USER MOD reduce.3.24.130724 H: found=0, std=0, add=556, rem=0, adj=19 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 323 SER OG : rot 180:sc= -0.0221 USER MOD Set 1.2: A 330 THR OG1 : rot 68:sc= 1.22 USER MOD Set 2.1: A 310 HIS : no HD1:sc= -7.83! C(o=-12!,f=-24!) USER MOD Set 2.2: A 312 CYS SG : rot 32:sc= -3.89! USER MOD Set 3.1: A 290 SER OG : rot 180:sc= -0.0195 USER MOD Set 3.2: A 294 MET CE :methyl 150:sc= -0.261 (180deg=-2!) USER MOD Single : A 293 THR OG1 : rot -140:sc= -0.534 USER MOD Single : A 295 LYS NZ :NH3+ 159:sc= 1.16 (180deg=0.0598) USER MOD Single : A 301 THR OG1 : rot 48:sc= 0.185 USER MOD Single : A 305 GLN : amide:sc= -0.0287 K(o=-0.029,f=-1.5!) USER MOD Single : A 306 THR OG1 : rot 71:sc= 0.128 USER MOD Single : A 311 LYS NZ :NH3+ 157:sc= -1.1 (180deg=-1.77) USER MOD Single : A 313 GLN : amide:sc= -1.2 K(o=-1.2,f=0) USER MOD Single : A 318 TYR OH : rot 180:sc= 0 USER MOD Single : A 321 LYS NZ :NH3+ -157:sc= -0.284 (180deg=-1.67) USER MOD Single : A 325 THR OG1 : rot -94:sc= -3.25! USER MOD Single : A 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 334 HIS : no HD1:sc= -0.18 K(o=-0.18,f=-0.84) USER MOD Single : A 336 LYS NZ :NH3+ -129:sc= -0.0584 (180deg=-0.541) 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 180:sc= -0.551 USER MOD Single : A 341 GLN : amide:sc= -0.0118 X(o=-0.012,f=-0.2) USER MOD Single : A 342 TYR OH : rot 30:sc= 0 USER MOD Single : A 344 SER OG : rot -43:sc= 0.031 USER MOD Single : A 345 THR OG1 : rot -43:sc= 0.376 USER MOD Single : A 346 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 350 GLN : amide:sc= 0.0106 X(o=0.011,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N PHE A 289 -19.674 2.098 2.409 1.00 0.00 N ATOM 2 CA PHE A 289 -18.277 1.751 2.035 1.00 0.00 C ATOM 3 C PHE A 289 -17.961 2.318 0.651 1.00 0.00 C ATOM 4 O PHE A 289 -17.005 1.927 0.012 1.00 0.00 O ATOM 5 CB PHE A 289 -18.128 0.231 1.979 1.00 0.00 C ATOM 6 CG PHE A 289 -18.767 -0.390 3.195 1.00 0.00 C ATOM 7 CD1 PHE A 289 -20.141 -0.655 3.202 1.00 0.00 C ATOM 8 CD2 PHE A 289 -17.988 -0.702 4.314 1.00 0.00 C ATOM 9 CE1 PHE A 289 -20.737 -1.232 4.330 1.00 0.00 C ATOM 10 CE2 PHE A 289 -18.583 -1.279 5.443 1.00 0.00 C ATOM 11 CZ PHE A 289 -19.958 -1.545 5.451 1.00 0.00 C ATOM 0 HA PHE A 289 -17.596 2.170 2.776 1.00 0.00 H new ATOM 0 HB2 PHE A 289 -18.595 -0.156 1.074 1.00 0.00 H new ATOM 0 HB3 PHE A 289 -17.073 -0.039 1.934 1.00 0.00 H new ATOM 0 HD1 PHE A 289 -20.742 -0.414 2.337 1.00 0.00 H new ATOM 0 HD2 PHE A 289 -16.927 -0.498 4.307 1.00 0.00 H new ATOM 0 HE1 PHE A 289 -21.798 -1.436 4.336 1.00 0.00 H new ATOM 0 HE2 PHE A 289 -17.982 -1.519 6.307 1.00 0.00 H new ATOM 0 HZ PHE A 289 -20.417 -1.991 6.321 1.00 0.00 H new ATOM 21 N SER A 290 -18.775 3.214 0.173 1.00 0.00 N ATOM 22 CA SER A 290 -18.557 3.792 -1.186 1.00 0.00 C ATOM 23 C SER A 290 -17.756 5.100 -1.125 1.00 0.00 C ATOM 24 O SER A 290 -16.907 5.345 -1.959 1.00 0.00 O ATOM 25 CB SER A 290 -19.922 4.033 -1.855 1.00 0.00 C ATOM 26 OG SER A 290 -19.867 3.573 -3.200 1.00 0.00 O ATOM 0 H SER A 290 -19.590 3.576 0.668 1.00 0.00 H new ATOM 0 HA SER A 290 -17.974 3.083 -1.774 1.00 0.00 H new ATOM 0 HB2 SER A 290 -20.706 3.508 -1.310 1.00 0.00 H new ATOM 0 HB3 SER A 290 -20.171 5.094 -1.830 1.00 0.00 H new ATOM 0 HG SER A 290 -20.734 3.722 -3.632 1.00 0.00 H new ATOM 32 N PRO A 291 -18.040 5.947 -0.179 1.00 0.00 N ATOM 33 CA PRO A 291 -17.361 7.254 -0.049 1.00 0.00 C ATOM 34 C PRO A 291 -16.087 7.203 0.803 1.00 0.00 C ATOM 35 O PRO A 291 -15.047 7.679 0.400 1.00 0.00 O ATOM 36 CB PRO A 291 -18.433 8.113 0.620 1.00 0.00 C ATOM 37 CG PRO A 291 -19.180 7.163 1.508 1.00 0.00 C ATOM 38 CD PRO A 291 -19.038 5.760 0.883 1.00 0.00 C ATOM 0 HA PRO A 291 -17.011 7.631 -1.010 1.00 0.00 H new ATOM 0 HB2 PRO A 291 -17.988 8.926 1.194 1.00 0.00 H new ATOM 0 HB3 PRO A 291 -19.094 8.568 -0.118 1.00 0.00 H new ATOM 0 HG2 PRO A 291 -18.773 7.178 2.519 1.00 0.00 H new ATOM 0 HG3 PRO A 291 -20.229 7.448 1.583 1.00 0.00 H new ATOM 0 HD2 PRO A 291 -18.707 5.027 1.618 1.00 0.00 H new ATOM 0 HD3 PRO A 291 -19.987 5.403 0.482 1.00 0.00 H new ATOM 46 N GLU A 292 -16.168 6.661 1.989 1.00 0.00 N ATOM 47 CA GLU A 292 -14.955 6.623 2.879 1.00 0.00 C ATOM 48 C GLU A 292 -14.112 