USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=21 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 310 HIS : no HE2:sc= -8.05! C(o=-14!,f=-13!) USER MOD Set 1.2: A 312 CYS SG : rot -56:sc= -5.69! USER MOD Set 2.1: A 290 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 294 MET CE :methyl 158:sc= 0 (180deg=-0.673) USER MOD Single : A 293 THR OG1 : rot -179:sc= -0.211 USER MOD Single : A 295 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0342) USER MOD Single : A 301 THR OG1 : rot 33:sc= 0.31 USER MOD Single : A 305 GLN : amide:sc= 0 X(o=0,f=-0.076) USER MOD Single : A 306 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 313 GLN : amide:sc= -0.0459 K(o=-0.046,f=-1.3!) 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 180:sc=-0.00562 USER MOD Single : A 325 THR OG1 : rot 4:sc= 0.852 USER MOD Single : A 330 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 LYS NZ :NH3+ 157:sc= -0.0563 (180deg=-0.463) USER MOD Single : A 334 HIS : no HE2:sc= -1.68 K(o=-1.7,f=-2.7!) USER MOD Single : A 336 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.076) USER MOD Single : A 337 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ 159:sc= -0.129 (180deg=-0.678) USER MOD Single : A 340 THR OG1 : rot 84:sc= 1 USER MOD Single : A 341 GLN : amide:sc= -0.614 K(o=-0.61,f=-1.9) USER MOD Single : A 342 TYR OH : rot 30:sc= 0 USER MOD Single : A 344 SER OG : rot 180:sc= 0 USER MOD Single : A 345 THR OG1 : rot -37:sc= 0.391 USER MOD Single : A 346 ASN : amide:sc= -1.75 K(o=-1.8,f=-0.33) USER MOD Single : A 350 GLN : amide:sc= -0.73 X(o=-0.73,f=-0.92) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.887 2.769 2.348 1.00 0.00 N ATOM 2 CA PHE A 289 -18.523 2.271 2.019 1.00 0.00 C ATOM 3 C PHE A 289 -18.055 2.957 0.733 1.00 0.00 C ATOM 4 O PHE A 289 -17.076 2.568 0.127 1.00 0.00 O ATOM 5 CB PHE A 289 -18.575 0.750 1.789 1.00 0.00 C ATOM 6 CG PHE A 289 -18.429 0.001 3.099 1.00 0.00 C ATOM 7 CD1 PHE A 289 -19.076 0.454 4.257 1.00 0.00 C ATOM 8 CD2 PHE A 289 -17.646 -1.160 3.147 1.00 0.00 C ATOM 9 CE1 PHE A 289 -18.937 -0.251 5.459 1.00 0.00 C ATOM 10 CE2 PHE A 289 -17.508 -1.864 4.349 1.00 0.00 C ATOM 11 CZ PHE A 289 -18.152 -1.410 5.505 1.00 0.00 C ATOM 0 HA PHE A 289 -17.837 2.490 2.837 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -19.519 0.482 1.315 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -17.780 0.454 1.105 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -19.682 1.347 4.222 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -17.148 -1.512 2.256 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -19.435 0.099 6.351 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -16.904 -2.758 4.384 1.00 0.00 H new ATOM 0 HZ PHE A 289 -18.044 -1.953 6.432 1.00 0.00 H new ATOM 21 N SER A 290 -18.770 3.953 0.298 1.00 0.00 N ATOM 22 CA SER A 290 -18.403 4.656 -0.969 1.00 0.00 C ATOM 23 C SER A 290 -17.531 5.888 -0.692 1.00 0.00 C ATOM 24 O SER A 290 -16.578 6.143 -1.400 1.00 0.00 O ATOM 25 CB SER A 290 -19.686 5.063 -1.717 1.00 0.00 C ATOM 26 OG SER A 290 -19.540 4.741 -3.095 1.00 0.00 O ATOM 0 H SER A 290 -19.600 4.316 0.766 1.00 0.00 H new ATOM 0 HA SER A 290 -17.820 3.974 -1.588 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.547 4.543 -1.298 1.00 0.00 H new ATOM 0 HB3 SER A 290 -19.869 6.131 -1.597 1.00 0.00 H new ATOM 0 HG SER A 290 -20.354 4.995 -3.578 1.00 0.00 H new ATOM 32 N PRO A 291 -17.859 6.658 0.306 1.00 0.00 N ATOM 33 CA PRO A 291 -17.098 7.885 0.639 1.00 0.00 C ATOM 34 C PRO A 291 -15.829 7.613 1.466 1.00 0.00 C ATOM 35 O PRO A 291 -14.758 8.059 1.120 1.00 0.00 O ATOM 36 CB PRO A 291 -18.108 8.753 1.431 1.00 0.00 C ATOM 37 CG PRO A 291 -19.312 7.879 1.705 1.00 0.00 C ATOM 38 CD PRO A 291 -18.981 6.458 1.223 1.00 0.00 C ATOM 0 HA PRO A 291 -16.725 8.371 -0.262 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.667 9.107 2.363 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -18.393 9.635 0.858 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -19.548 7.876 2.769 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -20.189 8.264 1.185 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.709 5.806 2.053 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.832 5.997 0.721 1.00 0.00 H new ATOM 46 N GLU A 292 -15.941 6.927 2.571 1.00 0.00 N ATOM 47 CA GLU A 292 -14.726 6.681 3.421 1.00 0.00 C ATOM 48 C GLU A 292 -14.002 5.380 3.026 1.00 0.00 C ATOM 49 O GLU A 292 -12.823 5.371 2.719 1.00 0.00 O ATOM 50 CB GLU A 292 -15.154 6.609 4.905 1.00 0.00 C ATOM 51 CG GLU A 292 -16.595 6.068 5.022 1.00 0.00 C ATOM 52 CD GLU A 292 -17.604 7.217 4.904 1.00 0.00 C ATOM 53 OE1 GLU A 292 -17.198 8.302 4.523 1.00 0.00 O ATOM 54 OE2 GLU A 292 -18.765 6.989 5.202 1.00 0.00 O ATOM 0 H GLU A 292 -16.810 6.527 2.925 1.00 0.00 H new ATOM 0 HA GLU A 292 -14.029 7.505 3.265 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -14.470 5.964 5.457 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -15.092 7.599 5.357 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -16.779 5.331 4.240 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -16.723 5.558 5.977 1.00 0.00 H new ATOM 61 N THR A 293 -14.694 4.282 3.084 1.00 0.00 N ATOM 62 CA THR A 293 -14.067 2.964 2.778 1.00 0.00 C ATOM 63 C THR A 293 -13.435 2.938 1.390 1.00 0.00 C ATOM 64 O THR A 293 -12.326 2.475 1.219 1.00 0.00 O ATOM 65 CB THR A 293 -15.142 1.882 2.839 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.890 2.022 4.039 1.00 0.00 O ATOM 67 CG2 THR A 293 -14.495 0.500 2.793 1.00 0.00 C ATOM 0 H THR A 293 -15.682 4.237 3.334 1.00 0.00 H new ATOM 0 HA THR A 293 -13.281 2.789 3.513 1.00 0.00 H new ATOM 0 HB THR A 293 -15.807 1.990 1.982 1.00 0.00 H new ATOM 0 HG1 THR A 293 -16.570 1.318 4.085 1.00 0.00 H new ATOM 0 HG21 THR A 293 -15.269 -0.266 2.837 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.931 0.393 1.866 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.822 0.385 3.643 1.00 0.00 H new ATOM 75 N MET A 294 -14.134 3.380 0.391 1.00 0.00 N ATOM 76 CA MET A 294 -13.554 3.312 -0.973 1.00 0.00 C ATOM 77 C MET A 294 -12.241 4.096 -1.014 1.00 0.00 C ATOM 78 O MET A 294 -11.255 3.617 -1.528 1.00 0.00 O ATOM 79 CB MET A 294 -14.561 3.860 -1.997 1.00 0.00 C ATOM 80 CG MET A 294 -14.406 3.119 -3.331 1.00 0.00 C ATOM 81 SD MET A 294 -15.709 3.649 -4.470 1.00 0.00 S ATOM 82 CE MET A 294 -16.947 2.424 -3.971 1.00 0.00 C ATOM 0 H MET A 294 -15.070 3.781 0.456 1.00 0.00 H new ATOM 0 HA MET A 294 -13.341 2.274 -1.230 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.577 3.740 -1.621 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.399 4.928 -2.143 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.426 3.324 -3.762 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.464 2.042 -3.170 1.00 0.00 H new ATOM 0 HE1 MET A 294 -17.941 2.781 -4.240 1.00 0.00 H new ATOM 0 HE2 MET A 294 -16.750 1.480 -4.479 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.895 2.273 -2.893 1.00 0.00 H new ATOM 92 N LYS A 295 -12.208 5.283 -0.463 1.00 0.00 N ATOM 93 CA LYS A 295 -10.935 6.070 -0.464 1.00 0.00 C ATOM 94 C LYS A 295 -9.796 5.155 -0.035 1.00 0.00 C ATOM 95 O LYS A 295 -8.703 5.222 -0.559 1.00 0.00 O ATOM 96 CB LYS A 295 -11.053 7.243 0.516 1.00 0.00 C ATOM 97 CG LYS A 295 -12.184 8.187 0.073 1.00 0.00 C ATOM 98 CD LYS A 295 -11.684 9.143 -1.013 1.00 0.00 C ATOM 99 CE LYS A 295 -12.749 10.208 -1.300 1.00 0.00 C ATOM 100 NZ LYS A 295 -12.702 11.258 -0.241 1.00 0.00 N ATOM 0 H LYS A 295 -13.002 5.740 -0.015 1.00 0.00 H new ATOM 0 HA LYS A 295 -10.741 6.462 -1.462 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.252 6.870 1.521 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -10.110 7.788 0.560 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -13.025 7.606 -0.304 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -12.548 8.756 0.928 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -10.758 9.620 -0.692 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -11.458 8.587 -1.923 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -12.576 10.656 -2.279 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -13.738 9.750 -1.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -13.327 12.046 -0.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -13.019 10.853 0.