USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=16 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 341 GLN : amide:sc= 0 K(o=1.2,f=0.25) USER MOD Set 1.2: A 344 SER OG : rot -63:sc= 1.19 USER MOD Set 2.1: A 310 HIS : no HD1:sc= -6.63! C(o=-14!,f=-19!) USER MOD Set 2.2: A 312 CYS SG : rot -66:sc= -7.18! USER MOD Single : A 290 SER OG : rot 180:sc= 0.0585 USER MOD Single : A 293 THR OG1 : rot 180:sc= -0.562 USER MOD Single : A 294 MET CE :methyl 143:sc= -0.0687 (180deg=-2.04!) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 THR OG1 : rot 59:sc= 0.934 USER MOD Single : A 305 GLN : amide:sc= -2.88! K(o=-2.9!,f=-2.2) USER MOD Single : A 306 THR OG1 : rot 75:sc= 0.158 USER MOD Single : A 311 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 313 GLN : amide:sc= -3.47! C(o=-3.5!,f=-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 170:sc= -1.36 USER MOD Single : A 325 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 HIS : no HD1:sc= -0.067 X(o=-0.067,f=-0.54) USER MOD Single : A 336 LYS NZ :NH3+ -112:sc= -2.27 (180deg=-5.13!) USER MOD Single : A 337 THR OG1 : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 THR OG1 : rot 79:sc= 0.676 USER MOD Single : A 342 TYR OH : rot 180:sc= 0 USER MOD Single : A 345 THR OG1 : rot -29:sc= 0.435 USER MOD Single : A 346 ASN : amide:sc= -7.1! K(o=-7.1!,f=-0.53) USER MOD Single : A 350 GLN : amide:sc= -1.55 K(o=-1.5,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.638 2.854 2.496 1.00 0.00 N ATOM 2 CA PHE A 289 -18.314 2.285 2.117 1.00 0.00 C ATOM 3 C PHE A 289 -17.912 2.846 0.753 1.00 0.00 C ATOM 4 O PHE A 289 -16.770 2.794 0.342 1.00 0.00 O ATOM 5 CB PHE A 289 -18.420 0.749 2.041 1.00 0.00 C ATOM 6 CG PHE A 289 -19.447 0.268 3.044 1.00 0.00 C ATOM 7 CD1 PHE A 289 -19.158 0.310 4.415 1.00 0.00 C ATOM 8 CD2 PHE A 289 -20.687 -0.211 2.605 1.00 0.00 C ATOM 9 CE1 PHE A 289 -20.110 -0.127 5.343 1.00 0.00 C ATOM 10 CE2 PHE A 289 -21.638 -0.650 3.533 1.00 0.00 C ATOM 11 CZ PHE A 289 -21.350 -0.607 4.903 1.00 0.00 C ATOM 0 HA PHE A 289 -17.563 2.553 2.860 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -18.706 0.442 1.035 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -17.451 0.295 2.249 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -18.202 0.679 4.755 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -20.910 -0.242 1.549 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -19.888 -0.094 6.399 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -22.593 -1.022 3.193 1.00 0.00 H new ATOM 0 HZ PHE A 289 -22.084 -0.944 5.620 1.00 0.00 H new ATOM 21 N SER A 290 -18.860 3.365 0.044 1.00 0.00 N ATOM 22 CA SER A 290 -18.569 3.913 -1.305 1.00 0.00 C ATOM 23 C SER A 290 -17.727 5.192 -1.222 1.00 0.00 C ATOM 24 O SER A 290 -16.862 5.416 -2.045 1.00 0.00 O ATOM 25 CB SER A 290 -19.888 4.192 -2.046 1.00 0.00 C ATOM 26 OG SER A 290 -20.893 3.311 -1.561 1.00 0.00 O ATOM 0 H SER A 290 -19.834 3.436 0.339 1.00 0.00 H new ATOM 0 HA SER A 290 -17.991 3.172 -1.857 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.192 5.228 -1.895 1.00 0.00 H new ATOM 0 HB3 SER A 290 -19.753 4.053 -3.119 1.00 0.00 H new ATOM 0 HG SER A 290 -21.736 3.487 -2.029 1.00 0.00 H new ATOM 32 N PRO A 291 -17.981 6.038 -0.264 1.00 0.00 N ATOM 33 CA PRO A 291 -17.244 7.311 -0.118 1.00 0.00 C ATOM 34 C PRO A 291 -15.991 7.201 0.765 1.00 0.00 C ATOM 35 O PRO A 291 -14.926 7.649 0.396 1.00 0.00 O ATOM 36 CB PRO A 291 -18.289 8.227 0.521 1.00 0.00 C ATOM 37 CG PRO A 291 -19.135 7.317 1.368 1.00 0.00 C ATOM 38 CD PRO A 291 -18.989 5.891 0.794 1.00 0.00 C ATOM 0 HA PRO A 291 -16.853 7.667 -1.071 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.818 9.003 1.124 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -18.888 8.732 -0.237 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -18.810 7.348 2.408 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -20.178 7.634 1.350 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.666 5.184 1.558 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.934 5.521 0.397 1.00 0.00 H new ATOM 46 N GLU A 292 -16.120 6.643 1.941 1.00 0.00 N ATOM 47 CA GLU A 292 -14.938 6.551 2.865 1.00 0.00 C ATOM 48 C GLU A 292 -14.124 5.269 2.644 1.00 0.00 C ATOM 49 O GLU A 292 -12.934 5.310 2.386 1.00 0.00 O ATOM 50 CB GLU A 292 -15.422 6.606 4.322 1.00 0.00 C ATOM 51 CG GLU A 292 -16.430 5.479 4.600 1.00 0.00 C ATOM 52 CD GLU A 292 -17.299 5.848 5.808 1.00 0.00 C ATOM 53 OE1 GLU A 292 -16.820 5.710 6.921 1.00 0.00 O ATOM 54 OE2 GLU A 292 -18.426 6.262 5.598 1.00 0.00 O ATOM 0 H GLU A 292 -16.987 6.247 2.305 1.00 0.00 H new ATOM 0 HA GLU A 292 -14.285 7.396 2.648 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -14.571 6.515 4.997 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -15.885 7.573 4.521 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -17.058 5.316 3.724 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -15.902 4.545 4.792 1.00 0.00 H new ATOM 61 N THR A 293 -14.743 4.134 2.771 1.00 0.00 N ATOM 62 CA THR A 293 -14.002 2.852 2.605 1.00 0.00 C ATOM 63 C THR A 293 -13.409 2.758 1.207 1.00 0.00 C ATOM 64 O THR A 293 -12.277 2.355 1.028 1.00 0.00 O ATOM 65 CB THR A 293 -14.969 1.689 2.806 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.684 1.869 4.021 1.00 0.00 O ATOM 67 CG2 THR A 293 -14.211 0.368 2.854 1.00 0.00 C ATOM 0 H THR A 293 -15.736 4.035 2.984 1.00 0.00 H new ATOM 0 HA THR A 293 -13.197 2.812 3.339 1.00 0.00 H new ATOM 0 HB THR A 293 -15.666 1.665 1.968 1.00 0.00 H new ATOM 0 HG1 THR A 293 -16.306 1.122 4.148 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.916 -0.451 2.998 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.673 0.223 1.917 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.501 0.386 3.681 1.00 0.00 H new ATOM 75 N MET A 294 -14.173 3.087 0.210 1.00 0.00 N ATOM 76 CA MET A 294 -13.651 2.972 -1.173 1.00 0.00 C ATOM 77 C MET A 294 -12.415 3.860 -1.335 1.00 0.00 C ATOM 78 O MET A 294 -11.485 3.503 -2.019 1.00 0.00 O ATOM 79 CB MET A 294 -14.747 3.366 -2.177 1.00 0.00 C ATOM 80 CG MET A 294 -14.580 2.557 -3.468 1.00 0.00 C ATOM 81 SD MET A 294 -15.877 3.015 -4.645 1.00 0.00 S ATOM 82 CE MET A 294 -17.115 1.801 -4.122 1.00 0.00 C ATOM 0 H MET A 294 -15.131 3.429 0.291 1.00 0.00 H new ATOM 0 HA MET A 294 -13.361 1.940 -1.369 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.731 3.182 -1.746 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.688 4.432 -2.395 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.598 2.745 -3.902 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.633 1.490 -3.250 1.00 0.00 H new ATOM 0 HE1 MET A 294 -18.108 2.246 -4.179 1.00 0.00 H new ATOM 0 HE2 MET A 294 -17.070 0.930 -4.776 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.913 1.495 -3.095 1.00 0.00 H new ATOM 92 N LYS A 295 -12.380 5.003 -0.702 1.00 0.00 N ATOM 93 CA LYS A 295 -11.171 5.867 -0.832 1.00 0.00 C ATOM 94 C LYS A 295 -9.955 5.042 -0.431 1.00 0.00 C ATOM 95 O LYS A 295 -8.938 5.065 -1.090 1.00 0.00 O ATOM 96 CB LYS A 295 -11.297 7.097 0.074 1.00 0.00 C ATOM 97 CG LYS A 295 -12.159 8.158 -0.615 1.00 0.00 C ATOM 98 CD LYS A 295 -12.558 9.224 0.404 1.00 0.00 C ATOM 99 CE LYS A 295 -13.514 10.225 -0.248 1.00 0.00 C ATOM 100 NZ LYS A 295 -14.115 11.094 0.803 1.00 0.00 N ATOM 0 H LYS A 295 -13.124 5.371 -0.109 1.00 0.00 H new ATOM 0 HA LYS A 295 -11.068 6.215 -1.860 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.744 6.814 1.027 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -10.309 7.503 0.293 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -11.607 8.613 -1.438 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -13.049 7.698 -1.044 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -13.036 8.757 1.265 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -11.671 9.740 0.772 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -12.979 10.834 -0.976 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -14.298 9.696 -0.