3.865 -4.903 -3.431 1.00 0.00 H new ATOM 406 N GLN A 313 4.757 -8.057 -4.918 1.00 0.00 N ATOM 407 CA GLN A 313 3.430 -8.527 -5.409 1.00 0.00 C ATOM 408 C GLN A 313 2.328 -7.804 -4.594 1.00 0.00 C ATOM 409 O GLN A 313 2.233 -7.997 -3.400 1.00 0.00 O ATOM 410 CB GLN A 313 3.311 -10.052 -5.178 1.00 0.00 C ATOM 411 CG GLN A 313 3.715 -10.840 -6.436 1.00 0.00 C ATOM 412 CD GLN A 313 3.239 -12.288 -6.296 1.00 0.00 C ATOM 413 OE1 GLN A 313 2.326 -12.569 -5.544 1.00 0.00 O ATOM 414 NE2 GLN A 313 3.816 -13.223 -6.996 1.00 0.00 N ATOM 0 H GLN A 313 5.298 -8.753 -4.405 1.00 0.00 H new ATOM 0 HA GLN A 313 3.322 -8.311 -6.472 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.946 -10.346 -4.342 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.286 -10.302 -4.903 1.00 0.00 H new ATOM 0 HG2 GLN A 313 3.275 -10.384 -7.323 1.00 0.00 H new ATOM 0 HG3 GLN A 313 4.797 -10.811 -6.566 1.00 0.00 H new ATOM 0 HE21 GLN A 313 4.582 -12.988 -7.627 1.00 0.00 H new ATOM 0 HE22 GLN A 313 3.502 -14.190 -6.913 1.00 0.00 H new ATOM 423 N PRO A 314 1.501 -6.980 -5.212 1.00 0.00 N ATOM 424 CA PRO A 314 0.416 -6.256 -4.487 1.00 0.00 C ATOM 425 C PRO A 314 -0.870 -7.081 -4.391 1.00 0.00 C ATOM 426 O PRO A 314 -1.316 -7.665 -5.359 1.00 0.00 O ATOM 427 CB PRO A 314 0.193 -5.034 -5.367 1.00 0.00 C ATOM 428 CG PRO A 314 0.404 -5.548 -6.755 1.00 0.00 C ATOM 429 CD PRO A 314 1.490 -6.632 -6.648 1.00 0.00 C ATOM 0 HA PRO A 314 0.683 -6.028 -3.455 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.810 -4.627 -5.240 1.00 0.00 H new ATOM 0 HB3 PRO A 314 0.894 -4.235 -5.126 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.519 -5.960 -7.162 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.718 -4.747 -7.424 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.254 -7.497 -7.267 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.460 -6.260 -6.977 1.00 0.00 H new ATOM 437 N ARG A 315 -1.475 -7.126 -3.233 1.00 0.00 N ATOM 438 CA ARG A 315 -2.741 -7.907 -3.067 1.00 0.00 C ATOM 439 C ARG A 315 -3.685 -7.126 -2.149 1.00 0.00 C ATOM 440 O ARG A 315 -3.408 -6.951 -0.982 1.00 0.00 O ATOM 441 CB ARG A 315 -2.439 -9.273 -2.417 1.00 0.00 C ATOM 442 CG ARG A 315 -1.197 -9.934 -3.056 1.00 0.00 C ATOM 443 CD ARG A 315 0.070 -9.558 -2.274 1.00 0.00 C ATOM 444 NE ARG A 315 0.061 -10.267 -0.961 1.00 0.00 N ATOM 445 CZ ARG A 315 1.155 -10.350 -0.260 1.00 0.00 C ATOM 446 NH1 ARG A 315 2.253 -9.804 -0.703 1.00 0.00 N ATOM 447 NH2 ARG A 315 1.152 -10.980 0.883 1.00 0.00 N ATOM 0 H ARG A 315 -1.147 -6.654 -2.390 1.00 0.00 H new ATOM 0 HA ARG A 315 -3.197 -8.064 -4.044 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -2.274 -9.141 -1.348 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -3.302 -9.930 -2.528 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -1.318 -11.017 -3.066 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -1.100 -9.614 -4.094 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.958 -9.832 -2.843 1.00 0.00 H new ATOM 0 HD3 ARG A 315 0.110 -8.480 -2.119 1.00 0.00 H new ATOM 0 HE ARG A 315 -0.801 -10.686 -0.613 1.00 0.00 H new ATOM 0 HH11 ARG A 315 2.254 -9.313 -1.597 1.00 0.00 H new ATOM 0 HH12 ARG A 315 3.111 -9.868 -0.155 1.00 0.00 H new ATOM 0 HH21 ARG A 315 0.292 -11.408 1.227 1.00 0.00 H new ATOM 0 HH22 ARG A 315 2.009 -11.045 1.432 1.00 0.00 H new ATOM 461 N LEU A 316 -4.799 -6.653 -2.650 1.00 0.00 N ATOM 462 CA LEU A 316 -5.730 -5.897 -1.778 1.00 0.00 C ATOM 463 C LEU A 316 -6.556 -6.887 -0.958 1.00 0.00 C ATOM 464 O LEU A 316 -7.301 -7.686 -1.488 1.00 0.00 O ATOM 465 CB LEU A 316 -6.650 -5.031 -2.647 1.00 0.00 C ATOM 466 CG LEU A 316 -7.118 -3.799 -1.863 1.00 0.00 C ATOM 467 CD1 LEU A 316 -7.939 -2.897 -2.784 1.00 0.00 C ATOM 468 CD2 LEU A 316 -7.980 -4.240 -0.684 1.00 0.00 C ATOM 0 H LEU A 316 -5.097 -6.760 -3.620 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.170 -5.249 -1.103 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.122 -4.718 -3.548 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.512 -5.615 -2.969 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.251 -3.253 -1.492 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.274 -2.020 -2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.324 -2.581 -3.627 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.806 -3.446 -3.153 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.312 -3.363 -0.128 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -8.848 -4.786 -1.052 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.396 -4.886 -0.028 1.00 0.00 H new ATOM 480 N LEU A 317 -6.426 -6.829 0.333 1.00 0.00 N ATOM 481 CA LEU A 317 -7.200 -7.756 1.220 1.00 0.00 C ATOM 482 C LEU A 317 -8.451 -7.018 1.701 1.00 0.00 C ATOM 483 O LEU A 317 -8.892 -6.111 1.038 1.00 0.00 O ATOM 484 CB LEU A 317 -6.333 -8.174 2.420 1.00 0.00 C ATOM 485 CG LEU A 317 -5.229 -9.157 1.982 1.00 0.00 C ATOM 486 CD1 LEU A 317 -5.844 -10.455 1.425 1.00 0.00 C ATOM 487 CD2 LEU A 317 -4.340 -8.502 0.917 1.00 0.00 C ATOM 0 H LEU A 317 -5.814 -6.177 0.823 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.485 -8.656 0.675 