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -11.727 11.607 -0.142 1.00 0.00 H new ATOM 114 N ALA A 296 -10.051 4.274 0.889 1.00 0.00 N ATOM 115 CA ALA A 296 -8.980 3.337 1.304 1.00 0.00 C ATOM 116 C ALA A 296 -8.637 2.464 0.098 1.00 0.00 C ATOM 117 O ALA A 296 -7.487 2.279 -0.243 1.00 0.00 O ATOM 118 CB ALA A 296 -9.466 2.466 2.460 1.00 0.00 C ATOM 0 H ALA A 296 -10.944 4.164 1.369 1.00 0.00 H new ATOM 0 HA ALA A 296 -8.101 3.886 1.640 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.672 1.781 2.758 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.735 3.100 3.305 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -10.339 1.895 2.143 1.00 0.00 H new ATOM 124 N ARG A 297 -9.637 1.951 -0.573 1.00 0.00 N ATOM 125 CA ARG A 297 -9.373 1.119 -1.781 1.00 0.00 C ATOM 126 C ARG A 297 -8.644 1.989 -2.802 1.00 0.00 C ATOM 127 O ARG A 297 -7.659 1.595 -3.391 1.00 0.00 O ATOM 128 CB ARG A 297 -10.693 0.645 -2.395 1.00 0.00 C ATOM 129 CG ARG A 297 -11.513 -0.105 -1.339 1.00 0.00 C ATOM 130 CD ARG A 297 -12.870 -0.580 -1.926 1.00 0.00 C ATOM 131 NE ARG A 297 -13.073 -2.050 -1.672 1.00 0.00 N ATOM 132 CZ ARG A 297 -12.189 -2.946 -2.033 1.00 0.00 C ATOM 133 NH1 ARG A 297 -11.127 -2.597 -2.702 1.00 0.00 N ATOM 134 NH2 ARG A 297 -12.386 -4.204 -1.746 1.00 0.00 N ATOM 0 H ARG A 297 -10.621 2.073 -0.336 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.776 0.249 -1.506 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.258 1.498 -2.770 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -10.496 -0.006 -3.247 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -10.948 -0.964 -0.977 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -11.690 0.544 -0.482 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -13.685 -0.012 -1.477 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -12.897 -0.384 -2.998 1.00 0.00 H new ATOM 0 HE ARG A 297 -13.926 -2.358 -1.204 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -10.979 -1.619 -2.949 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -10.444 -3.302 -2.979 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -13.227 -4.487 -1.242 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -11.699 -4.905 -2.026 1.00 0.00 H new ATOM 148 N ARG A 298 -9.130 3.179 -3.004 1.00 0.00 N ATOM 149 CA ARG A 298 -8.486 4.101 -3.972 1.00 0.00 C ATOM 150 C ARG A 298 -7.008 4.230 -3.602 1.00 0.00 C ATOM 151 O ARG A 298 -6.133 4.063 -4.429 1.00 0.00 O ATOM 152 CB ARG A 298 -9.194 5.466 -3.894 1.00 0.00 C ATOM 153 CG ARG A 298 -9.233 6.131 -5.281 1.00 0.00 C ATOM 154 CD ARG A 298 -7.806 6.458 -5.764 1.00 0.00 C ATOM 155 NE ARG A 298 -7.815 7.771 -6.485 1.00 0.00 N ATOM 156 CZ ARG A 298 -8.716 8.035 -7.397 1.00 0.00 C ATOM 157 NH1 ARG A 298 -9.509 7.097 -7.834 1.00 0.00 N ATOM 158 NH2 ARG A 298 -8.786 9.233 -7.913 1.00 0.00 N ATOM 0 H ARG A 298 -9.954 3.555 -2.535 1.00 0.00 H new ATOM 0 HA ARG A 298 -8.565 3.724 -4.992 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.209 5.335 -3.518 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -8.673 6.113 -3.188 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -9.722 5.468 -5.995 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -9.826 7.044 -5.236 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -7.124 6.501 -4.915 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.444 5.670 -6.424 1.00 0.00 H new ATOM 0 HE ARG A 298 -7.107 8.471 -6.262 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -9.430 6.149 -7.465 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -10.209 7.311 -8.545 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -8.140 9.959 -7.605 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -9.487 9.442 -8.624 1.00 0.00 H new ATOM 172 N ALA A 299 -6.722 4.502 -2.359 1.00 0.00 N ATOM 173 CA ALA A 299 -5.298 4.611 -1.944 1.00 0.00 C ATOM 174 C ALA A 299 -4.614 3.286 -2.278 1.00 0.00 C ATOM 175 O ALA A 299 -3.450 3.237 -2.631 1.00 0.00 O ATOM 176 CB ALA A 299 -5.218 4.872 -0.439 1.00 0.00 C ATOM 0 H ALA A 299 -7.407 4.652 -1.619 1.00 0.00 H new ATOM 0 HA ALA A 299 -4.809 5.434 -2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -4.173 4.951 -0.139 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -5.735 5.802 -0.203 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.689 4.049 0.099 1.00 0.00 H new ATOM 182 N TRP A 300 -5.351 2.213 -2.191 1.00 0.00 N ATOM 183 CA TRP A 300 -4.789 0.877 -2.523 1.00 0.00 C ATOM 184 C TRP A 300 -4.817 0.698 -4.041 1.00 0.00 C ATOM 185 O TRP A 300 -4.161 -0.166 -4.584 1.00 0.00 O ATOM 186 CB TRP A 300 -5.639 -0.218 -1.877 1.00 0.00 C ATOM 187 CG TRP A 300 -5.730 -0.086 -0.372 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.680 -0.716 0.366 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.895 0.655 0.602 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.481 -0.442 1.700 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.406 0.389 1.903 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.763 1.508 0.517 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.829 0.930 3.048 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.188 2.050 1.679 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.718 1.758 2.938 1.00 0.00 C ATOM 0 H TRP A 300 -6.329 2.207 -1.901 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.767 0.807 -2.150 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.643 -0.188 -2.300 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -5.217 -1.192 -2.126 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.470 -1.336 -0.032 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -7.064 -0.813 2.451 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.340 1.742 -0.449 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -5.244 0.707 4.020 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.328 2.698 1.598 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.265 2.175 3.825 1.00 0.00 H new ATOM 206 N THR A 301 -5.566 1.512 -4.733 1.00 0.00 N ATOM 207 CA THR A 301 -5.633 1.392 -6.218 1.00 0.00 C ATOM 208 C THR A 301 -4.436 2.108 -6.854 1.00 0.00 C ATOM 209 O THR A 301 -3.688 1.539 -7.625 1.00 0.00 O ATOM 210 CB THR A 301 -6.917 2.045 -6.718 1.00 0.00 C ATOM 211 OG1 THR A 301 -8.015 1.588 -5.940 1.00 0.00 O ATOM 212 CG2 THR A 301 -7.139 1.681 -8.185 1.00 0.00 C ATOM 0 H THR A 301 -6.136 2.257 -4.333 1.00 0.00 H new ATOM 0 HA THR A 301 -5.615 0.337 -6.491 1.00 0.00 H new ATOM 0 HB THR A 301 -6.834 3.128 -6.625 1.00 0.00 H new ATOM 0 HG1 THR A 301 -7.720 1.429 -5.019 1.00 0.00 H new ATOM 0 HG21 THR A 301 -8.057 2.148 -8.541 1.00 0.00 H new ATOM 0 HG22 THR A 301 -6.297 2.036 -8.779 1.00 0.00 H new ATOM 0 HG23 THR A 301 -7.221 0.599 -8.283 1.00 0.00 H new ATOM 220 N ASP A 302 -4.263 3.365 -6.543 1.00 0.00 N ATOM 221 CA ASP A 302 -3.134 4.141 -7.130 1.00 0.00 C ATOM 222 C ASP A 302 -1.808 3.445 -6.822 1.00 0.00 C ATOM 223 O ASP A 302 -0.944 3.324 -7.669 1.00 0.00 O ATOM 224 CB ASP A 302 -3.123 5.547 -6.526 1.00 0.00 C ATOM 225 CG ASP A 302 -1.982 6.360 -7.141 1.00 0.00 C ATOM 226 OD1 ASP A 302 -0.859 6.198 -6.694 1.00 0.00 O ATOM 227 OD2 ASP A 302 -2.253 7.131 -8.046 1.00 0.00 O ATOM 0 H ASP A 302 -4.860 3.890 -5.903 1.00 0.00 H new ATOM 0 HA ASP A 302 -3.262 4.203 -8.211 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -4.077 6.041 -6.712 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -3.000 5.488 -5.445 1.00 0.00 H new ATOM 232 N VAL A 303 -1.631 2.989 -5.620 1.00 0.00 N ATOM 233 CA VAL A 303 -0.357 2.312 -5.275 1.00 0.00 C ATOM 234 C VAL A 303 -0.330 0.920 -5.915 1.00 0.00 C ATOM 235 O VAL A 303 0.716 0.413 -6.266 1.00 0.00 O ATOM 236 CB VAL A 303 -0.257 2.191 -3.754 1.00 0.00 C ATOM 237 CG1 VAL A 303 -0.400 3.576 -3.119 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.370 1.269 -3.244 1.00 0.00 C ATOM 0 H VAL A 303 -2.311 3.055 -4.863 1.00 0.00 H new ATOM 0 HA VAL A 303 0.488 2.890 -5.650 1.00 0.00 H new ATOM 0 HB VAL A 303 0.712 1.772 -3.483 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -0.329 3.488 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL A 303 0.394 4.227 -3.484 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -1.368 4.000 -3.386 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.301 1.181 -2.160 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.340 1.686 -3.513 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.261 0.283 -3.696 1.00 0.00 H new