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -14.765 11.775 0.361 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -14.639 10.506 1.482 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -13.361 11.609 1.301 1.00 0.00 H new ATOM 114 N ALA A 296 -10.055 4.292 0.629 1.00 0.00 N ATOM 115 CA ALA A 296 -8.897 3.451 1.026 1.00 0.00 C ATOM 116 C ALA A 296 -8.612 2.477 -0.117 1.00 0.00 C ATOM 117 O ALA A 296 -7.477 2.183 -0.432 1.00 0.00 O ATOM 118 CB ALA A 296 -9.225 2.674 2.300 1.00 0.00 C ATOM 0 H ALA A 296 -10.877 4.225 1.230 1.00 0.00 H new ATOM 0 HA ALA A 296 -8.026 4.076 1.221 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.369 2.061 2.582 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.451 3.374 3.105 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -10.089 2.033 2.123 1.00 0.00 H new ATOM 124 N ARG A 297 -9.647 1.995 -0.757 1.00 0.00 N ATOM 125 CA ARG A 297 -9.454 1.063 -1.903 1.00 0.00 C ATOM 126 C ARG A 297 -8.880 1.855 -3.075 1.00 0.00 C ATOM 127 O ARG A 297 -8.066 1.371 -3.837 1.00 0.00 O ATOM 128 CB ARG A 297 -10.799 0.468 -2.322 1.00 0.00 C ATOM 129 CG ARG A 297 -11.461 -0.195 -1.121 1.00 0.00 C ATOM 130 CD ARG A 297 -12.705 -0.955 -1.588 1.00 0.00 C ATOM 131 NE ARG A 297 -12.292 -2.016 -2.550 1.00 0.00 N ATOM 132 CZ ARG A 297 -13.134 -2.948 -2.905 1.00 0.00 C ATOM 133 NH1 ARG A 297 -14.358 -2.933 -2.448 1.00 0.00 N ATOM 134 NH2 ARG A 297 -12.756 -3.888 -3.726 1.00 0.00 N ATOM 0 H ARG A 297 -10.619 2.209 -0.533 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.779 0.258 -1.613 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.445 1.250 -2.721 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -10.653 -0.262 -3.118 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -10.763 -0.878 -0.637 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -11.736 0.557 -0.381 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -13.217 -1.399 -0.735 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -13.409 -0.271 -2.062 1.00 0.00 H new ATOM 0 HE ARG A 297 -11.347 -2.014 -2.933 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -14.656 -2.192 -1.813 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -15.015 -3.662 -2.726 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -11.803 -3.894 -4.090 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -13.413 -4.617 -4.004 1.00 0.00 H new ATOM 148 N ARG A 298 -9.310 3.077 -3.215 1.00 0.00 N ATOM 149 CA ARG A 298 -8.816 3.936 -4.320 1.00 0.00 C ATOM 150 C ARG A 298 -7.345 4.258 -4.052 1.00 0.00 C ATOM 151 O ARG A 298 -6.517 4.215 -4.940 1.00 0.00 O ATOM 152 CB ARG A 298 -9.674 5.217 -4.358 1.00 0.00 C ATOM 153 CG ARG A 298 -9.889 5.697 -5.804 1.00 0.00 C ATOM 154 CD ARG A 298 -8.575 6.221 -6.393 1.00 0.00 C ATOM 155 NE ARG A 298 -8.878 7.107 -7.552 1.00 0.00 N ATOM 156 CZ ARG A 298 -7.960 7.904 -8.025 1.00 0.00 C ATOM 157 NH1 ARG A 298 -6.775 7.931 -7.480 1.00 0.00 N ATOM 158 NH2 ARG A 298 -8.229 8.677 -9.043 1.00 0.00 N ATOM 0 H ARG A 298 -9.992 3.521 -2.601 1.00 0.00 H new ATOM 0 HA ARG A 298 -8.894 3.437 -5.286 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.639 5.026 -3.888 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -9.187 6.002 -3.780 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -10.267 4.877 -6.414 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -10.644 6.483 -5.825 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -8.016 6.771 -5.636 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.947 5.389 -6.710 1.00 0.00 H new ATOM 0 HE ARG A 298 -9.805 7.090 -7.977 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -6.566 7.329 -6.684 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -6.057 8.554 -7.850 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -9.156 8.657 -9.467 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -7.512 9.301 -9.413 1.00 0.00 H new ATOM 172 N ALA A 299 -7.012 4.547 -2.825 1.00 0.00 N ATOM 173 CA ALA A 299 -5.592 4.831 -2.494 1.00 0.00 C ATOM 174 C ALA A 299 -4.812 3.532 -2.678 1.00 0.00 C ATOM 175 O ALA A 299 -3.639 3.531 -2.997 1.00 0.00 O ATOM 176 CB ALA A 299 -5.481 5.296 -1.042 1.00 0.00 C ATOM 0 H ALA A 299 -7.661 4.598 -2.040 1.00 0.00 H new ATOM 0 HA ALA A 299 -5.196 5.616 -3.139 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -4.437 5.503 -0.805 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -6.071 6.202 -0.904 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.856 4.515 -0.380 1.00 0.00 H new ATOM 182 N TRP A 300 -5.481 2.423 -2.505 1.00 0.00 N ATOM 183 CA TRP A 300 -4.821 1.107 -2.692 1.00 0.00 C ATOM 184 C TRP A 300 -4.734 0.824 -4.194 1.00 0.00 C ATOM 185 O TRP A 300 -3.982 -0.020 -4.632 1.00 0.00 O ATOM 186 CB TRP A 300 -5.651 0.007 -2.024 1.00 0.00 C ATOM 187 CG TRP A 300 -5.722 0.130 -0.508 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.643 -0.534 0.242 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.900 0.893 0.465 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.433 -0.267 1.574 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.386 0.597 1.771 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.801 1.787 0.378 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.812 1.145 2.916 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.231 2.337 1.538 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.733 2.013 2.800 1.00 0.00 C ATOM 0 H TRP A 300 -6.465 2.377 -2.240 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.827 1.125 -2.244 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.663 0.030 -2.429 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -5.227 -0.963 -2.282 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.420 -1.173 -0.150 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -6.991 -0.665 2.329 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.399 2.047 -0.590 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -5.204 0.896 3.891 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.396 3.017 1.453 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.283 2.437 3.686 1.00 0.00 H new ATOM 206 N THR A 301 -5.487 1.536 -4.989 1.00 0.00 N ATOM 207 CA THR A 301 -5.434 1.315 -6.462 1.00 0.00 C ATOM 208 C THR A 301 -4.216 2.034 -7.047 1.00 0.00 C ATOM 209 O THR A 301 -3.369 1.440 -7.683 1.00 0.00 O ATOM 210 CB THR A 301 -6.688 1.886 -7.111 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.837 1.421 -6.417 1.00 0.00 O ATOM 212 CG2 THR A 301 -6.752 1.447 -8.575 1.00 0.00 C ATOM 0 H THR A 301 -6.136 2.261 -4.682 1.00 0.00 H new ATOM 0 HA THR A 301 -5.366 0.245 -6.656 1.00 0.00 H new ATOM 0 HB THR A 301 -6.658 2.975 -7.064 1.00 0.00 H new ATOM 0 HG1 THR A 301 -7.787 1.698 -5.478 1.00 0.00 H new ATOM 0 HG21 THR A 301 -7.650 1.856 -9.039 1.00 0.00 H new ATOM 0 HG22 THR A 301 -5.872 1.813 -9.103 1.00 0.00 H new ATOM 0 HG23 THR A 301 -6.780 0.359 -8.628 1.00 0.00 H new ATOM 220 N ASP A 302 -4.139 3.323 -6.841 1.00 0.00 N ATOM 221 CA ASP A 302 -2.996 4.112 -7.385 1.00 0.00 C ATOM 222 C ASP A 302 -1.679 3.452 -6.996 1.00 0.00 C ATOM 223 O ASP A 302 -0.789 3.290 -7.808 1.00 0.00 O ATOM 224 CB ASP A 302 -3.035 5.529 -6.809 1.00 0.00 C ATOM 225 CG ASP A 302 -4.219 6.288 -7.406 1.00 0.00 C ATOM 226 OD1 ASP A 302 -5.313 5.750 -7.387 1.00 0.00 O ATOM 227 OD2 ASP A 302 -4.012 7.397 -7.871 1.00 0.00 O ATOM 0 H ASP A 302 -4.824 3.866 -6.315 1.00 0.00 H new ATOM 0 HA ASP A 302 -3.075 4.151 -8.471 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -3.124 5.490 -5.723 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -2.104 6.050 -7.033 1.00 0.00 H new ATOM 232 N VAL A 303 -1.541 3.073 -5.759 1.00 0.00 N ATOM 233 CA VAL A 303 -0.276 2.434 -5.326 1.00 0.00 C ATOM 234 C VAL A 303 -0.190 1.025 -5.918 1.00 0.00 C ATOM 235 O VAL A 303 0.870 0.573 -6.299 1.00 0.00 O ATOM 236 CB VAL A 303 -0.248 2.359 -3.800 1.00 0.00 C ATOM 237 CG1 VAL A 303 -0.342 3.769 -3.208 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.426 1.517 -3.312 1.00 0.00 C ATOM 0 H VAL A 303 -2.249 3.179 -5.032 1.00 0.00 H new ATOM 0 HA VAL A 303 0.574 3.021 -5.675 1.00 0.00 H new ATOM 0 HB VAL A 303 0.687 1.899 -3.478 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -0.322 3.709 -2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 303 0.502 4.366 -3.554 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -1.273 4.237 -3.528 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.408 1.462 -2.224 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.360 1.975 -3.637 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.352 0.512 -3.727 1.00 0.00 H new ATOM 248 N ILE A 304 -1.296 0.325 -6.018 1.00 0.00 N ATOM 249 CA ILE A 304 -1.244 -1.050 -6.606 1.00 0.00 