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -5.881 -7.291 2.873 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -6.959 -8.639 3.182 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.624 -9.408 2.853 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -5.047 -11.134 1.122 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -6.452 -10.929 2.195 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -6.469 -10.221 0.563 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -3.562 -9.202 0.612 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -4.946 -8.234 0.052 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -3.879 -7.604 1.330 1.00 0.00 H new ATOM 499 N TYR A 318 -9.008 -7.421 2.836 1.00 0.00 N ATOM 500 CA TYR A 318 -10.253 -6.788 3.429 1.00 0.00 C ATOM 501 C TYR A 318 -10.683 -5.517 2.660 1.00 0.00 C ATOM 502 O TYR A 318 -9.840 -4.757 2.246 1.00 0.00 O ATOM 503 CB TYR A 318 -9.946 -6.422 4.900 1.00 0.00 C ATOM 504 CG TYR A 318 -11.165 -6.626 5.776 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.508 -7.913 6.207 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.949 -5.528 6.157 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.634 -8.103 7.017 1.00 0.00 C ATOM 508 CE2 TYR A 318 -13.075 -5.719 6.968 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.417 -7.006 7.398 1.00 0.00 C ATOM 510 OH TYR A 318 -14.527 -7.193 8.195 1.00 0.00 O ATOM 0 H TYR A 318 -8.637 -8.190 3.394 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.075 -7.500 3.359 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -9.123 -7.036 5.267 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.620 -5.383 4.960 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.904 -8.759 5.915 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.685 -4.535 5.825 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.899 -9.096 7.348 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.679 -4.873 7.261 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.956 -6.329 8.366 1.00 0.00 H new ATOM 520 N PRO A 319 -11.976 -5.282 2.476 1.00 0.00 N ATOM 521 CA PRO A 319 -12.503 -4.096 1.743 1.00 0.00 C ATOM 522 C PRO A 319 -11.553 -2.894 1.716 1.00 0.00 C ATOM 523 O PRO A 319 -11.612 -2.081 0.823 1.00 0.00 O ATOM 524 CB PRO A 319 -13.777 -3.791 2.514 1.00 0.00 C ATOM 525 CG PRO A 319 -14.321 -5.147 2.865 1.00 0.00 C ATOM 526 CD PRO A 319 -13.109 -6.105 2.944 1.00 0.00 C ATOM 0 HA PRO A 319 -12.649 -4.301 0.682 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.572 -3.200 3.406 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.483 -3.222 1.910 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.853 -5.116 3.816 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.033 -5.485 2.112 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.949 -6.464 3.961 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.252 -6.983 2.314 1.00 0.00 H new ATOM 534 N ALA A 320 -10.655 -2.794 2.654 1.00 0.00 N ATOM 535 CA ALA A 320 -9.682 -1.664 2.634 1.00 0.00 C ATOM 536 C ALA A 320 -8.397 -2.066 3.363 1.00 0.00 C ATOM 537 O ALA A 320 -7.875 -1.311 4.160 1.00 0.00 O ATOM 538 CB ALA A 320 -10.289 -0.439 3.310 1.00 0.00 C ATOM 0 H ALA A 320 -10.551 -3.444 3.433 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.447 -1.423 1.597 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.571 0.381 3.290 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.194 -0.142 2.780 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.537 -0.679 4.344 1.00 0.00 H new ATOM 544 N LYS A 321 -7.866 -3.237 3.085 1.00 0.00 N ATOM 545 CA LYS A 321 -6.592 -3.669 3.753 1.00 0.00 C ATOM 546 C LYS A 321 -5.617 -4.120 2.667 1.00 0.00 C ATOM 547 O LYS A 321 -5.890 -5.048 1.931 1.00 0.00 O ATOM 548 CB LYS A 321 -6.874 -4.823 4.717 1.00 0.00 C ATOM 549 CG LYS A 321 -5.555 -5.273 5.348 1.00 0.00 C ATOM 550 CD LYS A 321 -5.813 -6.235 6.525 1.00 0.00 C ATOM 551 CE LYS A 321 -5.987 -7.670 6.011 1.00 0.00 C ATOM 552 NZ LYS A 321 -6.079 -8.602 7.171 1.00 0.00 N ATOM 0 H LYS A 321 -8.258 -3.910 2.427 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.165 -2.844 4.322 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.573 -4.506 5.491 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -7.341 -5.653 4.186 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -4.937 -5.766 4.598 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -4.998 -4.404 5.698 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -4.981 -6.192 7.228 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -6.706 -5.925 7.068 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -6.886 -7.743 5.399 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -5.146 -7.945 5.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -6.197 -9.576 6.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -5.209 -8.539 7.