ATOM 248 N ILE A 304 -1.469 0.295 -6.075 1.00 0.00 N ATOM 249 CA ILE A 304 -1.485 -1.066 -6.692 1.00 0.00 C ATOM 250 C ILE A 304 -0.702 -1.031 -8.014 1.00 0.00 C ATOM 251 O ILE A 304 0.035 -1.944 -8.327 1.00 0.00 O ATOM 252 CB ILE A 304 -2.962 -1.512 -6.908 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.365 -2.551 -5.844 1.00 0.00 C ATOM 254 CG2 ILE A 304 -3.181 -2.130 -8.298 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.889 -2.756 -5.839 1.00 0.00 C ATOM 0 H ILE A 304 -2.381 0.664 -5.808 1.00 0.00 H new ATOM 0 HA ILE A 304 -1.005 -1.792 -6.035 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.578 -0.617 -6.823 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.866 -3.499 -6.046 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -3.034 -2.219 -4.860 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -4.225 -2.426 -8.404 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.932 -1.397 -9.065 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.542 -3.006 -8.412 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -5.154 -3.493 -5.081 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.383 -1.811 -5.614 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -5.212 -3.110 -6.818 1.00 0.00 H new ATOM 267 N GLN A 305 -0.860 0.002 -8.799 1.00 0.00 N ATOM 268 CA GLN A 305 -0.124 0.055 -10.095 1.00 0.00 C ATOM 269 C GLN A 305 1.352 0.404 -9.846 1.00 0.00 C ATOM 270 O GLN A 305 2.230 -0.057 -10.548 1.00 0.00 O ATOM 271 CB GLN A 305 -0.792 1.085 -11.033 1.00 0.00 C ATOM 272 CG GLN A 305 -0.216 2.491 -10.817 1.00 0.00 C ATOM 273 CD GLN A 305 -1.096 3.518 -11.531 1.00 0.00 C ATOM 274 OE1 GLN A 305 -2.273 3.627 -11.251 1.00 0.00 O ATOM 275 NE2 GLN A 305 -0.571 4.280 -12.450 1.00 0.00 N ATOM 0 H GLN A 305 -1.460 0.803 -8.602 1.00 0.00 H new ATOM 0 HA GLN A 305 -0.163 -0.922 -10.577 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.645 0.785 -12.070 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.867 1.099 -10.855 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -0.168 2.716 -9.752 1.00 0.00 H new ATOM 0 HG3 GLN A 305 0.803 2.541 -11.200 1.00 0.00 H new ATOM 0 HE21 GLN A 305 0.417 4.188 -12.685 1.00 0.00 H new ATOM 0 HE22 GLN A 305 -1.149 4.968 -12.934 1.00 0.00 H new ATOM 284 N THR A 306 1.635 1.211 -8.859 1.00 0.00 N ATOM 285 CA THR A 306 3.062 1.572 -8.595 1.00 0.00 C ATOM 286 C THR A 306 3.802 0.382 -7.989 1.00 0.00 C ATOM 287 O THR A 306 4.885 0.052 -8.399 1.00 0.00 O ATOM 288 CB THR A 306 3.139 2.738 -7.611 1.00 0.00 C ATOM 289 OG1 THR A 306 2.515 3.880 -8.179 1.00 0.00 O ATOM 290 CG2 THR A 306 4.609 3.048 -7.298 1.00 0.00 C ATOM 0 H THR A 306 0.951 1.632 -8.230 1.00 0.00 H new ATOM 0 HA THR A 306 3.521 1.854 -9.542 1.00 0.00 H new ATOM 0 HB THR A 306 2.625 2.471 -6.688 1.00 0.00 H new ATOM 0 HG1 THR A 306 2.563 4.627 -7.547 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.664 3.880 -6.596 1.00 0.00 H new ATOM 0 HG22 THR A 306 5.080 2.170 -6.857 1.00 0.00 H new ATOM 0 HG23 THR A 306 5.128 3.315 -8.218 1.00 0.00 H new ATOM 298 N LEU A 307 3.240 -0.245 -7.001 1.00 0.00 N ATOM 299 CA LEU A 307 3.937 -1.395 -6.350 1.00 0.00 C ATOM 300 C LEU A 307 4.527 -2.326 -7.426 1.00 0.00 C ATOM 301 O LEU A 307 5.720 -2.547 -7.484 1.00 0.00 O ATOM 302 CB LEU A 307 2.911 -2.184 -5.505 1.00 0.00 C ATOM 303 CG LEU A 307 2.819 -1.688 -4.041 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.204 -1.629 -3.362 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.154 -0.308 -4.004 1.00 0.00 C ATOM 0 H LEU A 307 2.326 -0.015 -6.611 1.00 0.00 H new ATOM 0 HA LEU A 307 4.742 -1.023 -5.717 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.929 -2.106 -5.971 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.182 -3.240 -5.508 1.00 0.00 H new ATOM 0 HG LEU A 307 2.214 -2.404 -3.484 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.092 -1.276 -2.337 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.649 -2.624 -3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 307 4.850 -0.945 -3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.091 0.038 -2.972 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.746 0.397 -4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.151 -0.376 -4.426 1.00 0.00 H new ATOM 317 N ARG A 308 3.693 -2.880 -8.261 1.00 0.00 N ATOM 318 CA ARG A 308 4.186 -3.809 -9.319 1.00 0.00 C ATOM 319 C ARG A 308 5.371 -3.196 -10.078 1.00 0.00 C ATOM 320 O ARG A 308 5.984 -3.847 -10.901 1.00 0.00 O ATOM 321 CB ARG A 308 3.049 -4.105 -10.302 1.00 0.00 C ATOM 322 CG ARG A 308 2.423 -2.791 -10.775 1.00 0.00 C ATOM 323 CD ARG A 308 1.407 -3.075 -11.886 1.00 0.00 C ATOM 324 NE ARG A 308 0.354 -3.997 -11.375 1.00 0.00 N ATOM 325 CZ ARG A 308 -0.765 -4.144 -12.033 1.00 0.00 C ATOM 326 NH1 ARG A 308 -0.972 -3.469 -13.131 1.00 0.00 N ATOM 327 NH2 ARG A 308 -1.679 -4.962 -11.589 1.00 0.00 N ATOM 0 H ARG A 308 2.684 -2.729 -8.257 1.00 0.00 H new ATOM 0 HA ARG A 308 4.521 -4.731 -8.844 1.00 0.00 H new ATOM 0 HB2 ARG A 308 3.430 -4.666 -11.156 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.293 -4.728 -9.823 1.00 0.00 H new ATOM 0 HG2 ARG A 308 1.933 -2.289 -9.941 1.00 0.00 H new ATOM 0 HG3 ARG A 308 3.199 -2.118 -11.141 1.00 0.00 H new ATOM 0 HD2 ARG A 308 0.955 -2.143 -12.227 1.00 0.00 H new ATOM 0 HD3 ARG A 308 1.908 -3.519 -12.746 1.00 0.00 H new ATOM 0 HE ARG A 308 0.507 -4.515 -10.510 1.00 0.00 H new ATOM 0 HH11 ARG A 308 -0.260 -2.826 -13.476 1.00 0.00 H new ATOM 0 HH12 ARG A 308 -1.846 -3.585 -13.644 1.00 0.00 H new ATOM 0 HH21 ARG A 308 -1.520 -5.486 -10.729 1.00 0.00 H new ATOM 0 HH22 ARG A 308 -2.553 -5.077 -12.102 1.00 0.00 H new ATOM 341 N GLU A 309 5.702 -1.955 -9.830 1.00 0.00 N ATOM 342 CA GLU A 309 6.844 -1.339 -10.571 1.00 0.00 C ATOM 343 C GLU A 309 8.149 -2.064 -10.236 1.00 0.00 C ATOM 344 O GLU A 309 8.994 -2.240 -11.092 1.00 0.00 O ATOM 345 CB GLU A 309 6.991 0.143 -10.198 1.00 0.00 C ATOM 346 CG GLU A 309 5.843 0.948 -10.818 1.00 0.00 C ATOM 347 CD GLU A 309 6.135 1.212 -12.298 1.00 0.00 C ATOM 348 OE1 GLU A 309 5.862 0.334 -13.102 1.00 0.00 O ATOM 349 OE2 GLU A 309 6.627 2.286 -12.603 1.00 0.00 O ATOM 0 H GLU A 309 5.238 -1.347 -9.155 1.00 0.00 H new ATOM 0 HA GLU A 309 6.639 -1.427 -11.638 1.00 0.00 H new ATOM 0 HB2 GLU A 309 6.984 0.258 -9.114 1.00 0.00 H new ATOM 0 HB3 GLU A 309 7.949 0.524 -10.553 1.00 0.00 H new ATOM 0 HG2 GLU A 309 4.906 0.401 -10.715 1.00 0.00 H new ATOM 0 HG3 GLU A 309 5.721 1.893 -10.288 1.00 0.00 H new ATOM 356 N HIS A 310 8.336 -2.474 -9.000 1.00 0.00 N ATOM 357 CA HIS A 310 9.609 -3.174 -8.621 1.00 0.00 C ATOM 358 C HIS A 310 9.318 -4.471 -7.846 1.00 0.00 C ATOM 359 O HIS A 310 8.327 -5.136 -8.075 1.00 0.00 O ATOM 360 CB HIS A 310 10.479 -2.226 -7.788 1.00 0.00 C ATOM 361 CG HIS A 310 9.911 -2.050 -6.408 1.00 0.00 C ATOM 362 ND1 HIS A 310 10.515 -2.616 -5.297 1.00 0.00 N ATOM 363 CD2 HIS A 310 8.828 -1.346 -5.930 1.00 0.00 C ATOM 364 CE1 HIS A 310 9.808 -2.245 -4.217 1.00 0.00 C ATOM 365 NE2 HIS A 310 8.767 -1.472 -4.546 1.00 0.00 N ATOM 0 H HIS A 310 7.665 -2.355 -8.241 1.00 0.00 H new ATOM 0 HA HIS A 310 10.145 -3.450 -9.529 1.00 0.00 H new ATOM 0 HB2 HIS A 310 11.493 -2.621 -7.721 1.00 0.00 H new ATOM 0 HB3 HIS A 310 10.547 -1.258 -8.284 1.00 0.00 H new ATOM 0 HD1 HIS A 310 11.346 -3.207 -5.299 1.00 0.00 H new ATOM 0 HD2 HIS A 310 8.133 -0.783 -6.536 1.00 0.00 H new ATOM 0 HE1 HIS A 310 10.051 -2.536 -3.205 1.00 0.00 H new ATOM 373 N LYS A 311 10.206 -4.853 -6.963 1.00 0.00 N ATOM 374 CA LYS A 311 10.033 -6.132 -6.201 1.00 0.00 C ATOM 375 C LYS A 311 8.992 -6.009 -5.087 1.00 0.00 C ATOM 376 O LYS A 311 9.322 -6.052 -3.920 1.00 0.00 O ATOM 377 CB LYS A 311 11.375 -6.538 -5.574 1.00 0.00 C ATOM 378 CG LYS A 311 12.514 -6.284 -6.563 1.00 0.00 C ATOM 379 CD LYS A 311 12.271 -7.080 -7.845 1.00 0.00 C ATOM 380 CE LYS A 311 13.543 -7.076 -8.693 1.00 0.00 C ATOM 381 NZ LYS A 311 13.358 -7.970 -9.869 1.00 0.00 N ATOM 0 H LYS A 311 11.051 -4.330 -6.734 1.00 0.00 H new ATOM 0 HA LYS A 311 9.686 -6.885 -6.908 1.00 0.00 H new ATOM 0 HB2 LYS A 311 11.544 -5.971 -4.659 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.352 -7.592 -5.296 1.00 0.00 H new ATOM 0 HG2 LYS A 311 12.580 -5.220 -6.791 1.00 0.00 H new ATOM 0 HG3 LYS A 311 13.466 -6.574 -6.118 1.00 0.00 H new ATOM 0 HD2 LYS A 311 11.986 -8.104 -7.602 1.00 0.00 H new ATOM 0 HD3 LYS A 311 11.445 -6.643 -8.406 1.00 0.00 H new ATOM 0 HE2 LYS A 311 13.768 -6.063 -9.025 1.00 0.00 H new ATOM 0 HE3 LYS A 311 14.391 -7.412 -8.