C ATOM 250 C ILE A 304 -0.518 -0.959 -7.953 1.00 0.00 C ATOM 251 O ILE A 304 0.203 -1.853 -8.347 1.00 0.00 O ATOM 252 CB ILE A 304 -2.689 -1.588 -6.775 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.057 -2.488 -5.583 1.00 0.00 C ATOM 254 CG2 ILE A 304 -2.846 -2.399 -8.070 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.566 -2.748 -5.574 1.00 0.00 C ATOM 0 H ILE A 304 -2.219 0.641 -5.722 1.00 0.00 H new ATOM 0 HA ILE A 304 -0.706 -1.740 -5.956 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.354 -0.725 -6.821 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.517 -3.432 -5.648 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -2.755 -2.012 -4.650 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -3.872 -2.759 -8.152 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.614 -1.766 -8.926 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.164 -3.249 -8.052 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -4.820 -3.386 -4.728 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.098 -1.801 -5.487 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -4.855 -3.243 -6.501 1.00 0.00 H new ATOM 267 N GLN A 305 -0.697 0.126 -8.651 1.00 0.00 N ATOM 268 CA GLN A 305 -0.022 0.299 -9.952 1.00 0.00 C ATOM 269 C GLN A 305 1.449 0.629 -9.681 1.00 0.00 C ATOM 270 O GLN A 305 2.322 0.304 -10.455 1.00 0.00 O ATOM 271 CB GLN A 305 -0.726 1.446 -10.687 1.00 0.00 C ATOM 272 CG GLN A 305 0.109 1.948 -11.861 1.00 0.00 C ATOM 273 CD GLN A 305 0.370 0.804 -12.846 1.00 0.00 C ATOM 274 OE1 GLN A 305 -0.181 0.786 -13.929 1.00 0.00 O ATOM 275 NE2 GLN A 305 1.188 -0.157 -12.517 1.00 0.00 N ATOM 0 H GLN A 305 -1.290 0.905 -8.367 1.00 0.00 H new ATOM 0 HA GLN A 305 -0.069 -0.600 -10.567 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -1.697 1.108 -11.047 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -0.911 2.266 -9.993 1.00 0.00 H new ATOM 0 HG2 GLN A 305 -0.411 2.762 -12.366 1.00 0.00 H new ATOM 0 HG3 GLN A 305 1.055 2.350 -11.499 1.00 0.00 H new ATOM 0 HE21 GLN A 305 1.651 -0.144 -11.608 1.00 0.00 H new ATOM 0 HE22 GLN A 305 1.364 -0.922 -13.168 1.00 0.00 H new ATOM 284 N THR A 306 1.723 1.271 -8.577 1.00 0.00 N ATOM 285 CA THR A 306 3.131 1.627 -8.238 1.00 0.00 C ATOM 286 C THR A 306 3.850 0.407 -7.650 1.00 0.00 C ATOM 287 O THR A 306 4.957 0.085 -8.034 1.00 0.00 O ATOM 288 CB THR A 306 3.127 2.760 -7.204 1.00 0.00 C ATOM 289 OG1 THR A 306 2.296 3.815 -7.667 1.00 0.00 O ATOM 290 CG2 THR A 306 4.550 3.285 -6.998 1.00 0.00 C ATOM 0 H THR A 306 1.028 1.566 -7.892 1.00 0.00 H new ATOM 0 HA THR A 306 3.650 1.949 -9.141 1.00 0.00 H new ATOM 0 HB THR A 306 2.747 2.380 -6.256 1.00 0.00 H new ATOM 0 HG1 THR A 306 1.356 3.556 -7.574 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.538 4.089 -6.262 1.00 0.00 H new ATOM 0 HG22 THR A 306 5.188 2.476 -6.641 1.00 0.00 H new ATOM 0 HG23 THR A 306 4.938 3.664 -7.943 1.00 0.00 H new ATOM 298 N LEU A 307 3.240 -0.268 -6.712 1.00 0.00 N ATOM 299 CA LEU A 307 3.904 -1.454 -6.093 1.00 0.00 C ATOM 300 C LEU A 307 4.348 -2.425 -7.195 1.00 0.00 C ATOM 301 O LEU A 307 5.522 -2.651 -7.409 1.00 0.00 O ATOM 302 CB LEU A 307 2.901 -2.194 -5.172 1.00 0.00 C ATOM 303 CG LEU A 307 2.819 -1.587 -3.751 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.212 -1.473 -3.101 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.155 -0.209 -3.807 1.00 0.00 C ATOM 0 H LEU A 307 2.312 -0.050 -6.348 1.00 0.00 H new ATOM 0 HA LEU A 307 4.764 -1.115 -5.516 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.912 -2.169 -5.629 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.191 -3.242 -5.097 1.00 0.00 H new ATOM 0 HG LEU A 307 2.217 -2.257 -3.137 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.114 -1.043 -2.104 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.661 -2.464 -3.026 1.00 0.00 H new ATOM 0 HD13 LEU A 307 4.847 -0.832 -3.712 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.102 0.210 -2.802 1.00 0.00 H new ATOM 0 HD22 LEU A 307 2.741 0.452 -4.445 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.148 -0.306 -4.213 1.00 0.00 H new ATOM 317 N ARG A 308 3.405 -3.019 -7.871 1.00 0.00 N ATOM 318 CA ARG A 308 3.742 -4.003 -8.936 1.00 0.00 C ATOM 319 C ARG A 308 4.654 -3.372 -9.990 1.00 0.00 C ATOM 320 O ARG A 308 5.099 -4.037 -10.904 1.00 0.00 O ATOM 321 CB ARG A 308 2.452 -4.499 -9.597 1.00 0.00 C ATOM 322 CG ARG A 308 2.750 -5.727 -10.469 1.00 0.00 C ATOM 323 CD ARG A 308 1.444 -6.460 -10.783 1.00 0.00 C ATOM 324 NE ARG A 308 1.676 -7.444 -11.876 1.00 0.00 N ATOM 325 CZ ARG A 308 0.806 -8.392 -12.094 1.00 0.00 C ATOM 326 NH1 ARG A 308 -0.252 -8.492 -11.338 1.00 0.00 N ATOM 327 NH2 ARG A 308 0.998 -9.243 -13.065 1.00 0.00 N ATOM 0 H ARG A 308 2.407 -2.863 -7.730 1.00 0.00 H new ATOM 0 HA ARG A 308 4.270 -4.842 -8.483 1.00 0.00 H new ATOM 0 HB2 ARG A 308 1.717 -4.754 -8.834 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.017 -3.706 -10.206 1.00 0.00 H new ATOM 0 HG2 ARG A 308 3.238 -5.420 -11.394 1.00 0.00 H new ATOM 0 HG3 ARG A 308 3.439 -6.395 -9.952 1.00 0.00 H new ATOM 0 HD2 ARG A 308 1.078 -6.970 -9.892 1.00 0.00 H new ATOM 0 HD3 ARG A 308 0.676 -5.746 -11.080 1.00 0.00 H new ATOM 0 HE ARG A 308 2.514 -7.377 -12.454 1.00 0.00 H new ATOM 0 HH11 ARG A 308 -0.399 -7.829 -10.577 1.00 0.00 H new ATOM 0 HH12 ARG A 308 -0.932 -9.233 -11.508 1.00 0.00 H new ATOM 0 HH21 ARG A 308 1.828 -9.167 -13.653 1.00 0.00 H new ATOM 0 HH22 ARG A 308 0.318 -9.984 -13.236 1.00 0.00 H new ATOM 341 N GLU A 309 4.943 -2.100 -9.888 1.00 0.00 N ATOM 342 CA GLU A 309 5.829 -1.474 -10.912 1.00 0.00 C ATOM 343 C GLU A 309 7.287 -1.821 -10.579 1.00 0.00 C ATOM 344 O GLU A 309 8.165 -1.693 -11.409 1.00 0.00 O ATOM 345 CB GLU A 309 5.589 0.065 -10.936 1.00 0.00 C ATOM 346 CG GLU A 309 6.697 0.849 -10.206 1.00 0.00 C ATOM 347 CD GLU A 309 7.956 0.908 -11.078 1.00 0.00 C ATOM 348 OE1 GLU A 309 7.858 0.593 -12.253 1.00 0.00 O ATOM 349 OE2 GLU A 309 8.998 1.267 -10.554 1.00 0.00 O ATOM 0 H GLU A 309 4.610 -1.477 -9.152 1.00 0.00 H new ATOM 0 HA GLU A 309 5.603 -1.858 -11.907 1.00 0.00 H new ATOM 0 HB2 GLU A 309 5.531 0.404 -11.970 1.00 0.00 H new ATOM 0 HB3 GLU A 309 4.627 0.286 -10.473 1.00 0.00 H new ATOM 0 HG2 GLU A 309 6.352 1.858 -9.981 1.00 0.00 H new ATOM 0 HG3 GLU A 309 6.926 0.371 -9.254 1.00 0.00 H new ATOM 356 N HIS A 310 7.544 -2.277 -9.371 1.00 0.00 N ATOM 357 CA HIS A 310 8.941 -2.657 -8.981 1.00 0.00 C ATOM 358 C HIS A 310 8.927 -4.032 -8.294 1.00 0.00 C ATOM 359 O HIS A 310 8.101 -4.872 -8.592 1.00 0.00 O ATOM 360 CB HIS A 310 9.544 -1.560 -8.076 1.00 0.00 C ATOM 361 CG HIS A 310 9.211 -1.776 -6.622 1.00 0.00 C ATOM 362 ND1 HIS A 310 10.124 -2.329 -5.738 1.00 0.00 N ATOM 363 CD2 HIS A 310 8.102 -1.468 -5.873 1.00 0.00 C ATOM 364 CE1 HIS A 310 9.559 -2.333 -4.519 1.00 0.00 C ATOM 365 NE2 HIS A 310 8.324 -1.821 -4.544 1.00 0.00 N ATOM 0 H HIS A 310 6.844 -2.402 -8.639 1.00 0.00 H new ATOM 0 HA HIS A 310 9.572 -2.736 -9.866 1.00 0.00 H new ATOM 0 HB2 HIS A 310 10.627 -1.543 -8.201 1.00 0.00 H new ATOM 0 HB3 HIS A 310 9.172 -0.585 -8.392 1.00 0.00 H new ATOM 0 HD2 HIS A 310 7.197 -1.021 -6.256 1.00 0.00 H new ATOM 0 HE1 HIS A 310 10.043 -2.704 -3.628 1.00 0.00 H new ATOM 0 HE2 HIS A 310 7.682 -1.712 -3.759 1.00 0.00 H new ATOM 373 N LYS A 311 9.846 -4.282 -7.400 1.00 0.00 N ATOM 374 CA LYS A 311 9.895 -5.618 -6.725 1.00 0.00 C ATOM 375 C LYS A 311 8.955 -5.675 -5.518 1.00 0.00 C ATOM 376 O LYS A 311 9.391 -5.796 -4.391 1.00 0.00 O ATOM 377 CB LYS A 311 11.329 -5.899 -6.269 1.00 0.00 C ATOM 378 CG LYS A 311 12.264 -5.868 -7.485 1.00 0.00 C ATOM 379 CD LYS A 311 13.608 -6.526 -7.136 1.00 0.00 C ATOM 380 CE LYS A 311 13.425 -8.032 -6.868 1.00 0.00 C ATOM 381 NZ LYS A 311 14.629 -8.765 -7.350 1.00 0.00 N ATOM 0 H LYS A 311 10.566 -3.622 -7.106 1.00 0.00 H new ATOM 0 HA LYS A 311 9.569 -6.373 -7.440 1.00 0.00 H new ATOM 0 HB2 LYS A 311 11.642 -5.155 -5.536 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.383 -6.871 -5.779 1.00 0.00 H new ATOM 0 HG2 LYS A 311 11.801 -6.390 -8.322 1.00 0.00 H new ATOM 0 HG3 LYS A 311 12.426 -4.838 -7.802 1.00 0.00 H new ATOM 0 HD2 LYS A 311 14.313 -6.380 -7.955 1.00 0.00 H new ATOM 0 HD3 LYS A 311 14.037 -6.045 -6.257 1.00 0.00 H new ATOM 0 HE2 LYS A 311 13.279 -8.209 -5.802 1.00 0.00 H new ATOM 0 HE3 LYS A 311 12.533 -8.398 -7.