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -6.895 -8.343 7.761 1.00 0.00 H new ATOM 566 N LEU A 322 -4.497 -3.441 2.530 1.00 0.00 N ATOM 567 CA LEU A 322 -3.521 -3.802 1.450 1.00 0.00 C ATOM 568 C LEU A 322 -2.293 -4.513 2.030 1.00 0.00 C ATOM 569 O LEU A 322 -1.685 -4.058 2.978 1.00 0.00 O ATOM 570 CB LEU A 322 -3.095 -2.500 0.747 1.00 0.00 C ATOM 571 CG LEU A 322 -2.807 -2.746 -0.745 1.00 0.00 C ATOM 572 CD1 LEU A 322 -2.191 -1.484 -1.361 1.00 0.00 C ATOM 573 CD2 LEU A 322 -1.834 -3.924 -0.912 1.00 0.00 C ATOM 0 H LEU A 322 -4.219 -2.655 3.118 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.991 -4.487 0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -3.882 -1.753 0.851 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.206 -2.096 1.231 1.00 0.00 H new ATOM 0 HG LEU A 322 -3.742 -2.985 -1.251 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -1.987 -1.657 -2.418 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -2.887 -0.652 -1.258 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -1.261 -1.245 -0.846 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -1.639 -4.087 -1.972 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -0.898 -3.698 -0.401 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -2.274 -4.823 -0.481 1.00 0.00 H new ATOM 585 N SER A 323 -1.915 -5.619 1.431 1.00 0.00 N ATOM 586 CA SER A 323 -0.713 -6.380 1.895 1.00 0.00 C ATOM 587 C SER A 323 0.386 -6.265 0.840 1.00 0.00 C ATOM 588 O SER A 323 0.184 -6.593 -0.313 1.00 0.00 O ATOM 589 CB SER A 323 -1.086 -7.850 2.083 1.00 0.00 C ATOM 590 OG SER A 323 -1.077 -8.502 0.819 1.00 0.00 O ATOM 0 H SER A 323 -2.395 -6.030 0.631 1.00 0.00 H new ATOM 0 HA SER A 323 -0.359 -5.972 2.842 1.00 0.00 H new ATOM 0 HB2 SER A 323 -0.380 -8.333 2.759 1.00 0.00 H new ATOM 0 HB3 SER A 323 -2.072 -7.931 2.540 1.00 0.00 H new ATOM 0 HG SER A 323 -0.970 -7.836 0.108 1.00 0.00 H new ATOM 596 N ILE A 324 1.547 -5.789 1.222 1.00 0.00 N ATOM 597 CA ILE A 324 2.673 -5.634 0.249 1.00 0.00 C ATOM 598 C ILE A 324 3.856 -6.505 0.673 1.00 0.00 C ATOM 599 O ILE A 324 4.059 -6.781 1.837 1.00 0.00 O ATOM 600 CB ILE A 324 3.112 -4.171 0.204 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.430 -3.661 1.624 1.00 0.00 C ATOM 602 CG2 ILE A 324 1.999 -3.315 -0.411 1.00 0.00 C ATOM 603 CD1 ILE A 324 4.419 -2.498 1.529 1.00 0.00 C ATOM 0 H ILE A 324 1.764 -5.499 2.176 1.00 0.00 H new ATOM 0 HA ILE A 324 2.334 -5.946 -0.739 1.00 0.00 H new ATOM 0 HB ILE A 324 4.011 -4.095 -0.408 1.00 0.00 H new ATOM 0 HG12 ILE A 324 2.515 -3.337 2.121 1.00 0.00 H new ATOM 0 HG13 ILE A 324 3.852 -4.465 2.227 1.00 0.00 H new ATOM 0 HG21 ILE A 324 2.316 -2.273 -0.441 1.00 0.00 H new ATOM 0 HG22 ILE A 324 1.792 -3.661 -1.424 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.097 -3.402 0.194 1.00 0.00 H new ATOM 0 HD11 ILE A 324 4.648 -2.133 2.530 1.00 0.00 H new ATOM 0 HD12 ILE A 324 5.336 -2.839 1.048 1.00 0.00 H new ATOM 0 HD13 ILE A 324 3.979 -1.693 0.941 1.00 0.00 H new ATOM 615 N THR A 325 4.634 -6.942 -0.281 1.00 0.00 N ATOM 616 CA THR A 325 5.815 -7.804 0.025 1.00 0.00 C ATOM 617 C THR A 325 7.084 -6.946 0.045 1.00 0.00 C ATOM 618 O THR A 325 7.544 -6.479 -0.977 1.00 0.00 O ATOM 619 CB THR A 325 5.937 -8.885 -1.059 1.00 0.00 C ATOM 620 OG1 THR A 325 4.865 -9.808 -0.919 1.00 0.00 O ATOM 621 CG2 THR A 325 7.270 -9.626 -0.915 1.00 0.00 C ATOM 0 H THR A 325 4.501 -6.736 -1.271 1.00 0.00 H new ATOM 0 HA THR A 325 5.688 -8.275 1.000 1.00 0.00 H new ATOM 0 HB THR A 325 5.897 -8.415 -2.042 1.00 0.00 H new ATOM 0 HG1 THR A 325 4.937 -10.500 -1.610 1.00 0.00 H new ATOM 0 HG21 THR A 325 7.347 -10.390 -1.688 1.00 0.00 H new ATOM 0 HG22 THR A 325 8.093 -8.919 -1.021 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.320 -10.097 0.067 1.00 0.00 H new ATOM 629 N ILE A 326 7.660 -6.750 1.202 1.00 0.00 N ATOM 630 CA ILE A 326 8.912 -5.938 1.302 1.00 0.00 C ATOM 631 C ILE A 326 10.101 -6.897 1.368 1.00 0.00 C ATOM 632 O ILE A 326 10.334 -7.548 2.366 1.00 0.00 O ATOM 633 CB ILE A 326 8.860 -5.077 2.574 1.00 0.00 C ATOM 634 CG1 ILE A 326 7.799 -3.966 2.420 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.238 -4.460 2.857 1.00 0.00 C ATOM 636 CD1 ILE A 326 8.130 -3.019 1.248 1.00 0.00 C ATOM 0 H ILE A 326 7.316 -7.119 2.088 1.00 0.00 H new ATOM 0 HA ILE A 326 9.012 -5.282 0.437 1.00 0.00 H new ATOM 0 HB ILE A 326 8.584 -5.712 3.416 1.00 0.00 H new ATOM 0 HG12 ILE A 326 6.820 -4.418 2.258 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.736 -3.392 3.345 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.186 -3.853 3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 326 10.971 -5.255 2.995 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.536 -3.834 2.016 1.00 0.00 H new ATOM 0 HD11 ILE A 326 7.360 -2.251 1.172 1.00 0.00 H new ATOM 0 HD12 ILE A 326 9.097 -2.547 1.423 1.00 0.00 H new ATOM 0 HD13 ILE A 326 8.167 -3.589 0.319 1.00 0.00 H new ATOM 648 N ASP A 327 10.847 -6.995 0.304 1.00 0.00 N ATOM 649 CA ASP A 327 12.018 -7.917 0.286 1.00 0.00 C ATOM 650 C ASP A 327 11.618 -9.278 0.856 1.00 0.00 C ATOM 651 O ASP A 327 12.443 -10.020 1.352 1.00 0.00 O ATOM 652 CB ASP A 327 13.147 -7.325 1.127 1.00 0.00 C ATOM 653 CG ASP A 327 13.346 -5.854 0.756 1.00 0.00 C ATOM 654 OD1 ASP A 327 12.764 -5.427 -0.227 1.00 0.00 O ATOM 655 OD2 ASP A 327 14.078 -5.179 1.462 1.00 0.00 