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 14.223 -7.968 -10.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 13.163 -8.938 -9.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 12.559 -7.630 -10.441 1.00 0.00 H new ATOM 395 N CYS A 312 7.738 -5.908 -5.428 1.00 0.00 N ATOM 396 CA CYS A 312 6.690 -5.839 -4.370 1.00 0.00 C ATOM 397 C CYS A 312 5.345 -6.254 -4.963 1.00 0.00 C ATOM 398 O CYS A 312 4.703 -5.504 -5.672 1.00 0.00 O ATOM 399 CB CYS A 312 6.580 -4.425 -3.806 1.00 0.00 C ATOM 400 SG CYS A 312 7.970 -4.094 -2.697 1.00 0.00 S ATOM 0 H CYS A 312 7.394 -5.870 -6.387 1.00 0.00 H new ATOM 0 HA CYS A 312 6.967 -6.515 -3.561 1.00 0.00 H new ATOM 0 HB2 CYS A 312 6.572 -3.699 -4.619 1.00 0.00 H new ATOM 0 HB3 CYS A 312 5.639 -4.311 -3.268 1.00 0.00 H new ATOM 0 HG CYS A 312 8.004 -4.997 -1.762 1.00 0.00 H new ATOM 406 N GLN A 313 4.921 -7.448 -4.676 1.00 0.00 N ATOM 407 CA GLN A 313 3.621 -7.938 -5.213 1.00 0.00 C ATOM 408 C GLN A 313 2.454 -7.260 -4.456 1.00 0.00 C ATOM 409 O GLN A 313 2.308 -7.458 -3.266 1.00 0.00 O ATOM 410 CB GLN A 313 3.539 -9.452 -4.999 1.00 0.00 C ATOM 411 CG GLN A 313 4.585 -10.148 -5.874 1.00 0.00 C ATOM 412 CD GLN A 313 4.770 -11.591 -5.398 1.00 0.00 C ATOM 413 OE1 GLN A 313 4.735 -11.861 -4.214 1.00 0.00 O ATOM 414 NE2 GLN A 313 4.963 -12.535 -6.276 1.00 0.00 N ATOM 0 H GLN A 313 5.422 -8.114 -4.087 1.00 0.00 H new ATOM 0 HA GLN A 313 3.551 -7.700 -6.274 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.710 -9.692 -3.949 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.541 -9.812 -5.250 1.00 0.00 H new ATOM 0 HG2 GLN A 313 4.269 -10.136 -6.917 1.00 0.00 H new ATOM 0 HG3 GLN A 313 5.533 -9.612 -5.822 1.00 0.00 H new ATOM 0 HE21 GLN A 313 4.992 -12.309 -7.270 1.00 0.00 H new ATOM 0 HE22 GLN A 313 5.085 -13.500 -5.969 1.00 0.00 H new ATOM 423 N PRO A 314 1.622 -6.470 -5.118 1.00 0.00 N ATOM 424 CA PRO A 314 0.472 -5.792 -4.449 1.00 0.00 C ATOM 425 C PRO A 314 -0.782 -6.665 -4.403 1.00 0.00 C ATOM 426 O PRO A 314 -1.148 -7.294 -5.375 1.00 0.00 O ATOM 427 CB PRO A 314 0.233 -4.578 -5.335 1.00 0.00 C ATOM 428 CG PRO A 314 0.568 -5.054 -6.714 1.00 0.00 C ATOM 429 CD PRO A 314 1.675 -6.115 -6.552 1.00 0.00 C ATOM 0 HA PRO A 314 0.688 -5.555 -3.407 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.800 -4.237 -5.272 1.00 0.00 H new ATOM 0 HB3 PRO A 314 0.864 -3.740 -5.039 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.309 -5.479 -7.202 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.910 -4.228 -7.337 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.492 -6.983 -7.185 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.652 -5.719 -6.829 1.00 0.00 H new ATOM 437 N ARG A 315 -1.446 -6.690 -3.279 1.00 0.00 N ATOM 438 CA ARG A 315 -2.682 -7.510 -3.143 1.00 0.00 C ATOM 439 C ARG A 315 -3.665 -6.780 -2.231 1.00 0.00 C ATOM 440 O ARG A 315 -3.379 -6.538 -1.076 1.00 0.00 O ATOM 441 CB ARG A 315 -2.334 -8.859 -2.498 1.00 0.00 C ATOM 442 CG ARG A 315 -1.229 -9.583 -3.298 1.00 0.00 C ATOM 443 CD ARG A 315 0.167 -9.190 -2.777 1.00 0.00 C ATOM 444 NE ARG A 315 0.542 -10.103 -1.661 1.00 0.00 N ATOM 445 CZ ARG A 315 1.779 -10.161 -1.253 1.00 0.00 C ATOM 446 NH1 ARG A 315 2.682 -9.402 -1.807 1.00 0.00 N ATOM 447 NH2 ARG A 315 2.111 -10.977 -0.290 1.00 0.00 N ATOM 0 H ARG A 315 -1.181 -6.172 -2.441 1.00 0.00 H new ATOM 0 HA ARG A 315 -3.121 -7.669 -4.128 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -2.002 -8.701 -1.472 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -3.225 -9.485 -2.452 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -1.362 -10.662 -3.217 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -1.313 -9.330 -4.355 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.901 -9.256 -3.580 1.00 0.00 H new ATOM 0 HD3 ARG A 315 0.163 -8.156 -2.433 1.00 0.00 H new ATOM 0 HE ARG A 315 -0.169 -10.683 -1.216 1.00 0.00 H new ATOM 0 HH11 ARG A 315 2.421 -8.764 -2.559 1.00 0.00 H new ATOM 0 HH12 ARG A 315 3.650 -9.446 -1.489 1.00 0.00 H new ATOM 0 HH21 ARG A 315 1.403 -11.569 0.143 1.00 0.00 H new ATOM 0 HH22 ARG A 315 3.079 -11.022 0.029 1.00 0.00 H new ATOM 461 N LEU A 316 -4.825 -6.431 -2.723 1.00 0.00 N ATOM 462 CA LEU A 316 -5.810 -5.737 -1.860 1.00 0.00 C ATOM 463 C LEU A 316 -6.650 -6.796 -1.147 1.00 0.00 C ATOM 464 O LEU A 316 -7.369 -7.559 -1.762 1.00 0.00 O ATOM 465 CB LEU A 316 -6.701 -4.853 -2.731 1.00 0.00 C ATOM 466 CG LEU A 316 -7.306 -3.724 -1.895 1.00 0.00 C ATOM 467 CD1 LEU A 316 -8.117 -2.805 -2.812 1.00 0.00 C ATOM 468 CD2 LEU A 316 -8.214 -4.314 -0.813 1.00 0.00 C ATOM 0 H LEU A 316 -5.127 -6.598 -3.683 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.307 -5.111 -1.123 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.119 -4.435 -3.552 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.496 -5.452 -3.176 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.511 -3.152 -1.416 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.552 -1.997 -2.224 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.464 -2.386 -3.577 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.913 -3.377 -3.288 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.644 -3.507 -0.219 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -9.015 -4.886 -1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.631 -4.970 -0.166 1.00 0.00 H new ATOM 480 N LEU A 317 -6.553 -6.842 0.146 1.00 0.00 N ATOM 481 CA LEU A 317 -7.333 -7.847 0.937 1.00 0.00 C ATOM 482 C LEU A 317 -8.587 -7.156 1.468 1.00 0.00 C ATOM 483 O LEU A 317 -9.076 -6.257 0.828 1.00 0.00 O ATOM 484 CB LEU A 317 -6.478 -8.372 2.104 1.00 0.00 C ATOM 485 CG LEU A 317 -5.270 -9.174 1.585 1.00 0.00 C ATOM 486 CD1 LEU A 317 -5.742 -10.386 0.762 1.00 0.00 C ATOM 487 CD2 LEU A 317 -4.363 -8.278 0.723 1.00 0.00 C ATOM 0 H LEU A 317 -5.963 -6.223 0.702 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.609 -8.695 0.310 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -6.130 -7.535 2.710 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -7.087 -9.003 2.751 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.702 -9.531 2.444 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -4.876 -10.942 0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -6.355 -11.034 1.388 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -6.330 -10.041 -0.089 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -3.514 -8.859 0.363 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -4.929 -7.898 -0.128 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -4.003 -7.441 1.322 1.00 0.00 H new ATOM 499 N TYR A 318 -9.091 -7.577 2.621 1.00 0.00 N ATOM 500 CA TYR A 318 -10.330 -6.973 3.256 1.00 0.00 C ATOM 501 C TYR A 318 -10.774 -5.687 2.519 1.00 0.00 C ATOM 502 O TYR A 318 -9.939 -4.918 2.113 1.00 0.00 O ATOM 503 CB TYR A 318 -9.993 -6.628 4.723 1.00 0.00 C ATOM 504 CG TYR A 318 -11.196 -6.821 5.619 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.525 -8.098 6.082 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.976 -5.717 5.989 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.638 -8.276 6.914 1.00 0.00 C ATOM 508 CE2 TYR A 318 -13.087 -5.893 6.820 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.419 -7.173 7.283 1.00 0.00 C ATOM 510 OH TYR A 318 -14.515 -7.347 8.104 1.00 0.00 O ATOM 0 H TYR A 318 -8.682 -8.337 3.164 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.148 -7.691 3.196 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -9.174 -7.258 5.069 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.650 -5.595 4.787 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.921 -8.947 5.798 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.719 -4.730 5.632 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.894 -9.263 7.271 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.689 -5.043 7.105 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.945 -6.481 8.263 1.00 0.00 H new ATOM 520 N PRO A 319 -12.065 -5.453 2.347 1.00 0.00 N ATOM 521 CA PRO A 319 -12.591 -4.250 1.641 1.00 0.00 C ATOM 522 C PRO A 319 -11.655 -3.035 1.676 1.00 0.00 C ATOM 523 O PRO A 319 -11.755 -2.150 0.851 1.00 0.00 O ATOM 524 CB PRO A 319 -13.887 -3.985 2.388 1.00 0.00 C ATOM 