5.367 2.639 1.00 0.00 C ATOM 49 O GLU A 292 -12.931 5.440 2.352 1.00 0.00 O ATOM 50 CB GLU A 292 -15.375 6.693 4.359 1.00 0.00 C ATOM 51 CG GLU A 292 -16.461 5.658 4.679 1.00 0.00 C ATOM 52 CD GLU A 292 -17.074 5.978 6.044 1.00 0.00 C ATOM 53 OE1 GLU A 292 -16.354 5.904 7.026 1.00 0.00 O ATOM 54 OE2 GLU A 292 -18.252 6.291 6.084 1.00 0.00 O ATOM 0 H GLU A 292 -17.011 6.244 2.384 1.00 0.00 H new ATOM 0 HA GLU A 292 -14.343 7.491 2.632 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -14.506 6.520 4.994 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -15.744 7.693 4.588 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -17.232 5.672 3.908 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -16.034 4.655 4.685 1.00 0.00 H new ATOM 61 N THR A 293 -14.698 4.220 2.780 1.00 0.00 N ATOM 62 CA THR A 293 -13.931 2.957 2.596 1.00 0.00 C ATOM 63 C THR A 293 -13.339 2.886 1.195 1.00 0.00 C ATOM 64 O THR A 293 -12.174 2.593 1.014 1.00 0.00 O ATOM 65 CB THR A 293 -14.877 1.777 2.785 1.00 0.00 C ATOM 66 OG1 THR A 293 -15.622 1.958 3.980 1.00 0.00 O ATOM 67 CG2 THR A 293 -14.083 0.479 2.871 1.00 0.00 C ATOM 0 H THR A 293 -15.683 4.097 3.017 1.00 0.00 H new ATOM 0 HA THR A 293 -13.121 2.927 3.325 1.00 0.00 H new ATOM 0 HB THR A 293 -15.555 1.722 1.934 1.00 0.00 H new ATOM 0 HG1 THR A 293 -15.710 1.099 4.444 1.00 0.00 H new ATOM 0 HG21 THR A 293 -14.768 -0.358 3.006 1.00 0.00 H new ATOM 0 HG22 THR A 293 -13.515 0.338 1.951 1.00 0.00 H new ATOM 0 HG23 THR A 293 -13.398 0.527 3.717 1.00 0.00 H new ATOM 75 N MET A 294 -14.143 3.110 0.200 1.00 0.00 N ATOM 76 CA MET A 294 -13.634 3.009 -1.188 1.00 0.00 C ATOM 77 C MET A 294 -12.399 3.899 -1.357 1.00 0.00 C ATOM 78 O MET A 294 -11.438 3.508 -1.985 1.00 0.00 O ATOM 79 CB MET A 294 -14.745 3.408 -2.173 1.00 0.00 C ATOM 80 CG MET A 294 -14.608 2.605 -3.475 1.00 0.00 C ATOM 81 SD MET A 294 -16.043 2.923 -4.532 1.00 0.00 S ATOM 82 CE MET A 294 -17.104 1.601 -3.888 1.00 0.00 C ATOM 0 H MET A 294 -15.128 3.358 0.288 1.00 0.00 H new ATOM 0 HA MET A 294 -13.340 1.981 -1.398 1.00 0.00 H new ATOM 0 HB2 MET A 294 -15.722 3.226 -1.725 1.00 0.00 H new ATOM 0 HB3 MET A 294 -14.686 4.475 -2.387 1.00 0.00 H new ATOM 0 HG2 MET A 294 -13.691 2.886 -3.994 1.00 0.00 H new ATOM 0 HG3 MET A 294 -14.535 1.540 -3.253 1.00 0.00 H new ATOM 0 HE1 MET A 294 -18.149 1.900 -3.971 1.00 0.00 H new ATOM 0 HE2 MET A 294 -16.940 0.690 -4.464 1.00 0.00 H new ATOM 0 HE3 MET A 294 -16.861 1.417 -2.841 1.00 0.00 H new ATOM 92 N LYS A 295 -12.392 5.078 -0.790 1.00 0.00 N ATOM 93 CA LYS A 295 -11.183 5.945 -0.923 1.00 0.00 C ATOM 94 C LYS A 295 -9.967 5.129 -0.510 1.00 0.00 C ATOM 95 O LYS A 295 -8.961 5.117 -1.186 1.00 0.00 O ATOM 96 CB LYS A 295 -11.315 7.178 -0.023 1.00 0.00 C ATOM 97 CG LYS A 295 -12.229 8.210 -0.688 1.00 0.00 C ATOM 98 CD LYS A 295 -12.564 9.304 0.324 1.00 0.00 C ATOM 99 CE LYS A 295 -13.309 10.447 -0.372 1.00 0.00 C ATOM 100 NZ LYS A 295 -14.456 9.899 -1.149 1.00 0.00 N ATOM 0 H LYS A 295 -13.160 5.474 -0.248 1.00 0.00 H new ATOM 0 HA LYS A 295 -11.078 6.284 -1.954 1.00 0.00 H new ATOM 0 HB2 LYS A 295 -11.721 6.890 0.947 1.00 0.00 H new ATOM 0 HB3 LYS A 295 -10.332 7.613 0.160 1.00 0.00 H new ATOM 0 HG2 LYS A 295 -11.738 8.642 -1.560 1.00 0.00 H new ATOM 0 HG3 LYS A 295 -13.142 7.732 -1.041 1.00 0.00 H new ATOM 0 HD2 LYS A 295 -13.177 8.894 1.126 1.00 0.00 H new ATOM 0 HD3 LYS A 295 -11.649 9.680 0.782 1.00 0.00 H new ATOM 0 HE2 LYS A 295 -13.667 11.164 0.367 1.00 0.00 H new ATOM 0 HE3 LYS A 295 -12.632 10.985 -1.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 -15.152 10.653 -1.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 -14.114 9.531 -2.