O ATOM 0 H ASP A 327 10.696 -6.473 -0.559 1.00 0.00 H new ATOM 0 HA ASP A 327 12.357 -8.044 -0.742 1.00 0.00 H new ATOM 0 HB2 ASP A 327 12.910 -7.414 2.187 1.00 0.00 H new ATOM 0 HB3 ASP A 327 14.069 -7.881 0.959 1.00 0.00 H new ATOM 660 N GLY A 328 10.356 -9.613 0.778 1.00 0.00 N ATOM 661 CA GLY A 328 9.876 -10.935 1.301 1.00 0.00 C ATOM 662 C GLY A 328 9.014 -10.720 2.546 1.00 0.00 C ATOM 663 O GLY A 328 7.916 -11.232 2.645 1.00 0.00 O ATOM 0 H GLY A 328 9.629 -9.025 0.372 1.00 0.00 H new ATOM 0 HA2 GLY A 328 9.300 -11.452 0.534 1.00 0.00 H new ATOM 0 HA3 GLY A 328 10.727 -11.571 1.543 1.00 0.00 H new ATOM 667 N GLU A 329 9.500 -9.977 3.502 1.00 0.00 N ATOM 668 CA GLU A 329 8.706 -9.745 4.739 1.00 0.00 C ATOM 669 C GLU A 329 7.304 -9.258 4.359 1.00 0.00 C ATOM 670 O GLU A 329 7.140 -8.365 3.552 1.00 0.00 O ATOM 671 CB GLU A 329 9.425 -8.694 5.614 1.00 0.00 C ATOM 672 CG GLU A 329 9.376 -9.107 7.088 1.00 0.00 C ATOM 673 CD GLU A 329 7.924 -9.127 7.566 1.00 0.00 C ATOM 674 OE1 GLU A 329 7.217 -8.171 7.293 1.00 0.00 O ATOM 675 OE2 GLU A 329 7.543 -10.099 8.198 1.00 0.00 O ATOM 0 H GLU A 329 10.412 -9.521 3.479 1.00 0.00 H new ATOM 0 HA GLU A 329 8.614 -10.673 5.304 1.00 0.00 H new ATOM 0 HB2 GLU A 329 10.461 -8.591 5.292 1.00 0.00 H new ATOM 0 HB3 GLU A 329 8.953 -7.720 5.486 1.00 0.00 H new ATOM 0 HG2 GLU A 329 9.825 -10.092 7.215 1.00 0.00 H new ATOM 0 HG3 GLU A 329 9.959 -8.411 7.691 1.00 0.00 H new ATOM 682 N THR A 330 6.294 -9.845 4.940 1.00 0.00 N ATOM 683 CA THR A 330 4.896 -9.425 4.622 1.00 0.00 C ATOM 684 C THR A 330 4.484 -8.273 5.541 1.00 0.00 C ATOM 685 O THR A 330 4.623 -8.349 6.745 1.00 0.00 O ATOM 686 CB THR A 330 3.946 -10.612 4.829 1.00 0.00 C ATOM 687 OG1 THR A 330 2.615 -10.211 4.531 1.00 0.00 O ATOM 688 CG2 THR A 330 4.023 -11.090 6.279 1.00 0.00 C ATOM 0 H THR A 330 6.375 -10.599 5.623 1.00 0.00 H new ATOM 0 HA THR A 330 4.844 -9.095 3.585 1.00 0.00 H new ATOM 0 HB THR A 330 4.238 -11.427 4.167 1.00 0.00 H new ATOM 0 HG1 THR A 330 2.008 -10.969 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 330 3.347 -11.933 6.421 1.00 0.00 H new ATOM 0 HG22 THR A 330 5.043 -11.401 6.506 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.735 -10.277 6.946 1.00 0.00 H new ATOM 696 N LYS A 331 3.969 -7.209 4.978 1.00 0.00 N ATOM 697 CA LYS A 331 3.526 -6.043 5.797 1.00 0.00 C ATOM 698 C LYS A 331 2.143 -5.626 5.295 1.00 0.00 C ATOM 699 O LYS A 331 1.814 -5.842 4.145 1.00 0.00 O ATOM 700 CB LYS A 331 4.525 -4.896 5.618 1.00 0.00 C ATOM 701 CG LYS A 331 4.231 -3.770 6.620 1.00 0.00 C ATOM 702 CD LYS A 331 4.779 -4.118 8.013 1.00 0.00 C ATOM 703 CE LYS A 331 4.772 -2.866 8.892 1.00 0.00 C ATOM 704 NZ LYS A 331 5.880 -1.961 8.477 1.00 0.00 N ATOM 0 H LYS A 331 3.836 -7.099 3.973 1.00 0.00 H new ATOM 0 HA LYS A 331 3.478 -6.299 6.855 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.541 -5.264 5.762 1.00 0.00 H new ATOM 0 HB3 LYS A 331 4.467 -4.510 4.600 1.00 0.00 H new ATOM 0 HG2 LYS A 331 4.680 -2.840 6.270 1.00 0.00 H new ATOM 0 HG3 LYS A 331 3.156 -3.602 6.679 1.00 0.00 H new ATOM 0 HD2 LYS A 331 4.171 -4.899 8.470 1.00 0.00 H new ATOM 0 HD3 LYS A 331 5.792 -4.511 7.929 1.00 0.00 H new ATOM 0 HE2 LYS A 331 3.815 -2.351 8.803 1.00 0.00 H new ATOM 0 HE3 LYS A 331 4.888 -3.144 9.940 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 6.245 -1.455 9.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 6.645 -2.522 8.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 5.525 -1.274 7.782 1.00 0.00 H new ATOM 718 N VAL A 332 1.315 -5.063 6.139 1.00 0.00 N ATOM 719 CA VAL A 332 -0.059 -4.677 5.687 1.00 0.00 C ATOM 720 C VAL A 332 -0.483 -3.344 6.301 1.00 0.00 C ATOM 721 O VAL A 332 -0.029 -2.956 7.360 1.00 0.00 O ATOM 722 CB VAL A 332 -1.033 -5.777 6.111 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.331 -5.659 5.323 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.406 -7.142 5.825 1.00 0.00 C ATOM 0 H VAL A 332 1.528 -4.855 7.115 1.00 0.00 H new ATOM 0 HA VAL A 332 -0.063 -4.561 4.603 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.244 -5.673 7.175 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -3.018 -6.447 5.633 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.785 -4.687 5.513 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -2.121 -5.759 4.258 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -1.097 -7.930 6.126 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.197 -7.230 4.759 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.523 -7.240 6.386 1.00 0.00 H new ATOM 734 N PHE A 333 -1.356 -2.634 5.626 1.00 0.00 N ATOM 735 CA PHE A 333 -1.828 -1.312 6.139 1.00 0.00 C ATOM 736 C PHE A 333 -3.333 -1.180 5.901 1.00 0.00 C ATOM 737 O PHE A 333 -3.840 -1.532 4.854 1.00 0.00 O ATOM 738 CB PHE A 333 -1.094 -0.195 5.400 1.00 0.00 C ATOM 739 CG PHE A 333 0.387 -0.324 5.658 1.00 0.00 C ATOM 740 CD1 PHE A 333 1.150 -1.237 4.921 1.00 0.00 C ATOM 741 CD2 PHE A 333 0.994 0.469 6.638 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.524 -1.357 5.163 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.364 0.350 