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 14.510 -9.783 -7.171 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 14.748 -8.604 -8.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 15.470 -8.421 -6.845 1.00 0.00 H new ATOM 395 N CYS A 312 7.671 -5.630 -5.747 1.00 0.00 N ATOM 396 CA CYS A 312 6.710 -5.723 -4.609 1.00 0.00 C ATOM 397 C CYS A 312 5.337 -6.146 -5.135 1.00 0.00 C ATOM 398 O CYS A 312 4.605 -5.354 -5.689 1.00 0.00 O ATOM 399 CB CYS A 312 6.583 -4.379 -3.895 1.00 0.00 C ATOM 400 SG CYS A 312 7.991 -4.145 -2.787 1.00 0.00 S ATOM 0 H CYS A 312 7.246 -5.533 -6.669 1.00 0.00 H new ATOM 0 HA CYS A 312 7.084 -6.462 -3.900 1.00 0.00 H new ATOM 0 HB2 CYS A 312 6.544 -3.570 -4.625 1.00 0.00 H new ATOM 0 HB3 CYS A 312 5.652 -4.343 -3.329 1.00 0.00 H new ATOM 0 HG CYS A 312 7.945 -5.029 -1.835 1.00 0.00 H new ATOM 406 N GLN A 313 4.991 -7.388 -4.955 1.00 0.00 N ATOM 407 CA GLN A 313 3.665 -7.887 -5.432 1.00 0.00 C ATOM 408 C GLN A 313 2.549 -7.362 -4.502 1.00 0.00 C ATOM 409 O GLN A 313 2.507 -7.728 -3.345 1.00 0.00 O ATOM 410 CB GLN A 313 3.670 -9.416 -5.385 1.00 0.00 C ATOM 411 CG GLN A 313 4.659 -9.954 -6.423 1.00 0.00 C ATOM 412 CD GLN A 313 6.086 -9.583 -6.013 1.00 0.00 C ATOM 413 OE1 GLN A 313 6.784 -8.909 -6.745 1.00 0.00 O ATOM 414 NE2 GLN A 313 6.552 -9.994 -4.866 1.00 0.00 N ATOM 0 H GLN A 313 5.572 -8.088 -4.494 1.00 0.00 H new ATOM 0 HA GLN A 313 3.486 -7.539 -6.449 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.949 -9.759 -4.389 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.670 -9.800 -5.586 1.00 0.00 H new ATOM 0 HG2 GLN A 313 4.563 -11.037 -6.504 1.00 0.00 H new ATOM 0 HG3 GLN A 313 4.433 -9.539 -7.405 1.00 0.00 H new ATOM 0 HE21 GLN A 313 5.967 -10.560 -4.251 1.00 0.00 H new ATOM 0 HE22 GLN A 313 7.501 -9.750 -4.584 1.00 0.00 H new ATOM 423 N PRO A 314 1.651 -6.510 -4.973 1.00 0.00 N ATOM 424 CA PRO A 314 0.552 -5.961 -4.127 1.00 0.00 C ATOM 425 C PRO A 314 -0.744 -6.781 -4.199 1.00 0.00 C ATOM 426 O PRO A 314 -1.101 -7.315 -5.230 1.00 0.00 O ATOM 427 CB PRO A 314 0.333 -4.592 -4.747 1.00 0.00 C ATOM 428 CG PRO A 314 0.507 -4.833 -6.215 1.00 0.00 C ATOM 429 CD PRO A 314 1.562 -5.952 -6.344 1.00 0.00 C ATOM 0 HA PRO A 314 0.812 -5.960 -3.069 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.660 -4.204 -4.520 1.00 0.00 H new ATOM 0 HB3 PRO A 314 1.053 -3.864 -4.373 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.435 -5.131 -6.675 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.837 -3.926 -6.722 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.256 -6.709 -7.066 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.522 -5.561 -6.680 1.00 0.00 H new ATOM 437 N ARG A 315 -1.455 -6.863 -3.105 1.00 0.00 N ATOM 438 CA ARG A 315 -2.744 -7.623 -3.072 1.00 0.00 C ATOM 439 C ARG A 315 -3.693 -6.904 -2.099 1.00 0.00 C ATOM 440 O ARG A 315 -3.359 -6.688 -0.951 1.00 0.00 O ATOM 441 CB ARG A 315 -2.508 -9.087 -2.598 1.00 0.00 C ATOM 442 CG ARG A 315 -1.012 -9.450 -2.639 1.00 0.00 C ATOM 443 CD ARG A 315 -0.219 -8.663 -1.568 1.00 0.00 C ATOM 444 NE ARG A 315 0.251 -9.616 -0.521 1.00 0.00 N ATOM 445 CZ ARG A 315 1.192 -9.264 0.312 1.00 0.00 C ATOM 446 NH1 ARG A 315 1.739 -8.084 0.218 1.00 0.00 N ATOM 447 NH2 ARG A 315 1.587 -10.094 1.239 1.00 0.00 N ATOM 0 H ARG A 315 -1.195 -6.430 -2.219 1.00 0.00 H new ATOM 0 HA ARG A 315 -3.176 -7.661 -4.072 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -2.887 -9.209 -1.583 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -3.069 -9.773 -3.233 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -0.890 -10.520 -2.473 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -0.609 -9.232 -3.628 1.00 0.00 H new ATOM 0 HD2 ARG A 315 0.630 -8.155 -2.025 1.00 0.00 H new ATOM 0 HD3 ARG A 315 -0.849 -7.893 -1.122 1.00 0.00 H new ATOM 0 HE ARG A 315 -0.164 -10.545 -0.456 1.00 0.00 H new ATOM 0 HH11 ARG A 315 1.431 -7.436 -0.507 1.00 0.00 H new ATOM 0 HH12 ARG A 315 2.474 -7.809 0.869 1.00 0.00 H new ATOM 0 HH21 ARG A 315 1.160 -11.018 1.312 1.00 0.00 H new ATOM 0 HH22 ARG A 315 2.322 -9.819 1.890 1.00 0.00 H new ATOM 461 N LEU A 316 -4.868 -6.524 -2.537 1.00 0.00 N ATOM 462 CA LEU A 316 -5.807 -5.823 -1.626 1.00 0.00 C ATOM 463 C LEU A 316 -6.617 -6.853 -0.833 1.00 0.00 C ATOM 464 O LEU A 316 -7.310 -7.682 -1.387 1.00 0.00 O ATOM 465 CB LEU A 316 -6.747 -4.944 -2.463 1.00 0.00 C ATOM 466 CG LEU A 316 -7.186 -3.713 -1.665 1.00 0.00 C ATOM 467 CD1 LEU A 316 -8.022 -2.802 -2.565 1.00 0.00 C ATOM 468 CD2 LEU A 316 -8.022 -4.154 -0.465 1.00 0.00 C ATOM 0 H LEU A 316 -5.212 -6.672 -3.486 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.252 -5.198 -0.926 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.243 -4.631 -3.377 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.622 -5.521 -2.763 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.308 -3.172 -1.312 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.337 -1.924 -2.002 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.424 -2.489 -3.421 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.901 -3.343 -2.915 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.334 -3.277 0.103 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -8.903 -4.693 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.426 -4.806 0.173 1.00 0.00 H new ATOM 480 N LEU A 317 -6.535 -6.784 0.463 1.00 0.00 N ATOM 481 CA LEU A 317 -7.299 -7.730 1.337 1.00 0.00 C ATOM 482 C LEU A 317 -8.527 -6.984 1.863 1.00 0.00 C ATOM 483 O LEU A 317 -8.942 -6.034 1.249 1.00 0.00 O ATOM 484 CB LEU A 317 -6.417 -8.176 2.516 1.00 0.00 C ATOM 485 CG LEU A 317 -5.257 -9.071 2.037 1.00 0.00 C ATOM 486 CD1 LEU A 317 -5.794 -10.314 1.305 1.00 0.00 C ATOM 487 CD2 LEU A 317 -4.323 -8.279 1.107 1.00 0.00 C ATOM 0 H LEU A 317 -5.965 -6.105 0.967 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.599 -8.615 0.775 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -6.017 -7.300 3.026 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -7.023 -8.719 3.242 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.695 -9.399 2.912 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -4.958 -10.932 0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -6.426 -10.890 1.981 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -6.378 -10.002 0.439 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -3.508 -8.923 0.776 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -4.884 -7.929 0.240 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -3.914 -7.423 1.645 1.00 0.00 H new ATOM 499 N TYR A 318 -9.081 -7.420 2.990 1.00 0.00 N ATOM 500 CA TYR A 318 -10.297 -6.773 3.635 1.00 0.00 C ATOM 501 C TYR A 318 -10.756 -5.500 2.880 1.00 0.00 C ATOM 502 O TYR A 318 -9.933 -4.752 2.416 1.00 0.00 O ATOM 503 CB TYR A 318 -9.906 -6.396 5.079 1.00 0.00 C ATOM 504 CG TYR A 318 -11.096 -6.495 6.007 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.514 -7.746 6.474 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.777 -5.336 6.398 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.615 -7.838 7.334 1.00 0.00 C ATOM 508 CE2 TYR A 318 -12.878 -5.428 7.258 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.297 -6.680 7.727 1.00 0.00 C ATOM 510 OH TYR A 318 -14.381 -6.769 8.576 1.00 0.00 O ATOM 0 H TYR A 318 -8.727 -8.225 3.506 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.129 -7.477 3.608 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -9.112 -7.056 5.428 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.509 -5.381 5.099 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.988 -8.639 6.171 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.453 -4.371 6.036 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.939 -8.803 7.695 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.404 -4.534 7.560 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.736 -5.872 8.748 1.00 0.00 H new ATOM 520 N PRO A 319 -12.055 -5.249 2.765 1.00 0.00 N ATOM 521 CA PRO A 319 -12.598 -4.056 2.054 1.00 0.00 C ATOM 522 C PRO A 319 -11.640 -2.862 2.001 1.00 0.00 C ATOM 523 O PRO A 319 -11.723 -2.039 1.113 1.00 0.00 O ATOM 524 CB PRO A 319 -13.847 -3.743 2.862 1.00 0.00 C ATOM 525 CG PRO A 319 -14.387 -5.096 3.225 1.00 0.00 C ATOM 526 CD PRO A 319 -13.171 -6.052 3.302 1.00 0.00 C ATOM 0 HA PRO A 319 -12.780 -4.257 