525 CG PRO A 319 -14.417 -5.357 2.695 1.00 0.00 C ATOM 526 CD PRO A 319 -13.188 -6.292 2.804 1.00 0.00 C ATOM 0 HA PRO A 319 -12.710 -4.423 0.571 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.713 -3.412 3.298 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.588 -3.413 1.780 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.985 -5.354 3.625 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.093 -5.696 1.910 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -13.038 -6.638 3.827 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.304 -7.179 2.181 1.00 0.00 H new ATOM 534 N ALA A 320 -10.728 -2.991 2.595 1.00 0.00 N ATOM 535 CA ALA A 320 -9.777 -1.846 2.635 1.00 0.00 C ATOM 536 C ALA A 320 -8.455 -2.267 3.294 1.00 0.00 C ATOM 537 O ALA A 320 -7.866 -1.499 4.030 1.00 0.00 O ATOM 538 CB ALA A 320 -10.395 -0.698 3.426 1.00 0.00 C ATOM 0 H ALA A 320 -10.589 -3.697 3.318 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.574 -1.524 1.614 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.699 0.140 3.455 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.322 -0.383 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.607 -1.029 4.443 1.00 0.00 H new ATOM 544 N LYS A 321 -7.967 -3.467 3.033 1.00 0.00 N ATOM 545 CA LYS A 321 -6.663 -3.904 3.648 1.00 0.00 C ATOM 546 C LYS A 321 -5.644 -4.151 2.532 1.00 0.00 C ATOM 547 O LYS A 321 -5.894 -4.898 1.607 1.00 0.00 O ATOM 548 CB LYS A 321 -6.889 -5.177 4.465 1.00 0.00 C ATOM 549 CG LYS A 321 -5.550 -5.673 5.018 1.00 0.00 C ATOM 550 CD LYS A 321 -5.774 -6.751 6.104 1.00 0.00 C ATOM 551 CE LYS A 321 -5.891 -8.137 5.462 1.00 0.00 C ATOM 552 NZ LYS A 321 -5.920 -9.174 6.531 1.00 0.00 N ATOM 0 H LYS A 321 -8.412 -4.156 2.426 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.280 -3.129 4.312 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.581 -4.979 5.283 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -7.344 -5.946 3.841 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -4.946 -6.084 4.209 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -4.992 -4.836 5.438 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -4.946 -6.740 6.813 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -6.679 -6.526 6.668 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -6.797 -8.195 4.858 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -5.049 -8.312 4.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -5.999 -10.116 6.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -5.044 -9.122 7.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -6.737 -9.009 7.153 1.00 0.00 H new ATOM 566 N LEU A 322 -4.506 -3.490 2.591 1.00 0.00 N ATOM 567 CA LEU A 322 -3.470 -3.632 1.511 1.00 0.00 C ATOM 568 C LEU A 322 -2.219 -4.337 2.043 1.00 0.00 C ATOM 569 O LEU A 322 -1.549 -3.857 2.936 1.00 0.00 O ATOM 570 CB LEU A 322 -3.136 -2.205 1.027 1.00 0.00 C ATOM 571 CG LEU A 322 -1.997 -2.150 -0.026 1.00 0.00 C ATOM 572 CD1 LEU A 322 -0.609 -2.135 0.644 1.00 0.00 C ATOM 573 CD2 LEU A 322 -2.092 -3.329 -1.001 1.00 0.00 C ATOM 0 H LEU A 322 -4.250 -2.854 3.346 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.846 -4.242 0.690 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -4.034 -1.757 0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.853 -1.597 1.886 1.00 0.00 H new ATOM 0 HG LEU A 322 -2.119 -1.221 -0.583 1.00 0.00 H new ATOM 0 HD11 LEU A 322 0.165 -2.096 -0.123 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -0.525 -1.260 1.288 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -0.483 -3.038 1.241 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -1.282 -3.266 -1.728 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -2.012 -4.265 -0.449 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -3.050 -3.295 -1.521 1.00 0.00 H new ATOM 585 N SER A 323 -1.887 -5.469 1.464 1.00 0.00 N ATOM 586 CA SER A 323 -0.662 -6.229 1.877 1.00 0.00 C ATOM 587 C SER A 323 0.382 -6.138 0.761 1.00 0.00 C ATOM 588 O SER A 323 0.061 -6.200 -0.409 1.00 0.00 O ATOM 589 CB SER A 323 -1.026 -7.698 2.106 1.00 0.00 C ATOM 590 OG SER A 323 -1.032 -8.378 0.858 1.00 0.00 O ATOM 0 H SER A 323 -2.421 -5.904 0.712 1.00 0.00 H new ATOM 0 HA SER A 323 -0.261 -5.805 2.798 1.00 0.00 H new ATOM 0 HB2 SER A 323 -0.308 -8.162 2.783 1.00 0.00 H new ATOM 0 HB3 SER A 323 -2.005 -7.773 2.579 1.00 0.00 H new ATOM 0 HG SER A 323 -1.263 -9.320 1.000 1.00 0.00 H new ATOM 596 N ILE A 324 1.631 -5.990 1.117 1.00 0.00 N ATOM 597 CA ILE A 324 2.709 -5.889 0.088 1.00 0.00 C ATOM 598 C ILE A 324 3.969 -6.604 0.583 1.00 0.00 C ATOM 599 O ILE A 324 4.217 -6.715 1.768 1.00 0.00 O ATOM 600 CB ILE A 324 3.051 -4.423 -0.172 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.143 -3.657 1.163 1.00 0.00 C ATOM 602 CG2 ILE A 324 1.988 -3.791 -1.071 1.00 0.00 C ATOM 603 CD1 ILE A 324 4.154 -2.520 1.024 1.00 0.00 C ATOM 0 H ILE A 324 1.953 -5.934 2.083 1.00 0.00 H new ATOM 0 HA ILE A 324 2.354 -6.353 -0.832 1.00 0.00 H new ATOM 0 HB ILE A 324 4.016 -4.367 -0.675 1.00 0.00 H new ATOM 0 HG12 ILE A 324 2.166 -3.259 1.435 1.00 0.00 H new ATOM 0 HG13 ILE A 324 3.446 -4.333 1.963 1.00 0.00 H new ATOM 0 HG21 ILE A 324 2.239 -2.746 -1.252 1.00 0.00 H new ATOM 0 HG22 ILE A 324 1.951 -4.325 -2.021 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.016 -3.851 -0.582 1.00 0.00 H new ATOM 0 HD11 ILE A 324 4.222 -1.976 1.966 1.00 0.00 H new ATOM 0 HD12 ILE A 324 5.131 -2.931 0.771 1.00 0.00 H new ATOM 0 HD13 ILE A 324 3.831 -1.841 0.235 1.00 0.00 H new ATOM 615 N THR A 325 4.758 -7.094 -0.335 1.00 0.00 N ATOM 616 CA THR A 325 6.015 -7.815 0.032 1.00 0.00 C ATOM 617 C THR A 325 7.225 -6.887 -0.150 1.00 0.00 C ATOM 618 O THR A 325 7.353 -6.210 -1.148 1.00 0.00 O ATOM 619 CB THR A 325 6.164 -9.034 -0.888 1.00 0.00 C ATOM 620 OG1 THR A 325 5.160 -9.985 -0.563 1.00 0.00 O ATOM 621 CG2 THR A 325 7.548 -9.668 -0.706 1.00 0.00 C ATOM 0 H THR A 325 4.584 -7.025 -1.338 1.00 0.00 H new ATOM 0 HA THR A 325 5.967 -8.131 1.074 1.00 0.00 H new ATOM 0 HB THR A 325 6.056 -8.718 -1.926 1.00 0.00 H new ATOM 0 HG1 THR A 325 4.571 -9.616 0.128 1.00 0.00 H new ATOM 0 HG21 THR A 325 7.642 -10.532 -1.364 1.00 0.00 H new ATOM 0 HG22 THR A 325 8.318 -8.938 -0.954 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.669 -9.986 0.330 1.00 0.00 H new ATOM 629 N ILE A 326 8.126 -6.872 0.804 1.00 0.00 N ATOM 630 CA ILE A 326 9.348 -6.012 0.695 1.00 0.00 C ATOM 631 C ILE A 326 10.563 -6.828 1.139 1.00 0.00 C ATOM 632 O ILE A 326 10.577 -7.402 2.208 1.00 0.00 O ATOM 633 CB ILE A 326 9.214 -4.788 1.604 1.00 0.00 C ATOM 634 CG1 ILE A 326 8.076 -3.896 1.100 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.529 -3.995 1.591 1.00 0.00 C ATOM 636 CD1 ILE A 326 7.823 -2.781 2.115 1.00 0.00 C ATOM 0 H ILE A 326 8.066 -7.423 1.660 1.00 0.00 H new ATOM 0 HA ILE A 326 9.465 -5.680 -0.337 1.00 0.00 H new ATOM 0 HB ILE A 326 8.995 -5.115 2.621 1.00 0.00 H new ATOM 0 HG12 ILE A 326 8.334 -3.470 0.131 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.171 -4.487 0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.434 -3.123 2.238 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.339 -4.628 1.952 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.748 -3.670 0.574 1.00 0.00 H new ATOM 0 HD11 ILE A 326 7.013 -2.143 1.760 1.00 0.00 H new ATOM 0 HD12 ILE A 326 7.547 -3.218 3.075 1.00 0.00 H new ATOM 0 HD13 ILE A 326 8.728 -2.186 2.235 1.00 0.00 H new ATOM 648 N ASP A 327 11.584 -6.883 0.326 1.00 0.00 N ATOM 649 CA ASP A 327 12.805 -7.660 0.695 1.00 0.00 C ATOM 650 C ASP A 327 12.410 -9.006 1.305 1.00 0.00 C ATOM 651 O ASP A 327 13.159 -9.607 2.049 1.00 0.00 O ATOM 652 CB ASP A 327 13.629 -6.863 1.708 1.00 0.00 C ATOM 653 CG ASP A 327 14.960 -7.575 1.955 1.00 0.00 C ATOM 654 OD1 ASP A 327 15.453 -8.205 1.035 1.00 0.00 O ATOM 655 OD2 ASP A 327 15.465 -7.477 3.062 1.00 0.00 O ATOM 0 H ASP A 327 11.626 -6.421 -0.582 1.00 0.00 H new ATOM 0 HA ASP A 327 13.397 -7.838 -0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 327 13.808 -5.855 1.335 1.00 0.00 H new ATOM 0 HB3 ASP A 327 13.078 -6.764 2.643 1.00 0.00 H new ATOM 660 N GLY A 328 11.242 -9.485 0.987 1.00 0.00 N ATOM 661 CA GLY A 328 10.791 -10.797 1.537 1.00 0.00 C ATOM 662 C GLY A 328 10.177 -10.608 2.926 1.00 0.00 C ATOM 663 O GLY A 328 10.381 -11.414 3.813 1.00 0.00 O ATOM 0 H GLY A 328 10.575 -9.024 