6.883 1.00 0.00 C ATOM 744 CZ PHE A 333 3.131 -0.560 6.146 1.00 0.00 C ATOM 0 H PHE A 333 -1.764 -2.918 4.735 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.624 -1.239 7.207 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.296 -0.255 4.331 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.451 0.778 5.738 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.679 -1.849 4.166 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.403 1.173 7.205 1.00 0.00 H new ATOM 0 HE1 PHE A 333 3.115 -2.061 4.595 1.00 0.00 H new ATOM 0 HE2 PHE A 333 2.832 0.960 7.641 1.00 0.00 H new ATOM 0 HZ PHE A 333 4.191 -0.649 6.334 1.00 0.00 H new ATOM 754 N HIS A 334 -4.050 -0.681 6.876 1.00 0.00 N ATOM 755 CA HIS A 334 -5.532 -0.525 6.735 1.00 0.00 C ATOM 756 C HIS A 334 -5.864 0.943 6.432 1.00 0.00 C ATOM 757 O HIS A 334 -6.715 1.240 5.617 1.00 0.00 O ATOM 758 CB HIS A 334 -6.199 -0.960 8.057 1.00 0.00 C ATOM 759 CG HIS A 334 -7.543 -1.592 7.788 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.491 -1.003 6.967 1.00 0.00 N ATOM 761 CD2 HIS A 334 -8.103 -2.767 8.227 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.561 -1.818 6.935 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.378 -2.907 7.686 1.00 0.00 N ATOM 0 H HIS A 334 -3.670 -0.372 7.771 1.00 0.00 H new ATOM 0 HA HIS A 334 -5.903 -1.144 5.918 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.556 -1.668 8.580 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.321 -0.097 8.711 1.00 0.00 H new ATOM 0 HD1 HIS A 334 -8.395 -0.114 6.476 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -7.627 -3.474 8.890 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.459 -1.616 6.370 1.00 0.00 H new ATOM 771 N ASP A 335 -5.204 1.864 7.089 1.00 0.00 N ATOM 772 CA ASP A 335 -5.485 3.313 6.847 1.00 0.00 C ATOM 773 C ASP A 335 -4.480 3.872 5.836 1.00 0.00 C ATOM 774 O ASP A 335 -3.415 3.323 5.633 1.00 0.00 O ATOM 775 CB ASP A 335 -5.360 4.083 8.163 1.00 0.00 C ATOM 776 CG ASP A 335 -6.315 3.486 9.199 1.00 0.00 C ATOM 777 OD1 ASP A 335 -6.109 2.344 9.577 1.00 0.00 O ATOM 778 OD2 ASP A 335 -7.237 4.179 9.594 1.00 0.00 O ATOM 0 H ASP A 335 -4.482 1.675 7.784 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.495 3.423 6.452 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -4.334 4.035 8.528 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -5.592 5.136 8.004 1.00 0.00 H new ATOM 783 N LYS A 336 -4.815 4.959 5.199 1.00 0.00 N ATOM 784 CA LYS A 336 -3.888 5.556 4.193 1.00 0.00 C ATOM 785 C LYS A 336 -2.711 6.235 4.897 1.00 0.00 C ATOM 786 O LYS A 336 -1.596 6.206 4.417 1.00 0.00 O ATOM 787 CB LYS A 336 -4.642 6.584 3.340 1.00 0.00 C ATOM 788 CG LYS A 336 -5.468 7.511 4.240 1.00 0.00 C ATOM 789 CD LYS A 336 -6.109 8.610 3.388 1.00 0.00 C ATOM 790 CE LYS A 336 -6.953 9.525 4.279 1.00 0.00 C ATOM 791 NZ LYS A 336 -8.136 8.775 4.792 1.00 0.00 N ATOM 0 H LYS A 336 -5.692 5.462 5.331 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.506 4.763 3.551 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -3.935 7.170 2.753 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.296 6.073 2.634 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.239 6.941 4.758 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -4.831 7.954 5.006 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -5.336 9.190 2.883 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.732 8.165 2.612 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -6.353 9.891 5.112 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.281 10.398 3.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -8.846 9.447 5.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -8.549 8.209 4.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -7.839 8.145 5.564 1.00 0.00 H new ATOM 805 N THR A 337 -2.940 6.845 6.025 1.00 0.00 N ATOM 806 CA THR A 337 -1.814 7.516 6.736 1.00 0.00 C ATOM 807 C THR A 337 -0.798 6.468 7.177 1.00 0.00 C ATOM 808 O THR A 337 0.382 6.576 6.906 1.00 0.00 O ATOM 809 CB THR A 337 -2.337 8.251 7.972 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.286 9.231 7.575 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.167 8.926 8.692 1.00 0.00 C ATOM 0 H THR A 337 -3.849 6.909 6.483 1.00 0.00 H new ATOM 0 HA THR A 337 -1.345 8.232 6.061 1.00 0.00 H new ATOM 0 HB THR A 337 -2.816 7.540 8.646 1.00 0.00 H new ATOM 0 HG1 THR A 337 -3.622 9.700 8.367 1.00 0.00 H new ATOM 0 HG21 THR A 337 -1.536 9.451 9.573 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.442 8.171 8.996 1.00 0.00 H new ATOM 0 HG23 THR A 337 -0.688 9.638 8.020 1.00 0.00 H new ATOM 819 N LYS A 338 -1.245 5.453 7.863 1.00 0.00 N ATOM 820 CA LYS A 338 -0.314 4.396 8.331 1.00 0.00 C ATOM 821 C LYS A 338 0.598 3.975 7.171 1.00 0.00 C ATOM 822 O LYS A 338 1.789 3.801 7.337 1.00 0.00 O ATOM 823 CB LYS A 338 -1.153 3.207 8.831 1.00 0.00 C ATOM 824 CG LYS A 338 -0.438 2.458 9.966 1.00 0.00 C ATOM 825 CD LYS A 338 -1.451 1.564 10.678 1.00 0.00 C ATOM 826 CE LYS A 338 -0.727 0.647 11.665 1.00 0.00 C ATOM 827 NZ LYS A 338 -0.212 1.455 12.807 1.00 0.00 N ATOM 0 H LYS A 338 -2.222 5.312 8.120 1.00 0.00 H new ATOM 0 HA LYS A 338 0.315 4.760 9.143 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -2.121 3.564 9.181 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.346 2.522 8.005 1.00 0.00 H new ATOM 0 HG2 LYS A 338 0.380 1.858 9.566 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.000 3.167 10.669 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -2.183 2.176 11.205 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -2.000 0.968 9.949 1.00 0.00 H new ATOM 0 HE2 LYS A 338 -1.407 -0.124 12.028 1.00 0.00 H new ATOM 0 HE3 LYS A 338 0.097 0.136 11.