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 -14.904 9.130 -0.611 1.00 0.00 H new ATOM 114 N ALA A 296 -10.057 4.423 0.580 1.00 0.00 N ATOM 115 CA ALA A 296 -8.901 3.588 0.994 1.00 0.00 C ATOM 116 C ALA A 296 -8.583 2.632 -0.155 1.00 0.00 C ATOM 117 O ALA A 296 -7.444 2.471 -0.547 1.00 0.00 O ATOM 118 CB ALA A 296 -9.254 2.792 2.249 1.00 0.00 C ATOM 0 H ALA A 296 -10.870 4.388 1.195 1.00 0.00 H new ATOM 0 HA ALA A 296 -8.039 4.216 1.219 1.00 0.00 H new ATOM 0 HB1 ALA A 296 -8.400 2.182 2.545 1.00 0.00 H new ATOM 0 HB2 ALA A 296 -9.507 3.479 3.056 1.00 0.00 H new ATOM 0 HB3 ALA A 296 -10.107 2.146 2.042 1.00 0.00 H new ATOM 124 N ARG A 297 -9.592 2.017 -0.712 1.00 0.00 N ATOM 125 CA ARG A 297 -9.364 1.094 -1.857 1.00 0.00 C ATOM 126 C ARG A 297 -8.797 1.904 -3.020 1.00 0.00 C ATOM 127 O ARG A 297 -8.013 1.420 -3.811 1.00 0.00 O ATOM 128 CB ARG A 297 -10.687 0.460 -2.285 1.00 0.00 C ATOM 129 CG ARG A 297 -11.405 -0.088 -1.057 1.00 0.00 C ATOM 130 CD ARG A 297 -12.676 -0.818 -1.492 1.00 0.00 C ATOM 131 NE ARG A 297 -12.308 -2.102 -2.153 1.00 0.00 N ATOM 132 CZ ARG A 297 -13.209 -3.028 -2.327 1.00 0.00 C ATOM 133 NH1 ARG A 297 -14.433 -2.831 -1.920 1.00 0.00 N ATOM 134 NH2 ARG A 297 -12.887 -4.150 -2.910 1.00 0.00 N ATOM 0 H ARG A 297 -10.565 2.115 -0.422 1.00 0.00 H new ATOM 0 HA ARG A 297 -8.670 0.306 -1.565 1.00 0.00 H new ATOM 0 HB2 ARG A 297 -11.312 1.199 -2.786 1.00 0.00 H new ATOM 0 HB3 ARG A 297 -10.504 -0.341 -3.001 1.00 0.00 H new ATOM 0 HG2 ARG A 297 -10.750 -0.769 -0.513 1.00 0.00 H new ATOM 0 HG3 ARG A 297 -11.655 0.725 -0.376 1.00 0.00 H new ATOM 0 HD2 ARG A 297 -13.312 -1.010 -0.628 1.00 0.00 H new ATOM 0 HD3 ARG A 297 -13.250 -0.195 -2.178 1.00 0.00 H new ATOM 0 HE ARG A 297 -11.351 -2.256 -2.469 1.00 0.00 H new ATOM 0 HH11 ARG A 297 -14.684 -1.953 -1.466 1.00 0.00 H new ATOM 0 HH12 ARG A 297 -15.138 -3.555 -2.056 1.00 0.00 H new ATOM 0 HH21 ARG A 297 -11.930 -4.303 -3.230 1.00 0.00 H new ATOM 0 HH22 ARG A 297 -13.592 -4.875 -3.046 1.00 0.00 H new ATOM 148 N ARG A 298 -9.187 3.146 -3.118 1.00 0.00 N ATOM 149 CA ARG A 298 -8.671 4.006 -4.214 1.00 0.00 C ATOM 150 C ARG A 298 -7.188 4.254 -3.950 1.00 0.00 C ATOM 151 O ARG A 298 -6.351 4.072 -4.812 1.00 0.00 O ATOM 152 CB ARG A 298 -9.461 5.331 -4.223 1.00 0.00 C ATOM 153 CG ARG A 298 -9.465 5.975 -5.630 1.00 0.00 C ATOM 154 CD ARG A 298 -8.191 6.820 -5.853 1.00 0.00 C ATOM 155 NE ARG A 298 -8.514 8.261 -5.652 1.00 0.00 N ATOM 156 CZ ARG A 298 -7.550 9.132 -5.512 1.00 0.00 C ATOM 157 NH1 ARG A 298 -6.307 8.736 -5.535 1.00 0.00 N ATOM 158 NH2 ARG A 298 -7.830 10.397 -5.350 1.00 0.00 N ATOM 0 H ARG A 298 -9.843 3.601 -2.483 1.00 0.00 H new ATOM 0 HA ARG A 298 -8.791 3.530 -5.187 1.00 0.00 H new ATOM 0 HB2 ARG A 298 -10.486 5.147 -3.902 1.00 0.00 H new ATOM 0 HB3 ARG A 298 -9.021 6.024 -3.505 1.00 0.00 H new ATOM 0 HG2 ARG A 298 -9.528 5.197 -6.390 1.00 0.00 H new ATOM 0 HG3 ARG A 298 -10.348 6.604 -5.744 1.00 0.00 H new ATOM 0 HD2 ARG A 298 -7.409 6.510 -5.159 1.00 0.00 H new ATOM 0 HD3 ARG A 298 -7.806 6.659 -6.860 1.00 0.00 H new ATOM 0 HE ARG A 298 -9.487 8.567 -5.624 1.00 0.00 H new ATOM 0 HH11 ARG A 298 -6.089 7.748 -5.662 1.00 0.00 H new ATOM 0 HH12 ARG A 298 -5.553 9.415 -5.426 1.00 0.00 H new ATOM 0 HH21 ARG A 298 -8.802 10.706 -5.333 1.00 0.00 H new ATOM 0 HH22 ARG A 298 -7.077 11.076 -5.241 1.00 0.00 H new ATOM 172 N ALA A 299 -6.854 4.637 -2.748 1.00 0.00 N ATOM 173 CA ALA A 299 -5.421 4.858 -2.414 1.00 0.00 C ATOM 174 C ALA A 299 -4.678 3.553 -2.692 1.00 0.00 C ATOM 175 O ALA A 299 -3.523 3.539 -3.074 1.00 0.00 O ATOM 176 CB ALA A 299 -5.290 5.222 -0.933 1.00 0.00 C ATOM 0 H ALA A 299 -7.510 4.806 -1.986 1.00 0.00 H new ATOM 0 HA ALA A 299 -5.006 5.671 -3.010 1.00 0.00 H new ATOM 0 HB1 ALA A 299 -4.240 5.384 -0.690 1.00 0.00 H new ATOM 0 HB2 ALA A 299 -5.854 6.133 -0.731 1.00 0.00 H new ATOM 0 HB3 ALA A 299 -5.683 4.409 -0.322 1.00 0.00 H new ATOM 182 N TRP A 300 -5.361 2.454 -2.522 1.00 0.00 N ATOM 183 CA TRP A 300 -4.749 1.126 -2.788 1.00 0.00 C ATOM 184 C TRP A 300 -4.736 0.883 -4.298 1.00 0.00 C ATOM 185 O TRP A 300 -4.028 0.029 -4.791 1.00 0.00 O ATOM 186 CB TRP A 300 -5.585 0.041 -2.115 1.00 0.00 C ATOM 187 CG TRP A 300 -5.615 0.162 -0.601 1.00 0.00 C ATOM 188 CD1 TRP A 300 -6.520 -0.494 0.174 1.00 0.00 C ATOM 189 CD2 TRP A 300 -4.759 0.919 0.347 1.00 0.00 C ATOM 190 NE1 TRP A 300 -6.269 -0.226 1.500 1.00 0.00 N ATOM 191 CE2 TRP A 300 -5.207 0.629 1.666 1.00 0.00 C ATOM 192 CE3 TRP A 300 -3.653 1.802 0.223 1.00 0.00 C ATOM 193 CZ2 TRP A 300 -4.594 1.175 2.793 1.00 0.00 C ATOM 194 CZ3 TRP A 300 -3.042 2.348 1.364 1.00 0.00 C ATOM 195 CH2 TRP A 300 -3.509 2.032 2.642 1.00 0.00 C ATOM 0 H TRP A 300 -6.330 2.422 -2.206 1.00 0.00 H new ATOM 0 HA TRP A 300 -3.732 1.101 -2.395 1.00 0.00 H new ATOM 0 HB2 TRP A 