0.367 1.00 0.00 H new ATOM 0 HA2 GLY A 328 10.059 -11.248 0.867 1.00 0.00 H new ATOM 0 HA3 GLY A 328 11.635 -11.484 1.596 1.00 0.00 H new ATOM 667 N GLU A 329 9.418 -9.556 3.122 1.00 0.00 N ATOM 668 CA GLU A 329 8.774 -9.315 4.457 1.00 0.00 C ATOM 669 C GLU A 329 7.295 -8.992 4.242 1.00 0.00 C ATOM 670 O GLU A 329 6.937 -8.167 3.426 1.00 0.00 O ATOM 671 CB GLU A 329 9.477 -8.145 5.169 1.00 0.00 C ATOM 672 CG GLU A 329 10.627 -8.680 6.024 1.00 0.00 C ATOM 673 CD GLU A 329 11.513 -7.517 6.474 1.00 0.00 C ATOM 674 OE1 GLU A 329 10.992 -6.423 6.618 1.00 0.00 O ATOM 675 OE2 GLU A 329 12.696 -7.740 6.666 1.00 0.00 O ATOM 0 H GLU A 329 9.215 -8.851 2.414 1.00 0.00 H new ATOM 0 HA GLU A 329 8.864 -10.205 5.080 1.00 0.00 H new ATOM 0 HB2 GLU A 329 9.857 -7.435 4.435 1.00 0.00 H new ATOM 0 HB3 GLU A 329 8.765 -7.607 5.795 1.00 0.00 H new ATOM 0 HG2 GLU A 329 10.233 -9.208 6.892 1.00 0.00 H new ATOM 0 HG3 GLU A 329 11.215 -9.399 5.453 1.00 0.00 H new ATOM 682 N THR A 330 6.438 -9.654 4.967 1.00 0.00 N ATOM 683 CA THR A 330 4.972 -9.415 4.815 1.00 0.00 C ATOM 684 C THR A 330 4.510 -8.297 5.756 1.00 0.00 C ATOM 685 O THR A 330 4.606 -8.407 6.962 1.00 0.00 O ATOM 686 CB THR A 330 4.216 -10.709 5.141 1.00 0.00 C ATOM 687 OG1 THR A 330 2.837 -10.533 4.847 1.00 0.00 O ATOM 688 CG2 THR A 330 4.380 -11.063 6.625 1.00 0.00 C ATOM 0 H THR A 330 6.690 -10.355 5.663 1.00 0.00 H new ATOM 0 HA THR A 330 4.765 -9.112 3.789 1.00 0.00 H new ATOM 0 HB THR A 330 4.624 -11.520 4.538 1.00 0.00 H new ATOM 0 HG1 THR A 330 2.351 -11.359 5.052 1.00 0.00 H new ATOM 0 HG21 THR A 330 3.838 -11.984 6.842 1.00 0.00 H new ATOM 0 HG22 THR A 330 5.437 -11.203 6.851 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.981 -10.255 7.238 1.00 0.00 H new ATOM 696 N LYS A 331 3.988 -7.227 5.209 1.00 0.00 N ATOM 697 CA LYS A 331 3.486 -6.096 6.053 1.00 0.00 C ATOM 698 C LYS A 331 2.135 -5.655 5.475 1.00 0.00 C ATOM 699 O LYS A 331 1.871 -5.848 4.305 1.00 0.00 O ATOM 700 CB LYS A 331 4.509 -4.930 6.019 1.00 0.00 C ATOM 701 CG LYS A 331 4.812 -4.431 7.443 1.00 0.00 C ATOM 702 CD LYS A 331 3.564 -3.768 8.036 1.00 0.00 C ATOM 703 CE LYS A 331 3.949 -2.971 9.283 1.00 0.00 C ATOM 704 NZ LYS A 331 4.730 -1.767 8.883 1.00 0.00 N ATOM 0 H LYS A 331 3.887 -7.087 4.204 1.00 0.00 H new ATOM 0 HA LYS A 331 3.363 -6.402 7.092 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.431 -5.262 5.541 1.00 0.00 H new ATOM 0 HB3 LYS A 331 4.115 -4.111 5.417 1.00 0.00 H new ATOM 0 HG2 LYS A 331 5.126 -5.264 8.071 1.00 0.00 H new ATOM 0 HG3 LYS A 331 5.638 -3.720 7.421 1.00 0.00 H new ATOM 0 HD2 LYS A 331 3.105 -3.109 7.299 1.00 0.00 H new ATOM 0 HD3 LYS A 331 2.824 -4.526 8.291 1.00 0.00 H new ATOM 0 HE2 LYS A 331 3.053 -2.672 9.827 1.00 0.00 H new ATOM 0 HE3 LYS A 331 4.539 -3.592 9.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 4.661 -1.045 9.628 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 5.727 -2.029 8.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 4.348 -1.385 7.994 1.00 0.00 H new ATOM 718 N VAL A 332 1.270 -5.083 6.276 1.00 0.00 N ATOM 719 CA VAL A 332 -0.065 -4.659 5.751 1.00 0.00 C ATOM 720 C VAL A 332 -0.490 -3.327 6.375 1.00 0.00 C ATOM 721 O VAL A 332 -0.002 -2.926 7.413 1.00 0.00 O ATOM 722 CB VAL A 332 -1.088 -5.744 6.087 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.319 -5.591 5.203 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.468 -7.113 5.824 1.00 0.00 C ATOM 0 H VAL A 332 1.429 -4.892 7.265 1.00 0.00 H new ATOM 0 HA VAL A 332 -0.005 -4.523 4.671 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.376 -5.650 7.134 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -3.043 -6.368 5.449 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.767 -4.612 5.370 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -2.029 -5.684 4.156 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -1.192 -7.892 6.062 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.185 -7.189 4.774 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.417 -7.238 6.448 1.00 0.00 H new ATOM 734 N PHE A 333 -1.396 -2.636 5.727 1.00 0.00 N ATOM 735 CA PHE A 333 -1.868 -1.316 6.240 1.00 0.00 C ATOM 736 C PHE A 333 -3.377 -1.185 6.011 1.00 0.00 C ATOM 737 O PHE A 333 -3.889 -1.552 4.973 1.00 0.00 O ATOM 738 CB PHE A 333 -1.132 -0.213 5.478 1.00 0.00 C ATOM 739 CG PHE A 333 0.330 -0.578 5.391 1.00 0.00 C ATOM 740 CD1 PHE A 333 0.773 -1.477 4.414 1.00 0.00 C ATOM 741 CD2 PHE A 333 1.240 -0.029 6.297 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.129 -1.822 4.346 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.593 -0.376 6.231 1.00 0.00 C ATOM 744 CZ PHE A 333 3.038 -1.272 5.254 1.00 0.00 C ATOM 0 H PHE A 333 -1.832 -2.936 4.855 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.666 -1.232 7.308 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.553 -0.098 4.479 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.253 0.743 5.987 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.070 -1.904 3.714 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.898 0.665 7.050 1.00 0.00 H new ATOM 0 HE1 PHE A 333 2.472 -2.514 3.591 1.00 0.00 H new ATOM 0 HE2 PHE A 333 3.294 0.048 6.935 1.00 0.00 H new ATOM 0 HZ PHE A 333 4.083 -1.539 5.201 1.00 0.00 H new ATOM 754 N HIS A 334 -4.094 -0.667 6.980 1.00 0.00 N ATOM 755 CA HIS A 334 -5.578 -0.509 6.834 1.00 0.00 C ATOM 756 C HIS A 334 -5.909 0.958 6.513 1.00 0.00 C ATOM 757 O HIS A 334 -6.896 1.245 5.865 1.00 0.00 O ATOM 758 CB HIS A 334 -6.262 -0.930 8.155 1.00 0.00 C ATOM 759 CG HIS A 334 -6.653 -2.387 8.094 1.00 0.00 C ATOM 760 ND1 HIS A 334 -7.908 -2.792 7.673 1.00 0.00 N ATOM 761 CD2 HIS A 334 -5.965 -3.541 8.385 1.00 0.00 C ATOM 762 CE1 HIS A 334 -7.939 -4.135 7.721 1.00 0.00 C ATOM 763 NE2 HIS A 334 -6.781 -4.643 8.149 1.00 0.00 N ATOM 0 H HIS A 334 -3.714 -0.345 7.870 1.00 0.00 H new ATOM 0 HA HIS A 334 -5.941 -1.139 6.022 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.586 -0.761 8.994 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -7.145 -0.315 8.329 1.00 0.00 H new ATOM 0 HD1 HIS A 334 -8.671 -2.182 7.380 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -4.947 -3.585 8.742 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -8.797 -4.731 7.447 1.00 0.00 H new ATOM 771 N ASP A 335 -5.090 1.882 6.958 1.00 0.00 N ATOM 772 CA ASP A 335 -5.350 3.336 6.679 1.00 0.00 C ATOM 773 C ASP A 335 -4.253 3.884 5.764 1.00 0.00 C ATOM 774 O ASP A 335 -3.082 3.619 5.955 1.00 0.00 O ATOM 775 CB ASP A 335 -5.344 4.119 7.997 1.00 0.00 C ATOM 776 CG ASP A 335 -4.149 3.686 8.847 1.00 0.00 C ATOM 777 OD1 ASP A 335 -3.962 2.491 9.009 1.00 0.00 O ATOM 778 OD2 ASP A 335 -3.441 4.558 9.322 1.00 0.00 O ATOM 0 H ASP A 335 -4.249 1.694 7.504 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.320 3.443 6.194 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -5.291 5.189 7.796 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -6.272 3.943 8.540 1.00 0.00 H new ATOM 783 N LYS A 336 -4.621 4.651 4.772 1.00 0.00 N ATOM 784 CA LYS A 336 -3.598 5.217 3.849 1.00 0.00 C ATOM 785 C LYS A 336 -2.539 5.964 4.659 1.00 0.00 C ATOM 786 O LYS A 336 -1.424 6.153 4.214 1.00 0.00 O ATOM 787 CB LYS A 336 -4.271 6.185 2.871 1.00 0.00 C ATOM 788 CG LYS A 336 -5.161 7.161 3.642 1.00 0.00 C ATOM 789 CD LYS A 336 -5.850 8.109 2.658 1.00 0.00 C ATOM 790 CE LYS A 336 -6.675 9.142 3.430 1.00 0.00 C ATOM 791 NZ LYS A 336 -5.765 10.169 4.012 1.00 0.00 N ATOM 0 H LYS A 336 -5.585 4.909 4.562 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.125 4.409 3.291 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -3.515 6.733 2.309 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -4.866 5.630 2.146 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -5.907 6.613 4.218 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -4.563 7.730 4.354 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -5.106 8.612 2.040 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.494 7.544 1.984 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -7.398 9.616 2.766 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.242 8.652 4.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -6.327 10.966 4.