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 0.160 0.820 13.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 0.548 2.082 12.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -0.984 2.028 13.203 1.00 0.00 H new ATOM 841 N PHE A 339 0.050 3.829 5.994 1.00 0.00 N ATOM 842 CA PHE A 339 0.895 3.443 4.829 1.00 0.00 C ATOM 843 C PHE A 339 1.910 4.555 4.563 1.00 0.00 C ATOM 844 O PHE A 339 3.100 4.364 4.680 1.00 0.00 O ATOM 845 CB PHE A 339 0.018 3.242 3.589 1.00 0.00 C ATOM 846 CG PHE A 339 0.865 2.695 2.461 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.513 3.574 1.585 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.002 1.311 2.292 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.300 3.071 0.542 1.00 0.00 C ATOM 850 CE2 PHE A 339 1.790 0.806 1.247 1.00 0.00 C ATOM 851 CZ PHE A 339 2.440 1.686 0.372 1.00 0.00 C ATOM 0 H PHE A 339 -0.941 3.960 5.790 1.00 0.00 H new ATOM 0 HA PHE A 339 1.414 2.510 5.049 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.797 2.554 3.814 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.436 4.188 3.293 1.00 0.00 H new ATOM 0 HD1 PHE A 339 1.406 4.641 1.714 1.00 0.00 H new ATOM 0 HD2 PHE A 339 0.501 0.633 2.966 1.00 0.00 H new ATOM 0 HE1 PHE A 339 2.800 3.750 -0.132 1.00 0.00 H new ATOM 0 HE2 PHE A 339 1.896 -0.261 1.117 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.048 1.298 -0.432 1.00 0.00 H new ATOM 861 N THR A 340 1.444 5.720 4.205 1.00 0.00 N ATOM 862 CA THR A 340 2.384 6.850 3.930 1.00 0.00 C ATOM 863 C THR A 340 3.460 6.920 5.021 1.00 0.00 C ATOM 864 O THR A 340 4.634 7.044 4.737 1.00 0.00 O ATOM 865 CB THR A 340 1.606 8.165 3.895 1.00 0.00 C ATOM 866 OG1 THR A 340 0.650 8.121 2.843 1.00 0.00 O ATOM 867 CG2 THR A 340 2.580 9.319 3.655 1.00 0.00 C ATOM 0 H THR A 340 0.455 5.941 4.090 1.00 0.00 H new ATOM 0 HA THR A 340 2.866 6.684 2.967 1.00 0.00 H new ATOM 0 HB THR A 340 1.091 8.313 4.844 1.00 0.00 H new ATOM 0 HG1 THR A 340 0.149 8.963 2.821 1.00 0.00 H new ATOM 0 HG21 THR A 340 2.030 10.260 3.629 1.00 0.00 H new ATOM 0 HG22 THR A 340 3.314 9.350 4.461 1.00 0.00 H new ATOM 0 HG23 THR A 340 3.092 9.171 2.704 1.00 0.00 H new ATOM 875 N GLN A 341 3.071 6.837 6.264 1.00 0.00 N ATOM 876 CA GLN A 341 4.081 6.892 7.364 1.00 0.00 C ATOM 877 C GLN A 341 5.184 5.876 7.079 1.00 0.00 C ATOM 878 O GLN A 341 6.359 6.175 7.179 1.00 0.00 O ATOM 879 CB GLN A 341 3.404 6.564 8.699 1.00 0.00 C ATOM 880 CG GLN A 341 2.566 7.762 9.151 1.00 0.00 C ATOM 881 CD GLN A 341 1.997 7.494 10.546 1.00 0.00 C ATOM 882 OE1 GLN A 341 2.126 6.405 11.069 1.00 0.00 O ATOM 883 NE2 GLN A 341 1.367 8.449 11.177 1.00 0.00 N ATOM 0 H GLN A 341 2.102 6.734 6.567 1.00 0.00 H new ATOM 0 HA GLN A 341 4.512 7.892 7.420 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.771 5.683 8.592 1.00 0.00 H new ATOM 0 HB3 GLN A 341 4.156 6.327 9.452 1.00 0.00 H new ATOM 0 HG2 GLN A 341 3.179 8.663 9.164 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.755 7.939 8.444 1.00 0.00 H new ATOM 0 HE21 GLN A 341 1.258 9.364 10.739 1.00 0.00 H new ATOM 0 HE22 GLN A 341 0.984 8.280 12.107 1.00 0.00 H new ATOM 892 N TYR A 342 4.818 4.681 6.711 1.00 0.00 N ATOM 893 CA TYR A 342 5.852 3.646 6.401 1.00 0.00 C ATOM 894 C TYR A 342 6.903 4.262 5.474 1.00 0.00 C ATOM 895 O TYR A 342 8.093 4.130 5.674 1.00 0.00 O ATOM 896 CB TYR A 342 5.191 2.455 5.706 1.00 0.00 C ATOM 897 CG TYR A 342 6.221 1.382 5.455 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.843 0.748 6.532 1.00 0.00 C ATOM 899 CD2 TYR A 342 6.553 1.025 4.147 1.00 0.00 C ATOM 900 CE1 TYR A 342 7.799 -0.247 6.302 1.00 0.00 C ATOM 901 CE2 TYR A 342 7.506 0.033 3.915 1.00 0.00 C ATOM 902 CZ TYR A 342 8.132 -0.605 4.991 1.00 0.00 C ATOM 903 OH TYR A 342 9.072 -1.588 4.760 1.00 0.00 O ATOM 0 H TYR A 342 3.851 4.373 6.611 1.00 0.00 H new ATOM 0 HA TYR A 342 6.324 3.305 7.322 1.00 0.00 H new ATOM 0 HB2 TYR A 342 4.384 2.062 6.325 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.744 2.773 4.764 1.00 0.00 H new ATOM 0 HD1 TYR A 342 6.586 1.026 7.543 1.00 0.00 H new ATOM 0 HD2 TYR A 342 6.072 1.517 3.314 1.00 0.00 H new ATOM 0 HE1 TYR A 342 8.279 -0.738 7.135 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.761 -0.243 2.902 1.00 0.00 H new ATOM 0 HH TYR A 342 9.183 -1.714 3.794 1.00 0.00 H new ATOM 913 N LEU A 343 6.458 4.944 4.463 1.00 0.00 N ATOM 914 CA LEU A 343 7.406 5.601 3.516 1.00 0.00 C ATOM 915 C LEU A 343 8.087 6.770 4.217 1.00 0.00 C ATOM 916 O LEU A 343 9.288 6.966 4.089 1.00 0.00 O ATOM 917 