300 -6.605 0.088 -2.497 1.00 0.00 H new ATOM 0 HB3 TRP A 300 -5.187 -0.937 -2.387 1.00 0.00 H new ATOM 0 HD1 TRP A 300 -7.313 -1.128 -0.195 1.00 0.00 H new ATOM 0 HE1 TRP A 300 -6.810 -0.617 2.271 1.00 0.00 H new ATOM 0 HE3 TRP A 300 -3.278 2.056 -0.758 1.00 0.00 H new ATOM 0 HZ2 TRP A 300 -4.960 0.933 3.780 1.00 0.00 H new ATOM 0 HZ3 TRP A 300 -2.203 3.019 1.252 1.00 0.00 H new ATOM 0 HH2 TRP A 300 -3.028 2.453 3.512 1.00 0.00 H new ATOM 206 N THR A 301 -5.507 1.634 -5.037 1.00 0.00 N ATOM 207 CA THR A 301 -5.530 1.449 -6.516 1.00 0.00 C ATOM 208 C THR A 301 -4.334 2.166 -7.149 1.00 0.00 C ATOM 209 O THR A 301 -3.517 1.568 -7.819 1.00 0.00 O ATOM 210 CB THR A 301 -6.812 2.048 -7.082 1.00 0.00 C ATOM 211 OG1 THR A 301 -7.924 1.605 -6.317 1.00 0.00 O ATOM 212 CG2 THR A 301 -6.979 1.613 -8.538 1.00 0.00 C ATOM 0 H THR A 301 -6.121 2.367 -4.681 1.00 0.00 H new ATOM 0 HA THR A 301 -5.482 0.383 -6.740 1.00 0.00 H new ATOM 0 HB THR A 301 -6.756 3.136 -7.035 1.00 0.00 H new ATOM 0 HG1 THR A 301 -7.730 1.717 -5.363 1.00 0.00 H new ATOM 0 HG21 THR A 301 -7.896 2.041 -8.943 1.00 0.00 H new ATOM 0 HG22 THR A 301 -6.127 1.961 -9.122 1.00 0.00 H new ATOM 0 HG23 THR A 301 -7.033 0.526 -8.589 1.00 0.00 H new ATOM 220 N ASP A 302 -4.239 3.454 -6.949 1.00 0.00 N ATOM 221 CA ASP A 302 -3.113 4.230 -7.542 1.00 0.00 C ATOM 222 C ASP A 302 -1.785 3.557 -7.208 1.00 0.00 C ATOM 223 O ASP A 302 -0.914 3.426 -8.043 1.00 0.00 O ATOM 224 CB ASP A 302 -3.115 5.649 -6.974 1.00 0.00 C ATOM 225 CG ASP A 302 -4.441 6.333 -7.308 1.00 0.00 C ATOM 226 OD1 ASP A 302 -5.353 5.640 -7.730 1.00 0.00 O ATOM 227 OD2 ASP A 302 -4.523 7.537 -7.137 1.00 0.00 O ATOM 0 H ASP A 302 -4.897 4.004 -6.397 1.00 0.00 H new ATOM 0 HA ASP A 302 -3.237 4.266 -8.624 1.00 0.00 H new ATOM 0 HB2 ASP A 302 -2.971 5.619 -5.894 1.00 0.00 H new ATOM 0 HB3 ASP A 302 -2.285 6.219 -7.390 1.00 0.00 H new ATOM 232 N VAL A 303 -1.613 3.133 -5.992 1.00 0.00 N ATOM 233 CA VAL A 303 -0.335 2.482 -5.620 1.00 0.00 C ATOM 234 C VAL A 303 -0.278 1.076 -6.221 1.00 0.00 C ATOM 235 O VAL A 303 0.765 0.620 -6.642 1.00 0.00 O ATOM 236 CB VAL A 303 -0.242 2.395 -4.098 1.00 0.00 C ATOM 237 CG1 VAL A 303 -0.357 3.799 -3.499 1.00 0.00 C ATOM 238 CG2 VAL A 303 -1.377 1.518 -3.570 1.00 0.00 C ATOM 0 H VAL A 303 -2.300 3.209 -5.242 1.00 0.00 H new ATOM 0 HA VAL A 303 0.500 3.068 -6.005 1.00 0.00 H new ATOM 0 HB VAL A 303 0.716 1.959 -3.815 1.00 0.00 H new ATOM 0 HG11 VAL A 303 -0.291 3.738 -2.413 1.00 0.00 H new ATOM 0 HG12 VAL A 303 0.452 4.423 -3.877 1.00 0.00 H new ATOM 0 HG13 VAL A 303 -1.315 4.237 -3.780 1.00 0.00 H new ATOM 0 HG21 VAL A 303 -1.313 1.454 -2.484 1.00 0.00 H new ATOM 0 HG22 VAL A 303 -2.335 1.954 -3.852 1.00 0.00 H new ATOM 0 HG23 VAL A 303 -1.294 0.519 -3.997 1.00 0.00 H new ATOM 248 N ILE A 304 -1.386 0.381 -6.275 1.00 0.00 N ATOM 249 CA ILE A 304 -1.363 -0.998 -6.853 1.00 0.00 C ATOM 250 C ILE A 304 -0.601 -0.974 -8.190 1.00 0.00 C ATOM 251 O ILE A 304 0.160 -1.873 -8.490 1.00 0.00 O ATOM 252 CB ILE A 304 -2.823 -1.508 -7.021 1.00 0.00 C ATOM 253 CG1 ILE A 304 -3.172 -2.477 -5.875 1.00 0.00 C ATOM 254 CG2 ILE A 304 -3.023 -2.233 -8.358 1.00 0.00 C ATOM 255 CD1 ILE A 304 -4.682 -2.742 -5.840 1.00 0.00 C ATOM 0 H ILE A 304 -2.297 0.704 -5.948 1.00 0.00 H new ATOM 0 HA ILE A 304 -0.845 -1.687 -6.186 1.00 0.00 H new ATOM 0 HB ILE A 304 -3.478 -0.637 -6.999 1.00 0.00 H new ATOM 0 HG12 ILE A 304 -2.635 -3.416 -6.008 1.00 0.00 H new ATOM 0 HG13 ILE A 304 -2.848 -2.056 -4.923 1.00 0.00 H new ATOM 0 HG21 ILE A 304 -4.055 -2.574 -8.436 1.00 0.00 H new ATOM 0 HG22 ILE A 304 -2.803 -1.550 -9.179 1.00 0.00 H new ATOM 0 HG23 ILE A 304 -2.353 -3.091 -8.410 1.00 0.00 H new ATOM 0 HD11 ILE A 304 -4.912 -3.428 -5.025 1.00 0.00 H new ATOM 0 HD12 ILE A 304 -5.213 -1.803 -5.684 1.00 0.00 H new ATOM 0 HD13 ILE A 304 -4.996 -3.184 -6.786 1.00 0.00 H new ATOM 267 N GLN A 305 -0.780 0.045 -8.988 1.00 0.00 N ATOM 268 CA GLN A 305 -0.036 0.097 -10.278 1.00 0.00 C ATOM 269 C GLN A 305 1.423 0.460 -9.975 1.00 0.00 C ATOM 270 O GLN A 305 2.336 0.039 -10.658 1.00 0.00 O ATOM 271 CB GLN A 305 -0.693 1.127 -11.230 1.00 0.00 C ATOM 272 CG GLN A 305 -0.082 2.526 -11.046 1.00 0.00 C ATOM 273 CD GLN A 305 -1.026 3.587 -11.616 1.00 