0.998 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.613 -3.155 3.749 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.567 -3.168 2.279 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.913 -5.060 4.179 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.104 -5.440 2.479 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.977 -6.371 4.326 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.334 -6.954 2.713 1.00 0.00 H new ATOM 534 N ALA A 320 -10.711 -2.773 2.909 1.00 0.00 N ATOM 535 CA ALA A 320 -9.732 -1.653 2.861 1.00 0.00 C ATOM 536 C ALA A 320 -8.448 -2.040 3.599 1.00 0.00 C ATOM 537 O ALA A 320 -7.958 -1.297 4.425 1.00 0.00 O ATOM 538 CB ALA A 320 -10.327 -0.404 3.497 1.00 0.00 C ATOM 0 H ALA A 320 -10.587 -3.427 3.682 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.497 -1.446 1.817 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.600 0.407 3.455 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.227 -0.113 2.955 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.580 -0.611 4.537 1.00 0.00 H new ATOM 544 N LYS A 321 -7.880 -3.185 3.287 1.00 0.00 N ATOM 545 CA LYS A 321 -6.599 -3.603 3.950 1.00 0.00 C ATOM 546 C LYS A 321 -5.617 -3.994 2.854 1.00 0.00 C ATOM 547 O LYS A 321 -5.867 -4.899 2.083 1.00 0.00 O ATOM 548 CB LYS A 321 -6.843 -4.788 4.884 1.00 0.00 C ATOM 549 CG LYS A 321 -5.503 -5.246 5.469 1.00 0.00 C ATOM 550 CD LYS A 321 -5.729 -6.240 6.622 1.00 0.00 C ATOM 551 CE LYS A 321 -5.958 -7.647 6.060 1.00 0.00 C ATOM 552 NZ LYS A 321 -6.261 -8.584 7.178 1.00 0.00 N ATOM 0 H LYS A 321 -8.248 -3.847 2.603 1.00 0.00 H new ATOM 0 HA LYS A 321 -6.199 -2.784 4.548 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.525 -4.502 5.685 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -7.315 -5.606 4.339 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -4.901 -5.714 4.690 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -4.943 -4.383 5.830 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -4.866 -6.241 7.288 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -6.589 -5.932 7.216 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -6.782 -7.636 5.347 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -5.073 -7.983 5.519 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -6.417 -9.539 6.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -5.461 -8.602 7.842 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -7.117 -8.266 7.675 1.00 0.00 H new ATOM 566 N LEU A 322 -4.514 -3.288 2.751 1.00 0.00 N ATOM 567 CA LEU A 322 -3.525 -3.583 1.667 1.00 0.00 C ATOM 568 C LEU A 322 -2.293 -4.288 2.230 1.00 0.00 C ATOM 569 O LEU A 322 -1.716 -3.869 3.213 1.00 0.00 O ATOM 570 CB LEU A 322 -3.105 -2.245 1.023 1.00 0.00 C ATOM 571 CG LEU A 322 -2.781 -2.414 -0.474 1.00 0.00 C ATOM 572 CD1 LEU A 322 -2.097 -1.141 -0.977 1.00 0.00 C ATOM 573 CD2 LEU A 322 -1.841 -3.609 -0.703 1.00 0.00 C ATOM 0 H LEU A 322 -4.257 -2.520 3.372 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.982 -4.242 0.928 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -3.906 -1.516 1.143 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.233 -1.848 1.542 1.00 0.00 H new ATOM 0 HG LEU A 322 -3.710 -2.594 -1.015 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -1.862 -1.248 -2.036 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -2.764 -0.290 -0.837 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -1.177 -0.977 -0.416 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -1.628 -3.706 -1.768 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -0.910 -3.449 -0.160 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -2.318 -4.521 -0.344 1.00 0.00 H new ATOM 585 N SER A 323 -1.869 -5.335 1.570 1.00 0.00 N ATOM 586 CA SER A 323 -0.649 -6.079 1.999 1.00 0.00 C ATOM 587 C SER A 323 0.423 -5.887 0.930 1.00 0.00 C ATOM 588 O SER A 323 0.147 -5.957 -0.252 1.00 0.00 O ATOM 589 CB SER A 323 -0.971 -7.564 2.145 1.00 0.00 C ATOM 590 OG SER A 323 0.128 -8.223 2.759 1.00 0.00 O ATOM 0 H SER A 323 -2.325 -5.711 0.739 1.00 0.00 H new ATOM 0 HA SER A 323 -0.298 -5.704 2.960 1.00 0.00 H new ATOM 0 HB2 SER A 323 -1.871 -7.696 2.746 1.00 0.00 H new ATOM 0 HB3 SER A 323 -1.173 -8.002 1.168 1.00 0.00 H new ATOM 0 HG SER A 323 -0.132 -9.136 3.001 1.00 0.00 H new ATOM 596 N ILE A 324 1.640 -5.629 1.333 1.00 0.00 N ATOM 597 CA ILE A 324 2.741 -5.409 0.346 1.00 0.00 C ATOM 598 C ILE A 324 3.969 -6.235 0.743 1.00 0.00 C ATOM 599 O ILE A 324 4.319 -6.343 1.901 1.00 0.00 O ATOM 600 CB ILE A 324 3.104 -3.912 0.318 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.325 -3.362 1.762 1.00 0.00 C ATOM 602 CG2 ILE A 324 1.971 -3.127 -0.363 1.00 0.00 C ATOM 603 CD1 ILE A 324 4.822 -3.304 2.087 1.00 0.00 C ATOM 0 H ILE A 324 1.921 -5.561 2.311 1.00 0.00 H new ATOM 0 HA ILE A 324 2.411 -5.723 -0.644 1.00 0.00 H new ATOM 0 HB ILE A 324 4.032 -3.791 -0.241 1.00 0.00 H new ATOM 0 HG12 ILE A 324 2.888 -2.367 1.850 1.00 0.00 H new ATOM 0 HG13 ILE A 324 2.814 -4.000 2.483 1.00 0.00 H new ATOM 0 HG21 ILE A 324 2.225 -2.067 -0.385 1.00 0.00 H new ATOM 0 HG22 ILE A 324 1.839 -3.489 -1.383 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.045 -3.267 0.195 1.00 0.00 H new ATOM 0 HD11 ILE A 324 4.960 -2.918 3.097 1.00 0.00 H new ATOM 0 HD12 ILE A 324 5.248 -4.305 2.019 1.00 0.00 H new ATOM 0 HD13 ILE A 324 5.323 -2.647 1.376 1.00 0.00 H new ATOM 615 N THR A 325 4.611 -6.840 -0.227 1.00 0.00 N ATOM 616 CA THR A 325 5.812 -7.687 0.050 1.00 0.00 C ATOM 617 C THR A 325 7.095 -6.891 -0.224 1.00 0.00 C ATOM 618 O THR A 325 7.159 -6.101 -1.142 1.00 0.00 O ATOM 619 CB THR A 325 5.770 -8.915 -0.873 1.00 0.00 C ATOM 620 OG1 THR A 325 4.688 -9.752 -0.492 1.00 0.00 O ATOM 621 CG2 THR A 325 7.083 -9.697 -0.762 1.00 0.00 C ATOM 0 H THR A 325 4.350 -6.782 -1.211 1.00 0.00 H new ATOM 0 HA THR A 325 5.806 -7.997 1.095 1.00 0.00 H new ATOM 0 HB THR A 325 5.636 -8.586 -1.903 1.00 0.00 H new ATOM 0 HG1 THR A 325 4.658 -10.535 -1.080 1.00 0.00 H new ATOM 0 HG21 THR A 325 7.046 -10.566 -1.419 1.00 0.00 H new ATOM 0 HG22 THR A 325 7.914 -9.056 -1.055 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.224 -10.026 0.267 1.00 0.00 H new ATOM 629 N ILE A 326 8.126 -7.114 0.556 1.00 0.00 N ATOM 630 CA ILE A 326 9.421 -6.394 0.336 1.00 0.00 C ATOM 631 C ILE A 326 10.577 -7.364 0.592 1.00 0.00 C ATOM 632 O ILE A 326 10.836 -7.746 1.716 1.00 0.00 O ATOM 633 CB ILE A 326 9.543 -5.218 1.304 1.00 0.00 C ATOM 634 CG1 ILE A 326 8.246 -4.417 1.306 1.00 0.00 C ATOM 635 CG2 ILE A 326 10.695 -4.314 0.865 1.00 0.00 C ATOM 636 CD1 ILE A 326 8.375 -3.254 2.290 1.00 0.00 C ATOM 0 H ILE A 326 8.126 -7.767 1.339 1.00 0.00 H new ATOM 0 HA ILE A 326 9.453 -6.021 -0.688 1.00 0.00 H new ATOM 0 HB ILE A 326 9.736 -5.597 2.308 1.00 0.00 H new ATOM 0 HG12 ILE A 326 8.036 -4.040 0.305 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.410 -5.057 1.588 1.00 0.00 H new ATOM 0 HG21 ILE A 326 10.782 -3.475 1.555 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.625 -4.883 0.866 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.500 -3.939 -0.140 1.00 0.00 H new ATOM 0 HD11 ILE A 326 7.450 -2.678 2.295 1.00 0.00 H new ATOM 0 HD12 ILE A 326 8.566 -3.643 3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 326 9.201 -2.611 1.987 1.00 0.00 H new ATOM 648 N ASP A 327 11.271 -7.764 -0.440 1.00 0.00 N ATOM 649 CA ASP A 327 12.413 -8.713 -0.267 1.00 0.00 C ATOM 650 C ASP A 327 12.035 -9.824 0.719 1.00 0.00 C ATOM 651 O ASP A 327 12.883 -10.391 1.381 1.00 0.00 O ATOM 652 CB ASP A 327 13.635 -7.956 0.261 1.00 0.00 C ATOM 653 CG ASP A 327 14.889 -8.811 0.067 1.00 0.00 C ATOM 654 OD1 ASP A 327 15.121 -9.683 0.889 1.00 0.00 O ATOM 655 OD2 ASP A 327 15.597 -8.580 -0.900 1.00 0.00 O ATOM 0 H ASP A 327 11.096 -7.473 -1.402 1.00 0.00 H new ATOM 0 HA ASP A 327 12.648 -9.161 -1.233 1.00 0.00 H new ATOM 0 HB2 ASP A 327 13.744 -7.008 -0.265 1.00 0.00 H new ATOM 0 HB3 ASP A 327 13.502 -7.721 1.317 1.00 0.00 H new ATOM 660 N GLY A 328 10.769 -10.143 0.811 1.00 0.00 N ATOM 661 CA GLY A 328 10.315 -11.229 1.742 1.00 0.00 C ATOM 662 C GLY A 328 9.563 -10.634 2.938 1.00 0.00 C ATOM 663 O GLY A 328 8.565 -11.170 3.377 1.00 0.00 O ATOM 0 H GLY A 328 10.022 -9.696 0.279 1.00 0.00 H new ATOM 0 HA2 GLY A 328 9.668 -11.926 1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 328 