CB LEU A 343 6.638 6.091 2.289 1.00 0.00 C ATOM 918 CG LEU A 343 5.947 4.904 1.597 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.337 5.382 0.288 1.00 0.00 C ATOM 920 CD2 LEU A 343 6.965 3.802 1.279 1.00 0.00 C ATOM 0 H LEU A 343 5.470 5.079 4.246 1.00 0.00 H new ATOM 0 HA LEU A 343 8.166 4.889 3.195 1.00 0.00 H new ATOM 0 HB2 LEU A 343 5.896 6.833 2.585 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.320 6.582 1.594 1.00 0.00 H new ATOM 0 HG LEU A 343 5.180 4.508 2.263 1.00 0.00 H new ATOM 0 HD11 LEU A 343 4.845 4.547 -0.210 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.607 6.165 0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.122 5.777 -0.357 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.459 2.970 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.735 4.198 0.617 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.425 3.454 2.204 1.00 0.00 H new ATOM 932 N SER A 344 7.344 7.526 4.981 1.00 0.00 N ATOM 933 CA SER A 344 7.953 8.664 5.721 1.00 0.00 C ATOM 934 C SER A 344 9.107 8.127 6.562 1.00 0.00 C ATOM 935 O SER A 344 9.849 8.874 7.168 1.00 0.00 O ATOM 936 CB SER A 344 6.910 9.304 6.639 1.00 0.00 C ATOM 937 OG SER A 344 7.400 10.552 7.107 1.00 0.00 O ATOM 0 H SER A 344 6.342 7.403 5.123 1.00 0.00 H new ATOM 0 HA SER A 344 8.313 9.415 5.018 1.00 0.00 H new ATOM 0 HB2 SER A 344 5.973 9.447 6.100 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.696 8.645 7.481 1.00 0.00 H new ATOM 0 HG SER A 344 8.354 10.472 7.315 1.00 0.00 H new ATOM 943 N THR A 345 9.255 6.826 6.606 1.00 0.00 N ATOM 944 CA THR A 345 10.352 6.212 7.404 1.00 0.00 C ATOM 945 C THR A 345 10.966 5.050 6.612 1.00 0.00 C ATOM 946 O THR A 345 11.729 4.264 7.138 1.00 0.00 O ATOM 947 CB THR A 345 9.791 5.733 8.755 1.00 0.00 C ATOM 948 OG1 THR A 345 10.867 5.432 9.631 1.00 0.00 O ATOM 949 CG2 THR A 345 8.914 4.490 8.581 1.00 0.00 C ATOM 0 H THR A 345 8.656 6.161 6.118 1.00 0.00 H new ATOM 0 HA THR A 345 11.135 6.945 7.599 1.00 0.00 H new ATOM 0 HB THR A 345 9.176 6.530 9.174 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.596 5.019 9.123 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.532 4.175 9.552 1.00 0.00 H new ATOM 0 HG22 THR A 345 8.079 4.724 7.921 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.506 3.685 8.146 1.00 0.00 H new ATOM 957 N ASN A 346 10.671 4.964 5.331 1.00 0.00 N ATOM 958 CA ASN A 346 11.271 3.891 4.476 1.00 0.00 C ATOM 959 C ASN A 346 11.690 4.534 3.149 1.00 0.00 C ATOM 960 O ASN A 346 11.110 4.282 2.111 1.00 0.00 O ATOM 961 CB ASN A 346 10.263 2.761 4.214 1.00 0.00 C ATOM 962 CG ASN A 346 10.868 1.757 3.233 1.00 0.00 C ATOM 963 OD1 ASN A 346 11.917 1.196 3.486 1.00 0.00 O ATOM 964 ND2 ASN A 346 10.243 1.504 2.115 1.00 0.00 N ATOM 0 H ASN A 346 10.037 5.596 4.842 1.00 0.00 H new ATOM 0 HA ASN A 346 12.129 3.452 4.985 1.00 0.00 H new ATOM 0 HB2 ASN A 346 10.007 2.263 5.149 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.338 3.171 3.808 1.00 0.00 H new ATOM 0 HD21 ASN A 346 10.634 0.835 1.452 1.00 0.00 H new ATOM 0 HD22 ASN A 346 9.363 1.975 1.905 1.00 0.00 H new ATOM 971 N PRO A 347 12.698 5.375 3.200 1.00 0.00 N ATOM 972 CA PRO A 347 13.232 6.103 2.008 1.00 0.00 C ATOM 973 C PRO A 347 13.327 5.221 0.759 1.00 0.00 C ATOM 974 O PRO A 347 12.999 5.645 -0.330 1.00 0.00 O ATOM 975 CB PRO A 347 14.626 6.537 2.466 1.00 0.00 C ATOM 976 CG PRO A 347 14.477 6.765 3.933 1.00 0.00 C ATOM 977 CD PRO A 347 13.459 5.724 4.417 1.00 0.00 C ATOM 0 HA PRO A 347 12.582 6.926 1.711 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.371 5.769 2.256 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.949 7.443 1.953 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.431 6.646 4.446 1.00 0.00 H new ATOM 0 HG3 PRO A 347 14.129 7.777 4.138 1.00 0.00 H new ATOM 0 HD2 PRO A 347 13.953 4.851 4.843 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.809 6.132 5.191 1.00 0.00 H new ATOM 985 N ALA A 348 13.785 4.006 0.913 1.00 0.00 N ATOM 986 CA ALA A 348 13.923 3.087 -0.257 1.00 0.00 C ATOM 987 C ALA A 348 12.707 3.212 -1.179 1.00 0.00 C ATOM 988 O ALA A 348 12.826 3.507 -2.354 1.00 0.00 O ATOM 989 CB ALA A 348 14.024 1.644 0.244 1.00 0.00 C ATOM 0 H ALA A 348 14.072 3.607 1.807 1.00 0.00 H new ATOM 0 HA ALA A 348 14.821 3.356 -0.813 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.125 0.970 -0.607 1.00 0.00 H new ATOM 0 HB2 ALA A 348 14.895 1.544 0.892 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.124 1.389 0.804 1.00 0.00 H new ATOM 995 N LEU A 349 11.535 2.992 -0.664 1.00 0.00 N ATOM 996 CA LEU A 349 10.331 3.102 -1.527 1.00 0.00 C ATOM 997 C LEU A 349 10.029 4.583 -1.779 1.00 0.00 C ATOM 998 O LEU A 349 9.654 4.974 -2.862 1.00 0.00 O ATOM 999 CB LEU A 349 9.137 2.436 -0.827 1.00 0.00 C ATOM 1000 CG LEU A 349 9.103 0.929 -1.119 1.00 0.00 C ATOM 1001 CD1 LEU A 349 7.948 0.293 -0.342 1.00 0.00 C ATOM 1002 CD2 LEU A 349 8.921 0.670 -2.631 1.00 0.00 C ATOM 0 H LEU A 349 11.358 2.743 0.309 1.00 0.00 H new ATOM 0 HA LEU A 349 10.510 2.601 -2.479 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.202 2.601 