0.00 C ATOM 274 OE1 GLN A 305 -2.006 3.263 -12.258 1.00 0.00 O ATOM 275 NE2 GLN A 305 -0.770 4.850 -11.407 1.00 0.00 N ATOM 0 H GLN A 305 -1.401 0.833 -8.805 1.00 0.00 H new ATOM 0 HA GLN A 305 -0.067 -0.871 -10.779 1.00 0.00 H new ATOM 0 HB2 GLN A 305 -0.564 0.804 -12.263 1.00 0.00 H new ATOM 0 HB3 GLN A 305 -1.766 1.168 -11.040 1.00 0.00 H new ATOM 0 HG2 GLN A 305 0.098 2.717 -9.988 1.00 0.00 H new ATOM 0 HG3 GLN A 305 0.884 2.579 -11.548 1.00 0.00 H new ATOM 0 HE21 GLN A 305 0.052 5.121 -10.868 1.00 0.00 H new ATOM 0 HE22 GLN A 305 -1.392 5.565 -11.782 1.00 0.00 H new ATOM 284 N THR A 306 1.645 1.233 -8.942 1.00 0.00 N ATOM 285 CA THR A 306 3.042 1.612 -8.582 1.00 0.00 C ATOM 286 C THR A 306 3.774 0.387 -8.037 1.00 0.00 C ATOM 287 O THR A 306 4.814 0.008 -8.528 1.00 0.00 O ATOM 288 CB THR A 306 3.024 2.700 -7.506 1.00 0.00 C ATOM 289 OG1 THR A 306 2.213 3.784 -7.938 1.00 0.00 O ATOM 290 CG2 THR A 306 4.447 3.196 -7.247 1.00 0.00 C ATOM 0 H THR A 306 0.921 1.616 -8.335 1.00 0.00 H new ATOM 0 HA THR A 306 3.551 1.986 -9.470 1.00 0.00 H new ATOM 0 HB THR A 306 2.615 2.286 -6.584 1.00 0.00 H new ATOM 0 HG1 THR A 306 1.272 3.511 -7.932 1.00 0.00 H new ATOM 0 HG21 THR A 306 4.428 3.970 -6.480 1.00 0.00 H new ATOM 0 HG22 THR A 306 5.066 2.365 -6.909 1.00 0.00 H new ATOM 0 HG23 THR A 306 4.862 3.607 -8.167 1.00 0.00 H new ATOM 298 N LEU A 307 3.238 -0.236 -7.018 1.00 0.00 N ATOM 299 CA LEU A 307 3.910 -1.437 -6.435 1.00 0.00 C ATOM 300 C LEU A 307 4.355 -2.372 -7.571 1.00 0.00 C ATOM 301 O LEU A 307 5.434 -2.926 -7.554 1.00 0.00 O ATOM 302 CB LEU A 307 2.925 -2.180 -5.508 1.00 0.00 C ATOM 303 CG LEU A 307 2.932 -1.601 -4.072 1.00 0.00 C ATOM 304 CD1 LEU A 307 4.216 -1.981 -3.331 1.00 0.00 C ATOM 305 CD2 LEU A 307 2.799 -0.075 -4.106 1.00 0.00 C ATOM 0 H LEU A 307 2.365 0.035 -6.565 1.00 0.00 H new ATOM 0 HA LEU A 307 4.781 -1.125 -5.859 1.00 0.00 H new ATOM 0 HB2 LEU A 307 1.918 -2.114 -5.921 1.00 0.00 H new ATOM 0 HB3 LEU A 307 3.187 -3.238 -5.474 1.00 0.00 H new ATOM 0 HG LEU A 307 2.080 -2.027 -3.542 1.00 0.00 H new ATOM 0 HD11 LEU A 307 4.194 -1.561 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 307 4.293 -3.067 -3.269 1.00 0.00 H new ATOM 0 HD13 LEU A 307 5.077 -1.586 -3.870 1.00 0.00 H new ATOM 0 HD21 LEU A 307 2.806 0.314 -3.088 1.00 0.00 H new ATOM 0 HD22 LEU A 307 3.634 0.351 -4.662 1.00 0.00 H new ATOM 0 HD23 LEU A 307 1.862 0.198 -4.592 1.00 0.00 H new ATOM 317 N ARG A 308 3.527 -2.554 -8.554 1.00 0.00 N ATOM 318 CA ARG A 308 3.894 -3.451 -9.686 1.00 0.00 C ATOM 319 C ARG A 308 5.048 -2.848 -10.496 1.00 0.00 C ATOM 320 O ARG A 308 5.529 -3.448 -11.437 1.00 0.00 O ATOM 321 CB ARG A 308 2.682 -3.634 -10.601 1.00 0.00 C ATOM 322 CG ARG A 308 1.566 -4.341 -9.835 1.00 0.00 C ATOM 323 CD ARG A 308 0.272 -4.270 -10.644 1.00 0.00 C ATOM 324 NE ARG A 308 0.520 -4.787 -12.018 1.00 0.00 N ATOM 325 CZ ARG A 308 -0.484 -5.096 -12.789 1.00 0.00 C ATOM 326 NH1 ARG A 308 -1.707 -4.947 -12.357 1.00 0.00 N ATOM 327 NH2 ARG A 308 -0.268 -5.556 -13.991 1.00 0.00 N ATOM 0 H ARG A 308 2.607 -2.120 -8.626 1.00 0.00 H new ATOM 0 HA ARG A 308 4.209 -4.414 -9.283 1.00 0.00 H new ATOM 0 HB2 ARG A 308 2.334 -2.665 -10.959 1.00 0.00 H new ATOM 0 HB3 ARG A 308 2.961 -4.217 -11.479 1.00 0.00 H new ATOM 0 HG2 ARG A 308 1.837 -5.381 -9.653 1.00 0.00 H new ATOM 0 HG3 ARG A 308 1.425 -3.873 -8.861 1.00 0.00 H new ATOM 0 HD2 ARG A 308 -0.507 -4.857 -10.158 1.00 0.00 H new ATOM 0 HD3 ARG A 308 -0.086 -3.241 -10.689 1.00 0.00 H new ATOM 0 HE ARG A 308 1.476 -4.899 -12.356 1.00 0.00 H new ATOM 0 HH11 ARG A 308 -1.876 -4.589 -11.417 1.00 0.00 H new ATOM 0 HH12 ARG A 308 -2.494 -5.189 -12.960 1.00 0.00 H new ATOM 0 HH21 ARG A 308 0.688 -5.674 -14.328 1.00 0.00 H new ATOM 0 HH22 ARG A 308 -1.055 -5.798 -14.594 1.00 0.00 H new ATOM 341 N GLU A 309 5.479 -1.653 -10.172 1.00 0.00 N ATOM 342 CA GLU A 309 6.576 -1.023 -10.972 1.00 0.00 C ATOM 343 C GLU A 309 7.962 -1.527 -10.525 1.00 0.00 C ATOM 344 O GLU A 309 8.957 -1.201 -11.141 1.00 0.00 O ATOM 345 CB GLU A 309 6.480 0.517 -10.846 1.00 0.00 C ATOM 346 CG GLU A 309 7.299 1.043 -9.657 1.00 0.00 C ATOM 347 CD GLU A 309 6.950 2.512 -9.419 1.00 0.00 C ATOM 348 OE1 GLU A 309 6.061 3.006 -10.093 1.00 0.00 O ATOM 349 OE2 