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -5.219 9.748 4.791 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -5.113 10.511 3.278 1.00 0.00 H new ATOM 805 N THR A 337 -2.874 6.390 5.845 1.00 0.00 N ATOM 806 CA THR A 337 -1.877 7.121 6.676 1.00 0.00 C ATOM 807 C THR A 337 -0.751 6.170 7.075 1.00 0.00 C ATOM 808 O THR A 337 0.406 6.420 6.806 1.00 0.00 O ATOM 809 CB THR A 337 -2.553 7.665 7.936 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.785 8.281 7.586 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.636 8.692 8.605 1.00 0.00 C ATOM 0 H THR A 337 -3.791 6.264 6.273 1.00 0.00 H new ATOM 0 HA THR A 337 -1.468 7.951 6.099 1.00 0.00 H new ATOM 0 HB THR A 337 -2.744 6.845 8.629 1.00 0.00 H new ATOM 0 HG1 THR A 337 -4.218 8.628 8.394 1.00 0.00 H new ATOM 0 HG21 THR A 337 -2.118 9.080 9.503 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.693 8.216 8.876 1.00 0.00 H new ATOM 0 HG23 THR A 337 -1.443 9.512 7.914 1.00 0.00 H new ATOM 819 N LYS A 338 -1.073 5.079 7.712 1.00 0.00 N ATOM 820 CA LYS A 338 -0.012 4.121 8.121 1.00 0.00 C ATOM 821 C LYS A 338 0.880 3.826 6.913 1.00 0.00 C ATOM 822 O LYS A 338 2.090 3.791 7.015 1.00 0.00 O ATOM 823 CB LYS A 338 -0.679 2.831 8.628 1.00 0.00 C ATOM 824 CG LYS A 338 0.202 2.129 9.671 1.00 0.00 C ATOM 825 CD LYS A 338 -0.646 1.111 10.430 1.00 0.00 C ATOM 826 CE LYS A 338 0.251 0.281 11.349 1.00 0.00 C ATOM 827 NZ LYS A 338 1.133 1.190 12.137 1.00 0.00 N ATOM 0 H LYS A 338 -2.024 4.811 7.966 1.00 0.00 H new ATOM 0 HA LYS A 338 0.601 4.541 8.919 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -1.649 3.067 9.066 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -0.862 2.159 7.790 1.00 0.00 H new ATOM 0 HG2 LYS A 338 1.041 1.632 9.183 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.623 2.859 10.362 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -1.410 1.623 11.016 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -1.166 0.460 9.728 1.00 0.00 H new ATOM 0 HE2 LYS A 338 -0.359 -0.324 12.020 1.00 0.00 H new ATOM 0 HE3 LYS A 338 0.855 -0.408 10.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 1.473 0.694 12.986 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 1.946 1.476 11.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 0.596 2.034 12.421 1.00 0.00 H new ATOM 841 N PHE A 339 0.290 3.629 5.768 1.00 0.00 N ATOM 842 CA PHE A 339 1.107 3.357 4.555 1.00 0.00 C ATOM 843 C PHE A 339 1.990 4.572 4.271 1.00 0.00 C ATOM 844 O PHE A 339 3.201 4.498 4.319 1.00 0.00 O ATOM 845 CB PHE A 339 0.190 3.095 3.360 1.00 0.00 C ATOM 846 CG PHE A 339 1.021 2.599 2.203 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.575 3.510 1.300 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.244 1.228 2.042 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.352 3.051 0.232 1.00 0.00 C ATOM 850 CE2 PHE A 339 2.023 0.765 0.975 1.00 0.00 C ATOM 851 CZ PHE A 339 2.579 1.675 0.067 1.00 0.00 C ATOM 0 H PHE A 339 -0.719 3.645 5.620 1.00 0.00 H new ATOM 0 HA PHE A 339 1.730 2.478 4.721 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.569 2.358 3.622 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.336 4.008 3.082 1.00 0.00 H new ATOM 0 HD1 PHE A 339 1.403 4.569 1.427 1.00 0.00 H new ATOM 0 HD2 PHE A 339 0.815 0.526 2.741 1.00 0.00 H new ATOM 0 HE1 PHE A 339 2.778 3.756 -0.467 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.195 -0.294 0.852 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.180 1.320 -0.757 1.00 0.00 H new ATOM 861 N THR A 340 1.397 5.696 3.978 1.00 0.00 N ATOM 862 CA THR A 340 2.214 6.914 3.698 1.00 0.00 C ATOM 863 C THR A 340 3.292 7.074 4.777 1.00 0.00 C ATOM 864 O THR A 340 4.468 7.171 4.484 1.00 0.00 O ATOM 865 CB THR A 340 1.312 8.151 3.699 1.00 0.00 C ATOM 866 OG1 THR A 340 0.211 7.936 2.828 1.00 0.00 O ATOM 867 CG2 THR A 340 2.114 9.363 3.221 1.00 0.00 C ATOM 0 H THR A 340 0.387 5.826 3.920 1.00 0.00 H new ATOM 0 HA THR A 340 2.688 6.808 2.722 1.00 0.00 H new ATOM 0 HB THR A 340 0.943 8.333 4.709 1.00 0.00 H new ATOM 0 HG1 THR A 340 -0.490 7.443 3.303 1.00 0.00 H new ATOM 0 HG21 THR A 340 1.474 10.245 3.221 1.00 0.00 H new ATOM 0 HG22 THR A 340 2.959 9.527 3.890 1.00 0.00 H new ATOM 0 HG23 THR A 340 2.481 9.181 2.211 1.00 0.00 H new ATOM 875 N GLN A 341 2.899 7.098 6.021 1.00 0.00 N ATOM 876 CA GLN A 341 3.896 7.245 7.123 1.00 0.00 C ATOM 877 C GLN A 341 4.924 6.120 7.033 1.00 0.00 C ATOM 878 O GLN A 341 6.110 6.336 7.185 1.00 0.00 O ATOM 879 CB GLN A 341 3.183 7.174 8.475 1.00 0.00 C ATOM 880 CG GLN A 341 2.342 8.435 8.683 1.00 0.00 C ATOM 881 CD GLN A 341 1.647 8.365 10.045 1.00 0.00 C ATOM 882 OE1 GLN A 341 1.430 7.293 10.575 1.00 0.00 O ATOM 883 NE2 GLN A 341 1.288 9.470 10.641 1.00 0.00 N ATOM 0 H GLN A 341 1.928 7.022 6.324 1.00 0.00 H new ATOM 0 HA GLN A 341 4.398 8.208 7.028 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.546 6.290 8.515 1.00 0.00 H new ATOM 0 HB3 GLN A 341 3.914 7.077 9.278 1.00 0.00 H new ATOM 0 HG2 GLN A 341 2.976 9.320 8.631 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.601 8.526 7.889 1.00 0.00 H new ATOM 0 HE21 GLN A 341 1.469 10.371 10.198 1.00 0.00 H new ATOM 0 HE22 GLN A 341 0.826 9.433 11.550 1.00 0.00 H new ATOM 892 N TYR A 342 4.483 4.920 6.786 1.00 0.00 N ATOM 893 CA TYR A 342 5.445 3.790 6.688 1.00 0.00 C ATOM 894 C TYR A 342 6.510 4.131 5.644 1.00 0.00 C ATOM 895 O TYR A 342 7.638 3.688 5.727 1.00 0.00 O ATOM 896 CB TYR A 342 4.707 2.511 6.296 1.00 0.00 C ATOM 897 CG TYR A 342 5.708 1.407 6.055 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.184 0.641 7.125 1.00 0.00 C ATOM 899 CD2 TYR A 342 6.161 1.155 4.758 1.00 0.00 C ATOM 900 CE1 TYR A 342 7.115 -0.380 6.894 1.00 0.00 C ATOM 901 CE2 TYR A 342 7.090 0.134 4.525 1.00 0.00 C ATOM 902 CZ TYR A 342 7.567 -0.632 5.594 1.00 0.00 C ATOM 903 OH TYR A 342 8.482 -1.639 5.365 1.00 0.00 O ATOM 0 H TYR A 342 3.503 4.673 6.648 1.00 0.00 H new ATOM 0 HA TYR A 342 5.925 3.629 7.653 1.00 0.00 H new ATOM 0 HB2 TYR A 342 4.014 2.222 7.086 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.114 2.681 5.398 1.00 0.00 H new ATOM 0 HD1 TYR A 342 5.834 0.837 8.128 1.00 0.00 H new ATOM 0 HD2 TYR A 342 5.794 1.749 3.934 1.00 0.00 H new ATOM 0 HE1 TYR A 342 7.484 -0.972 7.719 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.438 -0.062 3.522 1.00 0.00 H new ATOM 0 HH TYR A 342 8.362 -2.348 6.031 1.00 0.00 H new ATOM 913 N LEU A 343 6.172 4.925 4.663 1.00 0.00 N ATOM 914 CA LEU A 343 7.187 5.304 3.637 1.00 0.00 C ATOM 915 C LEU A 343 8.001 6.489 4.143 1.00 0.00 C ATOM 916 O LEU A 343 9.217 6.498 4.060 1.00 0.00 O ATOM 917 CB LEU A 343 6.503 5.698 2.324 1.00 0.00 C ATOM 918 CG LEU A 343 5.896 4.474 1.615 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.364 4.924 0.257 1.00 0.00 C ATOM 920 CD2 LEU A 343 6.960 3.387 1.387 1.00 0.00 C ATOM 0 H LEU A 343 5.244 5.325 4.528 1.00 0.00 H new ATOM 0 HA LEU A 343 7.837 4.447 3.459 1.00 0.00 H new ATOM 0 HB2 LEU A 343 5.720 6.429 2.526 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.226 6.179 1.666 1.00 0.00 H new ATOM 0 HG LEU A 343 5.102 4.061 2.237 1.00 0.00 H new ATOM 0 HD11 LEU A 343 4.929 4.071 -0.264 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.602 5.690 0.400 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.182 5.333 -0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.506 2.533 0.885 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.763 3.788 0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.367 3.069 2.347 1.00 0.00 H new ATOM 932 N SER A 344 7.351 7.491 4.666 1.00 0.00 N ATOM 933 CA SER A 344 8.104 8.669 5.175 1.00 0.00 C ATOM 934 C SER A 344 9.226 8.171 6.081 1.00 0.00 C ATOM 935 O SER A 344 10.237 8.822 6.255 1.00 0.00 O ATOM 936 CB SER A 344 7.167 9.578 5.971 1.00 0.00 C ATOM 937 OG SER A 344 6.115 10.026 5.125 1.00 0.00 O ATOM 0 H SER A 344 6.337 7.545 4.762 1.00 0.00 H new ATOM 0 HA SER A 344 8.518 9.235 4.341 1.00 0.00 H new ATOM 0 HB2 SER A 344 6.757 9.039 6.825 1.00 0.00 H new ATOM 0 HB3 SER A 344 7.719 10.431 6.367 1.00 0.00 H new ATOM 0 HG SER A 344 5.512 10.608 5.633 1.00 0.00 H new ATOM 943 N THR A 345 9.048 7.003 6.648 1.00 0.00 N ATOM 944 CA THR A 345 10.093 6.421 7.543 1.00 0.00 C ATOM 945 C THR A 345 10.850 5.316 6.794 1.00 0.00 C ATOM 946 O THR A 345 11.690 4.642 7.355 1.00 0.00 O ATOM 947 CB THR A 345 9.426 5.862 8.807 1.00 0.00 C ATOM 948 OG1 THR A 345 10.424 5.508 9.754 1.00 0.00 O ATOM 949 CG2 THR A 345 8.588 4.634 8.466 1.00 0.00 C ATOM 0 H THR A 345 8.217 6.424 6.527 