0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.209 2.897 -1.164 1.00 0.00 H new ATOM 0 HG LEU A 349 10.049 0.486 -0.807 1.00 0.00 H new ATOM 0 HD11 LEU A 349 7.919 -0.777 -0.545 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.095 0.456 0.726 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.007 0.747 -0.652 1.00 0.00 H new ATOM 0 HD21 LEU A 349 8.900 -0.404 -2.816 1.00 0.00 H new ATOM 0 HD22 LEU A 349 7.984 1.115 -2.966 1.00 0.00 H new ATOM 0 HD23 LEU A 349 9.751 1.116 -3.179 1.00 0.00 H new ATOM 1014 N GLN A 350 10.174 5.404 -0.781 1.00 0.00 N ATOM 1015 CA GLN A 350 9.879 6.850 -0.948 1.00 0.00 C ATOM 1016 C GLN A 350 10.467 7.377 -2.269 1.00 0.00 C ATOM 1017 O GLN A 350 9.836 8.151 -2.960 1.00 0.00 O ATOM 1018 CB GLN A 350 10.468 7.605 0.254 1.00 0.00 C ATOM 1019 CG GLN A 350 9.589 8.802 0.608 1.00 0.00 C ATOM 1020 CD GLN A 350 10.181 9.528 1.819 1.00 0.00 C ATOM 1021 OE1 GLN A 350 11.164 9.089 2.383 1.00 0.00 O ATOM 1022 NE2 GLN A 350 9.622 10.626 2.246 1.00 0.00 N ATOM 0 H GLN A 350 10.487 5.133 0.151 1.00 0.00 H new ATOM 0 HA GLN A 350 8.801 7.006 -0.989 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.545 6.936 1.111 1.00 0.00 H new ATOM 0 HB3 GLN A 350 11.478 7.943 0.021 1.00 0.00 H new ATOM 0 HG2 GLN A 350 9.523 9.482 -0.241 1.00 0.00 H new ATOM 0 HG3 GLN A 350 8.575 8.469 0.830 1.00 0.00 H new ATOM 0 HE21 GLN A 350 8.797 10.995 1.773 1.00 0.00 H new ATOM 0 HE22 GLN A 350 10.010 11.115 3.053 1.00 0.00 H new ATOM 1031 N ARG A 351 11.658 6.970 -2.639 1.00 0.00 N ATOM 1032 CA ARG A 351 12.230 7.472 -3.926 1.00 0.00 C ATOM 1033 C ARG A 351 11.567 6.744 -5.102 1.00 0.00 C ATOM 1034 O ARG A 351 11.253 7.347 -6.108 1.00 0.00 O ATOM 1035 CB ARG A 351 13.753 7.275 -3.967 1.00 0.00 C ATOM 1036 CG ARG A 351 14.110 5.882 -3.458 1.00 0.00 C ATOM 1037 CD ARG A 351 15.507 5.480 -3.942 1.00 0.00 C ATOM 1038 NE ARG A 351 15.525 5.453 -5.432 1.00 0.00 N ATOM 1039 CZ ARG A 351 16.660 5.383 -6.073 1.00 0.00 C ATOM 1040 NH1 ARG A 351 17.780 5.298 -5.408 1.00 0.00 N ATOM 1041 NH2 ARG A 351 16.675 5.387 -7.377 1.00 0.00 N ATOM 0 H ARG A 351 12.249 6.324 -2.116 1.00 0.00 H new ATOM 0 HA ARG A 351 12.029 8.541 -4.003 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.118 7.404 -4.986 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.243 8.032 -3.355 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.077 5.866 -2.369 1.00 0.00 H new ATOM 0 HG3 ARG A 351 13.374 5.159 -3.810 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.250 6.186 -3.571 1.00 0.00 H new ATOM 0 HD3 ARG A 351 15.773 4.500 -3.546 1.00 0.00 H new ATOM 0 HE ARG A 351 14.648 5.489 -5.952 1.00 0.00 H new ATOM 0 HH11 ARG A 351 17.768 5.286 -4.388 1.00 0.00 H new ATOM 0 HH12 ARG A 351 18.667 5.243 -5.908 1.00 0.00 H new ATOM 0 HH21 ARG A 351 15.799 5.445 -7.897 1.00 0.00 H new ATOM 0 HH22 ARG A 351 17.562 5.332 -7.877 1.00 0.00 H new ATOM 1055 N ILE A 352 11.329 5.458 -4.993 1.00 0.00 N ATOM 1056 CA ILE A 352 10.664 4.747 -6.129 1.00 0.00 C ATOM 1057 C ILE A 352 9.171 5.086 -6.110 1.00 0.00 C ATOM 1058 O ILE A 352 8.637 5.647 -7.045 1.00 0.00 O ATOM 1059 CB ILE A 352 10.845 3.234 -5.984 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.328 2.924 -5.729 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.383 2.545 -7.273 1.00 0.00 C ATOM 1062 CD1 ILE A 352 12.600 1.425 -5.909 1.00 0.00 C ATOM 0 H ILE A 352 11.561 4.881 -4.185 1.00 0.00 H new ATOM 0 HA ILE A 352 11.112 5.064 -7.071 1.00 0.00 H new ATOM 0 HB ILE A 352 10.251 2.867 -5.147 1.00 0.00 H new ATOM 0 HG12 ILE A 352 12.949 3.498 -6.416 1.00 0.00 H new ATOM 0 HG13 ILE A 352 12.602 3.231 -4.720 1.00 0.00 H new ATOM 0 HG21 ILE A 352 10.510 1.467 -7.175 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.332 2.772 -7.450 1.00 0.00 H new ATOM 0 HG23 ILE A 352 10.978 2.906 -8.112 1.00 0.00 H new ATOM 0 HD11 ILE A 352 13.655 1.222 -5.725 1.00 0.00 H new ATOM 0 HD12 ILE A 352 11.993 0.858 -5.204 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.346 1.129 -6.927 1.00 0.00 H new ATOM 1074 N ILE A 353 8.504 4.760 -5.040 1.00 0.00 N ATOM 1075 CA ILE A 353 7.053 5.069 -4.931 1.00 0.00 C ATOM 1076 C ILE A 353 6.892 6.566 -4.646 1.00 0.00 C ATOM 1077 O ILE A 353 7.842 7.322 -4.705 1.00 0.00 O ATOM 1078 CB ILE A 353 6.458 4.225 -3.784 1.00 0.00 C ATOM 1079 CG1 ILE A 353 6.206 2.799 -4.297 1.00 0.00 C ATOM 1080 CG2 ILE A 353 5.138 4.830 -3.281 1.00 0.00 C ATOM 1081 CD1 ILE A 353 5.781 1.871 -3.148 1.00 0.00 C ATOM 0 H ILE A 353 8.906 4.289 -4.229 1.00 0.00 H new ATOM 0 HA ILE A 353 6.529 4.829 -5.856 1.00 0.00 H new ATOM 0 HB ILE A 353 7.164 4.211 -2.954 1.00 0.00 H new ATOM 0 HG12 ILE A 353 5.430 2.815 -5.063 1.00 0.00 H new ATOM 0 HG13 ILE A 353 7.110 2.412 -4.767 1.00 0.00 H new ATOM 0 HG21 ILE A 353 4.741 4.216 -2.473 1.00 0.00 H new ATOM 0 HG22 ILE A 353 5.317 5.840 -2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 353 4.418 4.864 -4.099 1.00 0.00 H new ATOM 0 HD11 ILE A 353 5.608 0.867 -3.536 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.569 1.839 -2.396 1.00 0.00 H new ATOM 0 HD13 ILE A 353 4.864 2.248 -2.696 1.00 0.00 H new