GLU A 309 7.580 3.119 -8.568 1.00 0.00 O ATOM 0 H GLU A 309 5.124 -1.092 -9.398 1.00 0.00 H new ATOM 0 HA GLU A 309 6.455 -1.308 -12.017 1.00 0.00 H new ATOM 0 HB2 GLU A 309 6.836 0.980 -11.766 1.00 0.00 H new ATOM 0 HB3 GLU A 309 5.436 0.808 -10.726 1.00 0.00 H new ATOM 0 HG2 GLU A 309 7.084 0.456 -8.764 1.00 0.00 H new ATOM 0 HG3 GLU A 309 8.365 0.938 -9.859 1.00 0.00 H new ATOM 356 N HIS A 310 8.045 -2.330 -9.483 1.00 0.00 N ATOM 357 CA HIS A 310 9.386 -2.857 -9.038 1.00 0.00 C ATOM 358 C HIS A 310 9.311 -4.376 -8.817 1.00 0.00 C ATOM 359 O HIS A 310 9.318 -5.143 -9.760 1.00 0.00 O ATOM 360 CB HIS A 310 9.842 -2.154 -7.751 1.00 0.00 C ATOM 361 CG HIS A 310 8.679 -1.934 -6.831 1.00 0.00 C ATOM 362 ND1 HIS A 310 7.906 -2.977 -6.354 1.00 0.00 N ATOM 363 CD2 HIS A 310 8.160 -0.795 -6.270 1.00 0.00 C ATOM 364 CE1 HIS A 310 6.976 -2.449 -5.543 1.00 0.00 C ATOM 365 NE2 HIS A 310 7.088 -1.123 -5.454 1.00 0.00 N ATOM 0 H HIS A 310 7.250 -2.642 -8.925 1.00 0.00 H new ATOM 0 HA HIS A 310 10.116 -2.651 -9.820 1.00 0.00 H new ATOM 0 HB2 HIS A 310 10.600 -2.756 -7.250 1.00 0.00 H new ATOM 0 HB3 HIS A 310 10.305 -1.198 -7.996 1.00 0.00 H new ATOM 0 HD2 HIS A 310 8.530 0.206 -6.438 1.00 0.00 H new ATOM 0 HE1 HIS A 310 6.227 -3.029 -5.024 1.00 0.00 H new ATOM 0 HE2 HIS A 310 6.510 -0.487 -4.904 1.00 0.00 H new ATOM 373 N LYS A 311 9.261 -4.826 -7.584 1.00 0.00 N ATOM 374 CA LYS A 311 9.212 -6.303 -7.329 1.00 0.00 C ATOM 375 C LYS A 311 8.356 -6.619 -6.098 1.00 0.00 C ATOM 376 O LYS A 311 8.047 -7.765 -5.837 1.00 0.00 O ATOM 377 CB LYS A 311 10.640 -6.818 -7.111 1.00 0.00 C ATOM 378 CG LYS A 311 11.414 -5.825 -6.238 1.00 0.00 C ATOM 379 CD LYS A 311 12.754 -6.438 -5.818 1.00 0.00 C ATOM 380 CE LYS A 311 13.571 -6.811 -7.059 1.00 0.00 C ATOM 381 NZ LYS A 311 13.420 -5.750 -8.098 1.00 0.00 N ATOM 0 H LYS A 311 9.252 -4.240 -6.749 1.00 0.00 H new ATOM 0 HA LYS A 311 8.762 -6.795 -8.191 1.00 0.00 H new ATOM 0 HB2 LYS A 311 10.616 -7.797 -6.632 1.00 0.00 H new ATOM 0 HB3 LYS A 311 11.143 -6.944 -8.070 1.00 0.00 H new ATOM 0 HG2 LYS A 311 11.584 -4.899 -6.787 1.00 0.00 H new ATOM 0 HG3 LYS A 311 10.828 -5.569 -5.355 1.00 0.00 H new ATOM 0 HD2 LYS A 311 13.311 -5.730 -5.205 1.00 0.00 H new ATOM 0 HD3 LYS A 311 12.582 -7.323 -5.206 1.00 0.00 H new ATOM 0 HE2 LYS A 311 14.622 -6.926 -6.793 1.00 0.00 H new ATOM 0 HE3 LYS A 311 13.235 -7.770 -7.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 311 14.232 -5.782 -8.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 311 12.543 -5.910 -8.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 311 13.380 -4.818 -7.639 1.00 0.00 H new ATOM 395 N CYS A 312 7.948 -5.632 -5.344 1.00 0.00 N ATOM 396 CA CYS A 312 7.094 -5.924 -4.153 1.00 0.00 C ATOM 397 C CYS A 312 5.647 -6.048 -4.649 1.00 0.00 C ATOM 398 O CYS A 312 5.050 -5.091 -5.102 1.00 0.00 O ATOM 399 CB CYS A 312 7.237 -4.797 -3.099 1.00 0.00 C ATOM 400 SG CYS A 312 8.660 -3.751 -3.505 1.00 0.00 S ATOM 0 H CYS A 312 8.165 -4.647 -5.498 1.00 0.00 H new ATOM 0 HA CYS A 312 7.401 -6.851 -3.669 1.00 0.00 H new ATOM 0 HB2 CYS A 312 6.328 -4.195 -3.071 1.00 0.00 H new ATOM 0 HB3 CYS A 312 7.364 -5.229 -2.106 1.00 0.00 H new ATOM 0 HG CYS A 312 8.808 -3.702 -4.796 1.00 0.00 H new ATOM 406 N GLN A 313 5.102 -7.233 -4.617 1.00 0.00 N ATOM 407 CA GLN A 313 3.721 -7.437 -5.142 1.00 0.00 C ATOM 408 C GLN A 313 2.650 -6.834 -4.199 1.00 0.00 C ATOM 409 O GLN A 313 2.738 -6.993 -2.999 1.00 0.00 O ATOM 410 CB GLN A 313 3.458 -8.939 -5.289 1.00 0.00 C ATOM 411 CG GLN A 313 4.677 -9.620 -5.919 1.00 0.00 C ATOM 412 CD GLN A 313 4.373 -11.102 -6.151 1.00 0.00 C ATOM 413 OE1 GLN A 313 5.258 -11.931 -6.104 1.00 0.00 O ATOM 414 NE2 GLN A 313 3.146 -11.473 -6.402 1.00 0.00 N ATOM 0 H GLN A 313 5.554 -8.070 -4.249 1.00 0.00 H new ATOM 0 HA GLN A 313 3.651 -6.931 -6.105 1.00 0.00 H new ATOM 0 HB2 GLN A 313 3.248 -9.378 -4.314 1.00 0.00 H new ATOM 0 HB3 GLN A 313 2.577 -9.104 -5.909 1.00 0.00 H new ATOM 0 HG2 GLN A 313 4.928 -9.138 -6.864 1.00 0.00 H new ATOM 0 HG3 GLN A 313 5.544 -9.514 -5.266 1.00 0.00 H new ATOM 0 HE21 GLN A 313 2.401 -10.778 -6.442 1.00 0.00 H new ATOM 0 HE22 GLN A 313 2.933 -12.458 -6.558 1.00 0.00 H new ATOM 423 N PRO A 314 1.624 -6.167 -4.731 1.00 0.00 N