11.176 -11.798 2.093 1.00 0.00 H new ATOM 667 N GLU A 329 10.035 -9.544 3.481 1.00 0.00 N ATOM 668 CA GLU A 329 9.338 -8.944 4.659 1.00 0.00 C ATOM 669 C GLU A 329 7.906 -8.554 4.262 1.00 0.00 C ATOM 670 O GLU A 329 7.686 -7.650 3.483 1.00 0.00 O ATOM 671 CB GLU A 329 10.122 -7.704 5.149 1.00 0.00 C ATOM 672 CG GLU A 329 10.706 -7.959 6.546 1.00 0.00 C ATOM 673 CD GLU A 329 11.529 -6.747 6.990 1.00 0.00 C ATOM 674 OE1 GLU A 329 12.507 -6.445 6.326 1.00 0.00 O ATOM 675 OE2 GLU A 329 11.167 -6.142 7.985 1.00 0.00 O ATOM 0 H GLU A 329 10.866 -9.045 3.164 1.00 0.00 H new ATOM 0 HA GLU A 329 9.292 -9.671 5.470 1.00 0.00 H new ATOM 0 HB2 GLU A 329 10.925 -7.473 4.449 1.00 0.00 H new ATOM 0 HB3 GLU A 329 9.463 -6.836 5.176 1.00 0.00 H new ATOM 0 HG2 GLU A 329 9.902 -8.146 7.258 1.00 0.00 H new ATOM 0 HG3 GLU A 329 11.333 -8.851 6.532 1.00 0.00 H new ATOM 682 N THR A 330 6.941 -9.238 4.807 1.00 0.00 N ATOM 683 CA THR A 330 5.513 -8.931 4.489 1.00 0.00 C ATOM 684 C THR A 330 4.958 -7.929 5.506 1.00 0.00 C ATOM 685 O THR A 330 5.154 -8.072 6.697 1.00 0.00 O ATOM 686 CB THR A 330 4.695 -10.223 4.550 1.00 0.00 C ATOM 687 OG1 THR A 330 5.217 -11.155 3.615 1.00 0.00 O ATOM 688 CG2 THR A 330 3.233 -9.924 4.211 1.00 0.00 C ATOM 0 H THR A 330 7.078 -10.005 5.466 1.00 0.00 H new ATOM 0 HA THR A 330 5.449 -8.500 3.490 1.00 0.00 H new ATOM 0 HB THR A 330 4.753 -10.641 5.555 1.00 0.00 H new ATOM 0 HG1 THR A 330 4.696 -11.984 3.654 1.00 0.00 H new ATOM 0 HG21 THR A 330 2.653 -10.846 4.255 1.00 0.00 H new ATOM 0 HG22 THR A 330 2.832 -9.208 4.929 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.171 -9.504 3.207 1.00 0.00 H new ATOM 696 N LYS A 331 4.250 -6.924 5.049 1.00 0.00 N ATOM 697 CA LYS A 331 3.662 -5.918 5.989 1.00 0.00 C ATOM 698 C LYS A 331 2.260 -5.559 5.486 1.00 0.00 C ATOM 699 O LYS A 331 1.925 -5.802 4.344 1.00 0.00 O ATOM 700 CB LYS A 331 4.572 -4.663 6.035 1.00 0.00 C ATOM 701 CG LYS A 331 5.027 -4.374 7.476 1.00 0.00 C ATOM 702 CD LYS A 331 3.842 -3.876 8.313 1.00 0.00 C ATOM 703 CE LYS A 331 4.363 -3.247 9.607 1.00 0.00 C ATOM 704 NZ LYS A 331 3.211 -2.795 10.438 1.00 0.00 N ATOM 0 H LYS A 331 4.054 -6.757 4.062 1.00 0.00 H new ATOM 0 HA LYS A 331 3.592 -6.323 6.999 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.443 -4.815 5.397 1.00 0.00 H new ATOM 0 HB3 LYS A 331 4.033 -3.802 5.639 1.00 0.00 H new ATOM 0 HG2 LYS A 331 5.443 -5.277 7.922 1.00 0.00 H new ATOM 0 HG3 LYS A 331 5.820 -3.626 7.472 1.00 0.00 H new ATOM 0 HD2 LYS A 331 3.264 -3.145 7.747 1.00 0.00 H new ATOM 0 HD3 LYS A 331 3.171 -4.704 8.542 1.00 0.00 H new ATOM 0 HE2 LYS A 331 4.963 -3.970 10.160 1.00 0.00 H new ATOM 0 HE3 LYS A 331 5.013 -2.403 9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 3.564 -2.367 11.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 2.656 -2.092 9.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 2.607 -3.610 10.667 1.00 0.00 H new ATOM 718 N VAL A 332 1.433 -4.989 6.326 1.00 0.00 N ATOM 719 CA VAL A 332 0.052 -4.629 5.880 1.00 0.00 C ATOM 720 C VAL A 332 -0.404 -3.336 6.554 1.00 0.00 C ATOM 721 O VAL A 332 0.008 -3.011 7.651 1.00 0.00 O ATOM 722 CB VAL A 332 -0.905 -5.768 6.239 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.217 -5.591 5.479 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.286 -7.107 5.838 1.00 0.00 C ATOM 0 H VAL A 332 1.652 -4.758 7.295 1.00 0.00 H new ATOM 0 HA VAL A 332 0.052 -4.475 4.801 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.089 -5.751 7.313 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -2.898 -6.403 5.735 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.670 -4.638 5.752 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -2.021 -5.606 4.407 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -0.970 -7.916 6.095 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.102 -7.115 4.764 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.656 -7.246 6.369 1.00 0.00 H new ATOM 734 N PHE A 333 -1.257 -2.591 5.893 1.00 0.00 N ATOM 735 CA PHE A 333 -1.757 -1.307 6.472 1.00 0.00 C ATOM 736 C PHE A 333 -3.245 -1.145 6.146 1.00 0.00 C ATOM 737 O PHE A 333 -3.702 -1.524 5.086 1.00 0.00 O ATOM 738 CB PHE A 333 -0.953 -0.151 5.877 1.00 0.00 C ATOM 739 CG PHE A 333 0.517 -0.496 5.937 1.00 0.00 C ATOM 740 CD1 PHE A 333 1.098 -1.263 4.920 1.00 0.00 C ATOM 741 CD2 PHE A 333 1.297 -0.056 7.014 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.458 -1.588 4.978 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.659 -0.383 7.072 1.00 0.00 C ATOM 744 CZ PHE A 333 3.238 -1.148 6.054 1.00 0.00 C ATOM 0 H PHE A 333 -1.630 -2.820 4.972 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.636 -1.310 7.555 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.257 0.028 4.845 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.148 0.768 6.430 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.496 -1.604 4.090 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.849 0.535 7.799 1.00 0.00 H new ATOM 0 HE1 PHE A 333 2.906 -2.178 4.192 1.00 0.00 H new ATOM 0 HE2 PHE A 333 3.261 -0.044 7.902 1.00 0.00 H new ATOM 0 HZ PHE A 333 4.287 -1.399 6.098 1.00 0.00 H new ATOM 754 N HIS A 334 -4.007 -0.598 7.064 1.00 0.00 N ATOM 755 CA HIS A 334 -5.480 -0.424 6.838 1.00 0.00 C ATOM 756 C HIS A 334 -5.793 1.038 6.475 1.00 0.00 C ATOM 757 O HIS A 334 -6.824 1.328 5.903 1.00 0.00 O ATOM 758 CB HIS A 334 -6.229 -0.821 8.136 1.00 0.00 C ATOM 759 CG HIS A 334 -7.488 -1.594 7.814 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.600 -0.999 7.238 1.00 0.00 N ATOM 761 CD2 HIS A 334 -7.817 -2.917 7.982 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.535 -1.955 7.081 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.110 -3.142 7.519 1.00 0.00 N ATOM 0 H HIS A 334 -3.670 -0.262 7.966 1.00 0.00 H new ATOM 0 HA HIS A 334 -5.804 -1.058 6.013 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.577 -1.425 8.767 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.482 0.074 8.704 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -7.170 -3.669 8.409 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.511 -1.782 6.652 1.00 0.00 H new ATOM 0 HE2 HIS A 334 -9.622 -4.024 7.515 1.00 0.00 H new ATOM 771 N ASP A 335 -4.922 1.958 6.821 1.00 0.00 N ATOM 772 CA ASP A 335 -5.174 3.409 6.516 1.00 0.00 C ATOM 773 C ASP A 335 -4.063 3.961 5.620 1.00 0.00 C ATOM 774 O ASP A 335 -2.918 3.567 5.716 1.00 0.00 O ATOM 775 CB ASP A 335 -5.201 4.191 7.830 1.00 0.00 C ATOM 776 CG ASP A 335 -6.223 3.558 8.777 1.00 0.00 C ATOM 777 OD1 ASP A 335 -7.361 3.392 8.366 1.00 0.00 O ATOM 778 OD2 ASP A 335 -5.851 3.247 9.896 1.00 0.00 O ATOM 0 H ASP A 335 -4.044 1.768 7.303 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.127 3.510 5.997 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -4.212 4.187 8.289 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -5.460 5.233 7.641 1.00 0.00 H new ATOM 783 N LYS A 336 -4.397 4.876 4.744 1.00 0.00 N ATOM 784 CA LYS A 336 -3.366 5.459 3.835 1.00 0.00 C ATOM 785 C LYS A 336 -2.314 6.203 4.656 1.00 0.00 C ATOM 786 O LYS A 336 -1.155 6.250 4.298 1.00 0.00 O ATOM 787 CB LYS A 336 -4.029 6.434 2.860 1.00 0.00 C ATOM 788 CG LYS A 336 -4.685 7.576 3.637 1.00 0.00 C ATOM 789 CD LYS A 336 -5.599 8.374 2.698 1.00 0.00 C ATOM 790 CE LYS A 336 -4.766 9.029 1.589 1.00 0.00 C ATOM 791 NZ LYS A 336 -4.500 8.033 0.513 1.00 0.00 N ATOM 0 H LYS A 336 -5.340 5.244 4.620 1.00 0.00 H new ATOM 0 HA LYS A 336 -2.888 4.654 3.277 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -3.287 6.832 2.168 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -4.776 5.913 2.261 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -5.262 7.178 4.472 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -3.921 8.229 4.060 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -6.349 7.715 2.260 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.135 9.138 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -5.297 9.889 1.180 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -3.826 9.400 1.997 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -3.486 7.800 0.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -5.051 7.170 0.