1.00 0.00 H new ATOM 0 HA THR A 345 10.805 7.193 7.836 1.00 0.00 H new ATOM 0 HB THR A 345 8.774 6.627 9.229 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.198 5.129 9.287 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.121 4.249 9.373 1.00 0.00 H new ATOM 0 HG22 THR A 345 7.815 4.909 7.748 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.228 3.865 8.033 1.00 0.00 H new ATOM 957 N ASN A 346 10.572 5.137 5.519 1.00 0.00 N ATOM 958 CA ASN A 346 11.290 4.090 4.720 1.00 0.00 C ATOM 959 C ASN A 346 11.655 4.686 3.357 1.00 0.00 C ATOM 960 O ASN A 346 11.044 4.379 2.352 1.00 0.00 O ATOM 961 CB ASN A 346 10.386 2.866 4.516 1.00 0.00 C ATOM 962 CG ASN A 346 11.231 1.668 4.076 1.00 0.00 C ATOM 963 OD1 ASN A 346 11.907 1.057 4.881 1.00 0.00 O ATOM 964 ND2 ASN A 346 11.221 1.306 2.822 1.00 0.00 N ATOM 0 H ASN A 346 9.877 5.673 4.999 1.00 0.00 H new ATOM 0 HA ASN A 346 12.189 3.776 5.251 1.00 0.00 H new ATOM 0 HB2 ASN A 346 9.860 2.632 5.442 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.627 3.084 3.764 1.00 0.00 H new ATOM 0 HD21 ASN A 346 11.781 0.510 2.517 1.00 0.00 H new ATOM 0 HD22 ASN A 346 10.654 1.819 2.148 1.00 0.00 H new ATOM 971 N PRO A 347 12.646 5.540 3.330 1.00 0.00 N ATOM 972 CA PRO A 347 13.111 6.210 2.078 1.00 0.00 C ATOM 973 C PRO A 347 13.467 5.198 0.982 1.00 0.00 C ATOM 974 O PRO A 347 13.598 5.543 -0.176 1.00 0.00 O ATOM 975 CB PRO A 347 14.356 7.001 2.524 1.00 0.00 C ATOM 976 CG PRO A 347 14.178 7.200 3.994 1.00 0.00 C ATOM 977 CD PRO A 347 13.439 5.961 4.494 1.00 0.00 C ATOM 0 HA PRO A 347 12.338 6.841 1.640 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.272 6.451 2.308 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.426 7.955 2.002 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.141 7.309 4.493 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.607 8.106 4.200 1.00 0.00 H new ATOM 0 HD2 PRO A 347 14.132 5.181 4.811 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.804 6.191 5.350 1.00 0.00 H new ATOM 985 N ALA A 348 13.617 3.952 1.337 1.00 0.00 N ATOM 986 CA ALA A 348 13.958 2.924 0.317 1.00 0.00 C ATOM 987 C ALA A 348 12.829 2.847 -0.711 1.00 0.00 C ATOM 988 O ALA A 348 13.038 3.027 -1.897 1.00 0.00 O ATOM 989 CB ALA A 348 14.124 1.566 0.998 1.00 0.00 C ATOM 0 H ALA A 348 13.518 3.602 2.290 1.00 0.00 H new ATOM 0 HA ALA A 348 14.890 3.193 -0.181 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.374 0.813 0.251 1.00 0.00 H new ATOM 0 HB2 ALA A 348 14.924 1.624 1.736 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.193 1.291 1.493 1.00 0.00 H new ATOM 995 N LEU A 349 11.628 2.596 -0.268 1.00 0.00 N ATOM 996 CA LEU A 349 10.498 2.523 -1.231 1.00 0.00 C ATOM 997 C LEU A 349 10.186 3.945 -1.711 1.00 0.00 C ATOM 998 O LEU A 349 10.031 4.193 -2.890 1.00 0.00 O ATOM 999 CB LEU A 349 9.257 1.922 -0.545 1.00 0.00 C ATOM 1000 CG LEU A 349 9.256 0.389 -0.634 1.00 0.00 C ATOM 1001 CD1 LEU A 349 8.012 -0.146 0.085 1.00 0.00 C ATOM 1002 CD2 LEU A 349 9.246 -0.089 -2.105 1.00 0.00 C ATOM 0 H LEU A 349 11.383 2.440 0.710 1.00 0.00 H new ATOM 0 HA LEU A 349 10.768 1.888 -2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.234 2.227 0.501 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.354 2.316 -1.012 1.00 0.00 H new ATOM 0 HG LEU A 349 10.163 0.011 -0.163 1.00 0.00 H new ATOM 0 HD11 LEU A 349 7.999 -1.234 0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.034 0.163 1.130 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.117 0.252 -0.392 1.00 0.00 H new ATOM 0 HD21 LEU A 349 9.246 -1.179 -2.134 1.00 0.00 H new ATOM 0 HD22 LEU A 349 8.353 0.287 -2.604 1.00 0.00 H new ATOM 0 HD23 LEU A 349 10.133 0.287 -2.616 1.00 0.00 H new ATOM 1014 N GLN A 350 10.092 4.878 -0.796 1.00 0.00 N ATOM 1015 CA GLN A 350 9.789 6.287 -1.174 1.00 0.00 C ATOM 1016 C GLN A 350 10.624 6.689 -2.400 1.00 0.00 C ATOM 1017 O GLN A 350 10.189 7.456 -3.235 1.00 0.00 O ATOM 1018 CB GLN A 350 10.127 7.202 0.023 1.00 0.00 C ATOM 1019 CG GLN A 350 9.114 8.345 0.119 1.00 0.00 C ATOM 1020 CD GLN A 350 9.211 9.216 -1.134 1.00 0.00 C ATOM 1021 OE1 GLN A 350 10.275 9.697 -1.472 1.00 0.00 O ATOM 1022 NE2 GLN A 350 8.141 9.438 -1.846 1.00 0.00 N ATOM 0 H GLN A 350 10.214 4.719 0.204 1.00 0.00 H new ATOM 0 HA GLN A 350 8.733 6.387 -1.427 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.120 6.622 0.946 1.00 0.00 H new ATOM 0 HB3 GLN A 350 11.133 7.607 -0.092 1.00 0.00 H new ATOM 0 HG2 GLN A 350 8.105 7.944 0.220 1.00 0.00 H new ATOM 0 HG3 GLN A 350 9.309 8.945 1.008 1.00 0.00 H new ATOM 0 HE21 GLN A 350 7.248 9.035 -1.563 1.00 0.00 H new ATOM 0 HE22 GLN A 350 8.198 10.015 -2.685 1.00 0.00 H new ATOM 1031 N ARG A 351 11.818 6.178 -2.506 1.00 0.00 N ATOM 1032 CA ARG A 351 12.682 6.528 -3.662 1.00 0.00 C ATOM 1033 C ARG A 351 12.164 5.802 -4.915 1.00 0.00 C ATOM 1034 O ARG A 351 12.150 6.353 -5.998 1.00 0.00 O ATOM 1035 CB ARG A 351 14.135 6.115 -3.325 1.00 0.00 C ATOM 1036 CG ARG A 351 14.872 5.596 -4.566 1.00 0.00 C ATOM 1037 CD ARG A 351 16.371 5.493 -4.278 1.00 0.00 C ATOM 1038 NE ARG A 351 17.007 4.611 -5.295 1.00 0.00 N ATOM 1039 CZ ARG A 351 18.302 4.612 -5.440 1.00 0.00 C ATOM 1040 NH1 ARG A 351 19.039 5.386 -4.692 1.00 0.00 N ATOM 1041 NH2 ARG A 351 18.859 3.842 -6.333 1.00 0.00 N ATOM 0 H ARG A 351 12.233 5.530 -1.837 1.00 0.00 H new ATOM 0 HA ARG A 351 12.660 7.599 -3.861 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.671 6.970 -2.913 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.126 5.343 -2.556 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.480 4.620 -4.850 1.00 0.00 H new ATOM 0 HG3 ARG A 351 14.700 6.266 -5.408 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.827 6.483 -4.302 1.00 0.00 H new ATOM 0 HD3 ARG A 351 16.534 5.091 -3.278 1.00 0.00 H new ATOM 0 HE ARG A 351 16.429 4.006 -5.878 1.00 0.00 H new ATOM 0 HH11 ARG A 351 18.601 5.989 -3.995 1.00 0.00 H new ATOM 0 HH12 ARG A 351 20.053 5.388 -4.804 1.00 0.00 H new ATOM 0 HH21 ARG A 351 18.281 3.239 -6.918 1.00 0.00 H new ATOM 0 HH22 ARG A 351 19.873 3.843 -6.446 1.00 0.00 H new ATOM 1055 N ILE A 352 11.753 4.571 -4.780 1.00 0.00 N ATOM 1056 CA ILE A 352 11.257 3.820 -5.971 1.00 0.00 C ATOM 1057 C ILE A 352 9.818 4.229 -6.299 1.00 0.00 C ATOM 1058 O ILE A 352 9.530 4.682 -7.388 1.00 0.00 O ATOM 1059 CB ILE A 352 11.321 2.320 -5.685 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.751 1.958 -5.269 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.935 1.541 -6.947 1.00 0.00 C ATOM 1062 CD1 ILE A 352 12.832 0.473 -4.918 1.00 0.00 C ATOM 0 H ILE A 352 11.739 4.053 -3.901 1.00 0.00 H new ATOM 0 HA ILE A 352 11.887 4.055 -6.829 1.00 0.00 H new ATOM 0 HB ILE A 352 10.628 2.063 -4.884 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.443 2.187 -6.079 1.00 0.00 H new ATOM 0 HG13 ILE A 352 13.053 2.560 -4.412 1.00 0.00 H new ATOM 0 HG21 ILE A 352 10.981 0.471 -6.743 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.922 1.810 -7.245 1.00 0.00 H new ATOM 0 HG23 ILE A 352 11.628 1.786 -7.752 1.00 0.00 H new ATOM 0 HD11 ILE A 352 13.851 0.224 -4.623 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.153 0.256 -4.093 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.550 -0.122 -5.786 1.00 0.00 H new ATOM 1074 N ILE A 353 8.912 4.071 -5.375 1.00 0.00 N ATOM 1075 CA ILE A 353 7.498 4.450 -5.648 1.00 0.00 C ATOM 1076 C ILE A 353 7.421 5.949 -5.946 1.00 0.00 C ATOM 1077 O ILE A 353 8.085 6.455 -6.829 1.00 0.00 O ATOM 1078 CB ILE A 353 6.646 4.123 -4.415 1.00 0.00 C ATOM 1079 CG1 ILE A 353 7.069 5.030 -3.226 1.00 0.00 C ATOM 1080 CG2 ILE A 353 6.852 2.649 -4.047 1.00 0.00 C ATOM 1081 CD1 ILE A 353 6.118 6.231 -3.087 1.00 0.00 C ATOM 0 H ILE A 353 9.089 3.696 -4.443 1.00 0.00 H new ATOM 0 HA ILE A 353 7.125 3.894 -6.508 1.00 0.00 H new ATOM 0 HB ILE A 353 5.594 4.303 -4.635 1.00 0.00 H new ATOM 0 HG12 ILE A 353 7.067 4.451 -2.303 1.00 0.00 H new ATOM 0 HG13 ILE A 353 8.089 5.384 -3.378 1.00 0.00 H new ATOM 0 HG21 ILE A 353 6.251 2.405 -3.171 1.00 0.00 H new ATOM 0 HG22 ILE A 353 6.547 2.019 -4.883 1.00 0.00 H new ATOM 0 HG23 ILE A 353 7.905 2.473 -3.825 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.435 6.851 -2.248 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.141 6.821 -4.003 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.104 5.873 -2.911 1.00 0.00 H new TER 1093 ILE A 353