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -4.777 8.433 -0.406 1.00 0.00 H new ATOM 805 N THR A 337 -2.704 6.784 5.757 1.00 0.00 N ATOM 806 CA THR A 337 -1.712 7.517 6.590 1.00 0.00 C ATOM 807 C THR A 337 -0.696 6.526 7.144 1.00 0.00 C ATOM 808 O THR A 337 0.496 6.725 7.046 1.00 0.00 O ATOM 809 CB THR A 337 -2.423 8.212 7.753 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.288 9.217 7.246 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.382 8.847 8.678 1.00 0.00 C ATOM 0 H THR A 337 -3.660 6.783 6.113 1.00 0.00 H new ATOM 0 HA THR A 337 -1.208 8.265 5.978 1.00 0.00 H new ATOM 0 HB THR A 337 -3.008 7.482 8.313 1.00 0.00 H new ATOM 0 HG1 THR A 337 -3.745 9.661 7.990 1.00 0.00 H new ATOM 0 HG21 THR A 337 -1.886 9.343 9.507 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.720 8.073 9.066 1.00 0.00 H new ATOM 0 HG23 THR A 337 -0.797 9.578 8.120 1.00 0.00 H new ATOM 819 N LYS A 338 -1.158 5.458 7.729 1.00 0.00 N ATOM 820 CA LYS A 338 -0.216 4.457 8.289 1.00 0.00 C ATOM 821 C LYS A 338 0.741 4.012 7.177 1.00 0.00 C ATOM 822 O LYS A 338 1.939 3.935 7.368 1.00 0.00 O ATOM 823 CB LYS A 338 -1.032 3.267 8.825 1.00 0.00 C ATOM 824 CG LYS A 338 -0.323 2.602 10.019 1.00 0.00 C ATOM 825 CD LYS A 338 -1.336 1.764 10.801 1.00 0.00 C ATOM 826 CE LYS A 338 -0.656 1.158 12.032 1.00 0.00 C ATOM 827 NZ LYS A 338 -1.564 0.155 12.657 1.00 0.00 N ATOM 0 H LYS A 338 -2.147 5.237 7.843 1.00 0.00 H new ATOM 0 HA LYS A 338 0.370 4.878 9.106 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -2.021 3.608 9.130 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.178 2.535 8.031 1.00 0.00 H new ATOM 0 HG2 LYS A 338 0.494 1.972 9.667 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.116 3.362 10.666 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -2.179 2.384 11.106 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -1.736 0.973 10.167 1.00 0.00 H new ATOM 0 HE2 LYS A 338 0.284 0.685 11.746 1.00 0.00 H new ATOM 0 HE3 LYS A 338 -0.413 1.942 12.750 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 -1.103 -0.257 13.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 -2.449 0.619 12.943 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -1.774 -0.598 11.971 1.00 0.00 H new ATOM 841 N PHE A 339 0.221 3.737 6.011 1.00 0.00 N ATOM 842 CA PHE A 339 1.102 3.321 4.885 1.00 0.00 C ATOM 843 C PHE A 339 2.066 4.466 4.569 1.00 0.00 C ATOM 844 O PHE A 339 3.269 4.317 4.637 1.00 0.00 O ATOM 845 CB PHE A 339 0.255 3.008 3.648 1.00 0.00 C ATOM 846 CG PHE A 339 1.160 2.641 2.494 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.708 1.355 2.411 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.454 3.587 1.506 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.547 1.016 1.343 1.00 0.00 C ATOM 850 CE2 PHE A 339 2.293 3.251 0.437 1.00 0.00 C ATOM 851 CZ PHE A 339 2.841 1.964 0.355 1.00 0.00 C ATOM 0 H PHE A 339 -0.774 3.783 5.791 1.00 0.00 H new ATOM 0 HA PHE A 339 1.660 2.428 5.165 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.430 2.187 3.862 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.355 3.872 3.384 1.00 0.00 H new ATOM 0 HD1 PHE A 339 1.483 0.623 3.173 1.00 0.00 H new ATOM 0 HD2 PHE A 339 1.032 4.579 1.568 1.00 0.00 H new ATOM 0 HE1 PHE A 339 2.968 0.023 1.281 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.518 3.983 -0.324 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.489 1.704 -0.469 1.00 0.00 H new ATOM 861 N THR A 340 1.549 5.618 4.234 1.00 0.00 N ATOM 862 CA THR A 340 2.444 6.774 3.928 1.00 0.00 C ATOM 863 C THR A 340 3.484 6.909 5.044 1.00 0.00 C ATOM 864 O THR A 340 4.659 7.095 4.796 1.00 0.00 O ATOM 865 CB THR A 340 1.612 8.055 3.838 1.00 0.00 C ATOM 866 OG1 THR A 340 0.652 7.921 2.799 1.00 0.00 O ATOM 867 CG2 THR A 340 2.526 9.245 3.539 1.00 0.00 C ATOM 0 H THR A 340 0.550 5.809 4.159 1.00 0.00 H new ATOM 0 HA THR A 340 2.949 6.609 2.976 1.00 0.00 H new ATOM 0 HB THR A 340 1.103 8.223 4.787 1.00 0.00 H new ATOM 0 HG1 THR A 340 -0.104 7.386 3.119 1.00 0.00 H new ATOM 0 HG21 THR A 340 1.929 10.155 3.476 1.00 0.00 H new ATOM 0 HG22 THR A 340 3.262 9.348 4.337 1.00 0.00 H new ATOM 0 HG23 THR A 340 3.039 9.081 2.591 1.00 0.00 H new ATOM 875 N GLN A 341 3.056 6.796 6.270 1.00 0.00 N ATOM 876 CA GLN A 341 4.008 6.896 7.413 1.00 0.00 C ATOM 877 C GLN A 341 5.061 5.804 7.267 1.00 0.00 C ATOM 878 O GLN A 341 6.243 6.047 7.392 1.00 0.00 O ATOM 879 CB GLN A 341 3.242 6.696 8.728 1.00 0.00 C ATOM 880 CG GLN A 341 2.311 7.901 8.999 1.00 0.00 C ATOM 881 CD GLN A 341 3.008 8.916 9.913 1.00 0.00 C ATOM 882 OE1 GLN A 341 4.068 9.415 9.590 1.00 0.00 O ATOM 883 NE2 GLN A 341 2.454 9.241 11.049 1.00 0.00 N ATOM 0 H GLN A 341 2.083 6.638 6.532 1.00 0.00 H new ATOM 0 HA GLN A 341 4.487 7.875 7.419 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.655 5.779 8.678 1.00 0.00 H new ATOM 0 HB3 GLN A 341 3.946 6.580 9.552 1.00 0.00 H new ATOM 0 HG2 GLN A 341 2.037 8.377 8.057 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.386 7.558 9.463 1.00 0.00 H new ATOM 0 HE21 GLN A 341 1.564 8.823 11.321 1.00 0.00 H new ATOM 0 HE22 GLN A 341 2.911 9.913 11.665 1.00 0.00 H new ATOM 892 N TYR A 342 4.638 4.601 6.991 1.00 0.00 N ATOM 893 CA TYR A 342 5.620 3.491 6.824 1.00 0.00 C ATOM 894 C TYR A 342 6.693 3.927 5.826 1.00 0.00 C ATOM 895 O TYR A 342 7.847 3.563 5.939 1.00 0.00 O ATOM 896 CB TYR A 342 4.908 2.239 6.307 1.00 0.00 C ATOM 897 CG TYR A 342 5.908 1.121 6.156 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.187 0.274 7.234 1.00 0.00 C ATOM 899 CD2 TYR A 342 6.555 0.934 4.932 1.00 0.00 C ATOM 900 CE1 TYR A 342 7.117 -0.763 7.085 1.00 0.00 C ATOM 901 CE2 TYR A 342 7.484 -0.101 4.781 1.00 0.00 C ATOM 902 CZ TYR A 342 7.766 -0.950 5.858 1.00 0.00 C ATOM 903 OH TYR A 342 8.682 -1.971 5.707 1.00 0.00 O ATOM 0 H TYR A 342 3.659 4.339 6.874 1.00 0.00 H new ATOM 0 HA TYR A 342 6.081 3.260 7.784 1.00 0.00 H new ATOM 0 HB2 TYR A 342 4.118 1.945 6.998 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.432 2.448 5.349 1.00 0.00 H new ATOM 0 HD1 TYR A 342 5.686 0.419 8.180 1.00 0.00 H new ATOM 0 HD2 TYR A 342 6.338 1.589 4.101 1.00 0.00 H new ATOM 0 HE1 TYR A 342 7.333 -1.418 7.916 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.983 -0.245 3.834 1.00 0.00 H new ATOM 0 HH TYR A 342 9.037 -1.959 4.794 1.00 0.00 H new ATOM 913 N LEU A 343 6.325 4.713 4.849 1.00 0.00 N ATOM 914 CA LEU A 343 7.331 5.185 3.854 1.00 0.00 C ATOM 915 C LEU A 343 8.048 6.411 4.403 1.00 0.00 C ATOM 916 O LEU A 343 9.257 6.534 4.301 1.00 0.00 O ATOM 917 CB LEU A 343 6.641 5.537 2.533 1.00 0.00 C ATOM 918 CG LEU A 343 6.158 4.264 1.817 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.523 4.665 0.492 1.00 0.00 C ATOM 920 CD2 LEU A 343 7.339 3.318 1.533 1.00 0.00 C ATOM 0 H LEU A 343 5.373 5.048 4.697 1.00 0.00 H new ATOM 0 HA LEU A 343 8.054 4.390 3.672 1.00 0.00 H new ATOM 0 HB2 LEU A 343 5.794 6.197 2.723 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.332 6.082 1.890 1.00 0.00 H new ATOM 0 HG LEU A 343 5.439 3.749 2.454 1.00 0.00 H new ATOM 0 HD11 LEU A 343 5.175 3.773 -0.029 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.679 5.329 0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.260 5.180 -0.124 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.975 2.424 1.026 1.00 0.00 H new ATOM 0 HD22 LEU A 343 8.066 3.824 0.898 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.813 3.035 2.473 1.00 0.00 H new ATOM 932 N SER A 344 7.326 7.316 5.003 1.00 0.00 N ATOM 933 CA SER A 344 7.984 8.521 5.572 1.00 0.00 C ATOM 934 C SER A 344 9.162 8.065 6.431 1.00 0.00 C ATOM 935 O SER A 344 10.130 8.777 6.608 1.00 0.00 O ATOM 936 CB SER A 344 6.988 9.289 6.442 1.00 0.00 C ATOM 937 OG SER A 344 6.920 8.680 7.726 1.00 0.00 O ATOM 0 H SER A 344 6.314 7.273 5.123 1.00 0.00 H new ATOM 0 HA SER A 344 8.330 9.172 4.769 1.00 0.00 H new ATOM 0 HB2 SER A 344 7.297 10.330 6.536 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.003 9.290 5.974 1.00 0.00 H new ATOM 0 HG SER A 344 6.585 7.764 7.636 1.00 0.00 H new ATOM 943 N THR A 345 9.079 6.869 6.961 1.00 0.00 N ATOM 944 CA THR A 345 10.182 6.329 7.813 1.00 0.00 C ATOM 945 C THR A 345 11.016 5.319 7.010 1.00 0.00 C ATOM 946 O THR A 345 11.972 4.764 7.515 1.00 0.00 O ATOM 947 CB THR A 345 9.586 5.668 9.063 1.00 0.00 C ATOM 948 OG1 THR A 345 10.634 5.314 9.954 1.00 0.00 O ATOM 949 CG2 THR A 345 8.797 4.417 8.680 1.00 0.00 C ATOM 0 H THR A 345 8.286 6.239 6.838 1.00 0.00 H new ATOM 0 HA THR A 345 10.836 7.144 8.125 1.00 0.00 H new ATOM 0 HB THR A 345 8.911 6.373 9.548 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.448 5.124 9.443 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.381 3.960 9.578 1.00 0.00 H new ATOM 0 HG22 THR A 345 7.987 4.690 8.003 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.459 3.707 8.185 1.00 0.00 H new ATOM 957 N ASN A 346 10.674 5.083 5.756 1.00 0.00 N ATOM 958 CA ASN A 346 11.466 4.116 4.919 1.00 0.00 C ATOM 959 C ASN A 346 11.722 4.742 3.542 1.00 0.00 C ATOM 960 O ASN A 346 11.081 4.401 2.568 1.00 0.00 O ATOM 961 CB ASN A 346 10.690 2.800 4.742 1.00 0.00 C ATOM 962 CG ASN A 346 11.388 1.925 3.698 1.00 0.00 C ATOM 963 OD1 ASN A 346 12.296 1.184 4.017 1.00 0.00 O ATOM 964 ND2 ASN A 346 10.997 1.983 2.454 1.00 0.00 N ATOM 0 H ASN A 346 9.883 5.518 5.280 1.00 0.00 H new ATOM 0 HA ASN A 346 12.411 3.902 5.418 1.00 0.00 H new ATOM 0 HB2 ASN A 346 10.631 2.271 5.693 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.667 3.009 4.430 1.00 0.00 H new ATOM 0 HD21 ASN A 346 11.454 1.406 1.748 1.00 0.00 H new ATOM 0 HD22 ASN A 346 10.234 2.606 2.188 1.00 0.00 H new ATOM 971 N PRO A 347 12.660 5.650 3.466 1.00 0.00 N ATOM 972 CA PRO A 347 13.023 6.339 2.189 1.00 0.00 C ATOM 973 C PRO A 347 13.446 5.344 1.099 1.00 0.00 C ATOM 974 O PRO A 347 13.466 5.664 -0.073 1.00 0.00 O ATOM 975 CB PRO A 347 14.202 7.252 2.586 1.00 0.00 C ATOM 976 CG PRO A 347 14.072 7.431 4.064 1.00 0.00 C ATOM 977 CD PRO A 347 13.481 6.126 4.589 1.00 0.00 C ATOM 0 HA PRO A 347 12.181 6.886 1.765 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.158 6.798 2.326 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.152 8.209 2.067 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.041 7.633 4.520 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.426 8.276 4.300 1.00 0.00 H new ATOM 0 HD2 PRO A 347 14.259 5.409 4.851 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.882 6.288 5.485 1.00 0.00 H new ATOM 985 N ALA A 348 13.790 4.142 1.478 1.00 0.00 N ATOM 986 CA ALA A 348 14.216 3.133 0.467 1.00 0.00 C ATOM 987 C ALA A 348 13.099 2.926 -0.558 1.00 0.00 C ATOM 988 O ALA A 348 13.299 3.075 -1.752 1.00 0.00 O ATOM 989 CB ALA A 348 14.522 1.808 1.167 1.00 0.00 C ATOM 0 H ALA A 348 13.794 3.816 2.444 1.00 0.00 H new ATOM 0 HA ALA A 348 15.111 3.489 -0.044 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.834 1.070 0.428 1.00 0.00 H new ATOM 0 HB2 ALA A 348 15.322 1.956 1.892 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.628 1.453 1.680 1.00 0.00 H new ATOM 995 N LEU A 349 11.915 2.595 -0.114 1.00 0.00 N ATOM 996 CA LEU A 349 10.814 2.397 -1.093 1.00 0.00 C ATOM 997 C LEU A 349 10.476 3.757 -1.695 1.00 0.00 C ATOM 998 O LEU A 349 10.393 3.898 -2.887 1.00 0.00 O ATOM 999 CB LEU A 349 9.556 1.828 -0.409 1.00 0.00 C ATOM 1000 CG LEU A 349 9.582 0.295 -0.347 1.00 0.00 C ATOM 1001 CD1 LEU A 349 8.290 -0.192 0.330 1.00 0.00 C ATOM 1002 CD2 LEU A 349 9.690 -0.320 -1.760 1.00 0.00 C ATOM 0 H LEU A 349 11.668 2.456 0.866 1.00 0.00 H new ATOM 0 HA LEU A 349 11.135 1.689 -1.857 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.478 2.231 0.601 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.669 2.154 -0.952 1.00 0.00 H new ATOM 0 HG LEU A 349 10.455 -0.020 0.224 1.00 0.00 H new ATOM 0 HD11 LEU A 349 8.294 -1.281 0.381 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.230 0.218 1.338 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.428 0.141 -0.249 1.00 0.00 H new ATOM 0 HD21 LEU A 349 9.706 -1.407 -1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 349 8.832 -0.011 -2.358 1.00 0.00 H new ATOM 0 HD23 LEU A 349 10.608 0.024 -2.237 1.00 0.00 H new ATOM 1014 N GLN A 350 10.278 4.751 -0.866 1.00 0.00 N ATOM 1015 CA GLN A 350 9.935 6.113 -1.372 1.00 0.00 C ATOM 1016 C GLN A 350 10.788 6.449 -2.605 1.00 0.00 C ATOM 1017 O GLN A 350 10.319 7.063 -3.543 1.00 0.00 O ATOM 1018 CB GLN A 350 10.182 7.139 -0.244 1.00 0.00 C ATOM 1019 CG GLN A 350 9.071 8.193 -0.229 1.00 0.00 C ATOM 1020 CD GLN A 350 9.418 9.290 0.780 1.00 0.00 C ATOM 1021 OE1 GLN A 350 8.881 10.379 0.720 1.00 0.00 O ATOM 1022 NE2 GLN A 350 10.298 9.048 1.713 1.00 0.00 N ATOM 0 H GLN A 350 10.340 4.675 0.149 1.00 0.00 H new ATOM 0 HA GLN A 350 8.886 6.146 -1.668 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.221 6.629 0.718 1.00 0.00 H new ATOM 0 HB3 GLN A 350 11.148 7.622 -0.388 1.00 0.00 H new ATOM 0 HG2 GLN A 350 8.951 8.624 -1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 350 8.120 7.730 0.035 1.00 0.00 H new ATOM 0 HE21 GLN A 350 10.749 8.135 1.764 1.00 0.00 H new ATOM 0 HE22 GLN A 350 10.535 9.772 2.391 1.00 0.00 H new ATOM 1031 N ARG A 351 12.026 6.036 -2.622 1.00 0.00 N ATOM 1032 CA ARG A 351 12.878 6.320 -3.798 1.00 0.00 C ATOM 1033 C ARG A 351 12.287 5.578 -5.001 1.00 0.00 C ATOM 1034 O ARG A 351 12.104 6.139 -6.062 1.00 0.00 O ATOM 1035 CB ARG A 351 14.300 5.832 -3.508 1.00 0.00 C ATOM 1036 CG ARG A 351 15.120 5.848 -4.795 1.00 0.00 C ATOM 1037 CD ARG A 351 16.606 5.668 -4.475 1.00 0.00 C ATOM 1038 NE ARG A 351 17.041 6.670 -3.444 1.00 0.00 N ATOM 1039 CZ ARG A 351 16.905 7.956 -3.635 1.00 0.00 C ATOM 1040 NH1 ARG A 351 16.560 8.421 -4.804 1.00 0.00 N ATOM 1041 NH2 ARG A 351 17.169 8.784 -2.661 1.00 0.00 N ATOM 0 H ARG A 351 12.479 5.515 -1.871 1.00 0.00 H new ATOM 0 HA ARG A 351 12.913 7.388 -4.012 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.768 6.470 -2.759 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.272 4.824 -3.095 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.784 5.052 -5.459 1.00 0.00 H new ATOM 0 HG3 ARG A 351 14.965 6.789 -5.322 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.787 4.657 -4.109 1.00 0.00 H new ATOM 0 HD3 ARG A 351 17.198 5.789 -5.382 1.00 0.00 H new ATOM 0 HE ARG A 351 17.453 6.338 -2.572 1.00 0.00 H new ATOM 0 HH11 ARG A 351 16.394 7.779 -5.579 1.00 0.00 H new ATOM 0 HH12 ARG A 351 16.457 9.426 -4.943 1.00 0.00 H new ATOM 0 HH21 ARG A 351 17.479 8.426 -1.758 1.00 0.00 H new ATOM 0 HH22 ARG A 351 17.065 9.789 -2.803 1.00 0.00 H new ATOM 1055 N ILE A 352 11.970 4.323 -4.829 1.00 0.00 N ATOM 1056 CA ILE A 352 11.367 3.544 -5.951 1.00 0.00 C ATOM 1057 C ILE A 352 9.878 3.898 -6.059 1.00 0.00 C ATOM 1058 O ILE A 352 9.227 3.624 -7.047 1.00 0.00 O ATOM 1059 CB ILE A 352 11.510 2.044 -5.673 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.989 1.693 -5.478 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.952 1.253 -6.857 1.00 0.00 C ATOM 1062 CD1 ILE A 352 13.105 0.307 -4.837 1.00 0.00 C ATOM 0 H ILE A 352 12.102 3.803 -3.961 1.00 0.00 H new ATOM 0 HA ILE A 352 11.878 3.789 -6.882 1.00 0.00 H new ATOM 0 HB ILE A 352 10.957 1.790 -4.769 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.506 1.706 -6.437 1.00 0.00 H new ATOM 0 HG13 ILE A 352 13.471 2.439 -4.846 1.00 0.00 H new ATOM 0 HG21 ILE A 352 11.053 0.185 -6.661 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.899 1.499 -6.995 1.00 0.00 H new ATOM 0 HG23 ILE A 352 11.506 1.510 -7.760 1.00 0.00 H new ATOM 0 HD11 ILE A 352 14.157 0.057 -4.698 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.602 0.310 -3.870 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.639 -0.434 -5.486 1.00 0.00 H new ATOM 1074 N ILE A 353 9.344 4.490 -5.024 1.00 0.00 N ATOM 1075 CA ILE A 353 7.899 4.870 -4.990 1.00 0.00 C ATOM 1076 C ILE A 353 7.793 6.401 -4.974 1.00 0.00 C ATOM 1077 O ILE A 353 7.046 6.988 -5.732 1.00 0.00 O ATOM 1078 CB ILE A 353 7.280 4.264 -3.707 1.00 0.00 C ATOM 1079 CG1 ILE A 353 6.865 2.808 -3.976 1.00 0.00 C ATOM 1080 CG2 ILE A 353 6.051 5.057 -3.250 1.00 0.00 C ATOM 1081 CD1 ILE A 353 6.493 2.090 -2.664 1.00 0.00 C ATOM 0 H ILE A 353 9.862 4.732 -4.179 1.00 0.00 H new ATOM 0 HA ILE A 353 7.366 4.494 -5.863 1.00 0.00 H new ATOM 0 HB ILE A 353 8.031 4.306 -2.918 1.00 0.00 H new ATOM 0 HG12 ILE A 353 6.016 2.788 -4.659 1.00 0.00 H new ATOM 0 HG13 ILE A 353 7.681 2.278 -4.466 1.00 0.00 H new ATOM 0 HG21 ILE A 353 5.641 4.605 -2.347 1.00 0.00 H new ATOM 0 HG22 ILE A 353 6.340 6.087 -3.041 1.00 0.00 H new ATOM 0 HG23 ILE A 353 5.297 5.044 -4.037 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.203 1.062 -2.881 1.00 0.00 H new ATOM 0 HD12 ILE A 353 7.352 2.091 -1.993 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.661 2.609 -2.189 1.00 0.00 H new