ATOM 424 CA PRO A 314 0.516 -5.584 -3.908 1.00 0.00 C ATOM 425 C PRO A 314 -0.683 -6.535 -3.790 1.00 0.00 C ATOM 426 O PRO A 314 -1.025 -7.229 -4.729 1.00 0.00 O ATOM 427 CB PRO A 314 0.113 -4.380 -4.738 1.00 0.00 C ATOM 428 CG PRO A 314 0.197 -4.884 -6.140 1.00 0.00 C ATOM 429 CD PRO A 314 1.392 -5.859 -6.166 1.00 0.00 C ATOM 0 HA PRO A 314 0.824 -5.368 -2.885 1.00 0.00 H new ATOM 0 HB2 PRO A 314 -0.893 -4.041 -4.492 1.00 0.00 H new ATOM 0 HB3 PRO A 314 0.783 -3.536 -4.573 1.00 0.00 H new ATOM 0 HG2 PRO A 314 -0.725 -5.388 -6.430 1.00 0.00 H new ATOM 0 HG3 PRO A 314 0.346 -4.064 -6.842 1.00 0.00 H new ATOM 0 HD2 PRO A 314 1.163 -6.759 -6.737 1.00 0.00 H new ATOM 0 HD3 PRO A 314 2.270 -5.405 -6.625 1.00 0.00 H new ATOM 437 N ARG A 315 -1.343 -6.551 -2.660 1.00 0.00 N ATOM 438 CA ARG A 315 -2.533 -7.440 -2.487 1.00 0.00 C ATOM 439 C ARG A 315 -3.571 -6.719 -1.626 1.00 0.00 C ATOM 440 O ARG A 315 -3.289 -6.329 -0.510 1.00 0.00 O ATOM 441 CB ARG A 315 -2.126 -8.745 -1.779 1.00 0.00 C ATOM 442 CG ARG A 315 -0.838 -9.326 -2.395 1.00 0.00 C ATOM 443 CD ARG A 315 0.416 -8.710 -1.738 1.00 0.00 C ATOM 444 NE ARG A 315 0.877 -9.594 -0.631 1.00 0.00 N ATOM 445 CZ ARG A 315 2.080 -9.453 -0.147 1.00 0.00 C ATOM 446 NH1 ARG A 315 2.880 -8.552 -0.644 1.00 0.00 N ATOM 447 NH2 ARG A 315 2.485 -10.215 0.832 1.00 0.00 N ATOM 0 H ARG A 315 -1.108 -5.984 -1.845 1.00 0.00 H new ATOM 0 HA ARG A 315 -2.945 -7.676 -3.468 1.00 0.00 H new ATOM 0 HB2 ARG A 315 -1.972 -8.555 -0.717 1.00 0.00 H new ATOM 0 HB3 ARG A 315 -2.933 -9.474 -1.859 1.00 0.00 H new ATOM 0 HG2 ARG A 315 -0.826 -10.408 -2.267 1.00 0.00 H new ATOM 0 HG3 ARG A 315 -0.824 -9.132 -3.467 1.00 0.00 H new ATOM 0 HD2 ARG A 315 1.207 -8.592 -2.478 1.00 0.00 H new ATOM 0 HD3 ARG A 315 0.188 -7.716 -1.354 1.00 0.00 H new ATOM 0 HE ARG A 315 0.254 -10.307 -0.253 1.00 0.00 H new ATOM 0 HH11 ARG A 315 2.565 -7.958 -1.411 1.00 0.00 H new ATOM 0 HH12 ARG A 315 3.821 -8.441 -0.266 1.00 0.00 H new ATOM 0 HH21 ARG A 315 1.861 -10.922 1.220 1.00 0.00 H new ATOM 0 HH22 ARG A 315 3.426 -10.103 1.209 1.00 0.00 H new ATOM 461 N LEU A 316 -4.770 -6.535 -2.121 1.00 0.00 N ATOM 462 CA LEU A 316 -5.811 -5.846 -1.317 1.00 0.00 C ATOM 463 C LEU A 316 -6.638 -6.889 -0.558 1.00 0.00 C ATOM 464 O LEU A 316 -7.291 -7.732 -1.141 1.00 0.00 O ATOM 465 CB LEU A 316 -6.716 -5.048 -2.261 1.00 0.00 C ATOM 466 CG LEU A 316 -7.340 -3.862 -1.524 1.00 0.00 C ATOM 467 CD1 LEU A 316 -8.163 -3.041 -2.514 1.00 0.00 C ATOM 468 CD2 LEU A 316 -8.241 -4.373 -0.399 1.00 0.00 C ATOM 0 H LEU A 316 -5.068 -6.835 -3.049 1.00 0.00 H new ATOM 0 HA LEU A 316 -5.346 -5.170 -0.599 1.00 0.00 H new ATOM 0 HB2 LEU A 316 -6.139 -4.691 -3.114 1.00 0.00 H new ATOM 0 HB3 LEU A 316 -7.501 -5.694 -2.655 1.00 0.00 H new ATOM 0 HG LEU A 316 -6.556 -3.239 -1.094 1.00 0.00 H new ATOM 0 HD11 LEU A 316 -8.612 -2.193 -1.998 1.00 0.00 H new ATOM 0 HD12 LEU A 316 -7.516 -2.679 -3.313 1.00 0.00 H new ATOM 0 HD13 LEU A 316 -8.949 -3.665 -2.939 1.00 0.00 H new ATOM 0 HD21 LEU A 316 -8.685 -3.526 0.125 1.00 0.00 H new ATOM 0 HD22 LEU A 316 -9.032 -4.994 -0.820 1.00 0.00 H new ATOM 0 HD23 LEU A 316 -7.650 -4.963 0.301 1.00 0.00 H new ATOM 480 N LEU A 317 -6.619 -6.813 0.738 1.00 0.00 N ATOM 481 CA LEU A 317 -7.404 -7.767 1.588 1.00 0.00 C ATOM 482 C LEU A 317 -8.600 -7.002 2.134 1.00 0.00 C ATOM 483 O LEU A 317 -9.099 -6.135 1.459 1.00 0.00 O ATOM 484 CB LEU A 317 -6.546 -8.290 2.754 1.00 0.00 C ATOM 485 CG LEU A 317 -5.314 -9.065 2.239 1.00 0.00 C ATOM 486 CD1 LEU A 317 -5.744 -10.153 1.242 1.00 0.00 C ATOM 487 CD2 LEU A 317 -4.311 -8.108 1.568 1.00 0.00 C ATOM 0 H LEU A 317 -6.085 -6.120 1.262 1.00 0.00 H new ATOM 0 HA LEU A 317 -7.721 -8.626 0.997 1.00 0.00 H new ATOM 0 HB2 LEU A 317 -6.220 -7.454 3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 317 -7.148 -8.940 3.389 1.00 0.00 H new ATOM 0 HG LEU A 317 -4.829 -9.538 3.093 1.00 0.00 H new ATOM 0 HD11 LEU A 317 -4.864 -10.690 0.888 1.00 0.00 H new ATOM 0 HD12 LEU A 317 -6.422 -10.851 1.734 1.00 0.00 H new ATOM 0 HD13 LEU A 317 -6.252 -9.691 0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 317 -3.450 -8.674 1.212 1.00 0.00 H new ATOM 0 HD22 LEU A 317 -4.791 -7.610 0.726 1.00 0.00 H new ATOM 0 HD23 LEU A 317 -3.981 -7.362 2.291 1.00 0.00 H new ATOM 499 N TYR A 318 -9.048 -7.329 3.338 1.00 0.00 N ATOM 500 CA TYR A 318 -10.226 -6.643 4.002 1.00 0.00 C ATOM 501 C TYR A 318 -10.677 -5.395 3.206 1.00 0.00 C ATOM 502 O TYR A 318 -9.845 -4.695 2.683 1.00 0.00 O ATOM 503 CB TYR A 318 -9.778 -6.216 5.415 1.00 0.00 C ATOM 504 CG TYR A 318 -10.937 -6.255 6.383 1.00 0.00 C ATOM 505 CD1 TYR A 318 -11.353 -7.477 6.921 1.00 0.00 C ATOM 506 CD2 TYR A 318 -11.593 -5.071 6.741 1.00 0.00 C ATOM 507 CE1 TYR A 318 -12.428 -7.516 7.817 1.00 0.00 C ATOM 508 CE2 TYR A 318 -12.667 -5.109 7.637 1.00 0.00 C ATOM 509 CZ TYR A 318 -13.085 -6.332 8.175 1.00 0.00 C ATOM 510 OH TYR A 318 -14.143 -6.371 9.059 1.00 0.00 O ATOM 0 H TYR A 318 -8.632 -8.067 3.906 1.00 0.00 H new ATOM 0 HA TYR A 318 -11.071 -7.330 4.042 1.00 0.00 H new ATOM 0 HB2 TYR A 318 -8.985 -6.877 5.765 1.00 0.00 H new ATOM 0 HB3 TYR A 318 -9.362 -5.209 5.380 1.00 0.00 H new ATOM 0 HD1 TYR A 318 -10.845 -8.390 6.646 1.00 0.00 H new ATOM 0 HD2 TYR A 318 -11.270 -4.128 6.325 1.00 0.00 H new ATOM 0 HE1 TYR A 318 -12.751 -8.459 8.232 1.00 0.00 H new ATOM 0 HE2 TYR A 318 -13.173 -4.196 7.913 1.00 0.00 H new ATOM 0 HH TYR A 318 -14.485 -5.463 9.201 1.00 0.00 H new ATOM 520 N PRO A 319 -11.968 -5.122 3.107 1.00 0.00 N ATOM 521 CA PRO A 319 -12.507 -3.959 2.346 1.00 0.00 C ATOM 522 C PRO A 319 -11.526 -2.790 2.172 1.00 0.00 C ATOM 523 O PRO A 319 -11.673 -1.985 1.274 1.00 0.00 O ATOM 524 CB PRO A 319 -13.717 -3.569 3.181 1.00 0.00 C ATOM 525 CG PRO A 319 -14.276 -4.887 3.639 1.00 0.00 C ATOM 526 CD PRO A 319 -13.084 -5.873 3.713 1.00 0.00 C ATOM 0 HA PRO A 319 -12.731 -4.219 1.311 1.00 0.00 H new ATOM 0 HB2 PRO A 319 -13.435 -2.939 4.025 1.00 0.00 H new ATOM 0 HB3 PRO A 319 -14.444 -3.008 2.594 1.00 0.00 H new ATOM 0 HG2 PRO A 319 -14.756 -4.787 4.612 1.00 0.00 H new ATOM 0 HG3 PRO A 319 -15.035 -5.248 2.945 1.00 0.00 H new ATOM 0 HD2 PRO A 319 -12.863 -6.157 4.742 1.00 0.00 H new ATOM 0 HD3 PRO A 319 -13.291 -6.793 3.166 1.00 0.00 H new ATOM 534 N ALA A 320 -10.514 -2.698 2.989 1.00 0.00 N ATOM 535 CA ALA A 320 -9.528 -1.594 2.816 1.00 0.00 C ATOM 536 C ALA A 320 -8.163 -1.980 3.409 1.00 0.00 C ATOM 537 O ALA A 320 -7.495 -1.151 3.995 1.00 0.00 O ATOM 538 CB ALA A 320 -10.054 -0.340 3.507 1.00 0.00 C ATOM 0 H ALA A 320 -10.327 -3.334 3.764 1.00 0.00 H new ATOM 0 HA ALA A 320 -9.396 -1.405 1.751 1.00 0.00 H new ATOM 0 HB1 ALA A 320 -9.337 0.471 3.384 1.00 0.00 H new ATOM 0 HB2 ALA A 320 -11.007 -0.052 3.063 1.00 0.00 H new ATOM 0 HB3 ALA A 320 -10.195 -0.542 4.569 1.00 0.00 H new ATOM 544 N LYS A 321 -7.725 -3.219 3.253 1.00 0.00 N ATOM 545 CA LYS A 321 -6.379 -3.619 3.811 1.00 0.00 C ATOM 546 C LYS A 321 -5.408 -3.890 2.650 1.00 0.00 C ATOM 547 O LYS A 321 -5.691 -4.674 1.766 1.00 0.00 O ATOM 548 CB LYS A 321 -6.531 -4.882 4.684 1.00 0.00 C ATOM 549 CG LYS A 321 -6.918 -4.487 6.124 1.00 0.00 C ATOM 550 CD LYS A 321 -5.661 -4.087 6.933 1.00 0.00 C ATOM 551 CE LYS A 321 -5.077 -5.310 7.650 1.00 0.00 C ATOM 552 NZ LYS A 321 -3.717 -4.981 8.163 1.00 0.00 N ATOM 0 H LYS A 321 -8.233 -3.960 2.771 1.00 0.00 H new ATOM 0 HA LYS A 321 -5.984 -2.812 4.428 1.00 0.00 H new ATOM 0 HB2 LYS A 321 -7.293 -5.537 4.261 1.00 0.00 H new ATOM 0 HB3 LYS A 321 -5.597 -5.443 4.691 1.00 0.00 H new ATOM 0 HG2 LYS A 321 -7.623 -3.656 6.102 1.00 0.00 H new ATOM 0 HG3 LYS A 321 -7.422 -5.321 6.613 1.00 0.00 H new ATOM 0 HD2 LYS A 321 -4.913 -3.656 6.267 1.00 0.00 H new ATOM 0 HD3 LYS A 321 -5.919 -3.319 7.662 1.00 0.00 H new ATOM 0 HE2 LYS A 321 -5.726 -5.607 8.474 1.00 0.00 H new ATOM 0 HE3 LYS A 321 -5.024 -6.156 6.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 321 -3.173 -5.858 8.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 321 -3.228 -4.366 7.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 321 -3.800 -4.489 9.076 1.00 0.00 H new ATOM 566 N LEU A 322 -4.268 -3.228 2.641 1.00 0.00 N ATOM 567 CA LEU A 322 -3.273 -3.418 1.529 1.00 0.00 C ATOM 568 C LEU A 322 -1.991 -4.070 2.066 1.00 0.00 C ATOM 569 O LEU A 322 -1.333 -3.537 2.938 1.00 0.00 O ATOM 570 CB LEU A 322 -2.946 -2.032 0.948 1.00 0.00 C ATOM 571 CG LEU A 322 -2.298 -2.129 -0.450 1.00 0.00 C ATOM 572 CD1 LEU A 322 -0.961 -2.881 -0.368 1.00 0.00 C ATOM 573 CD2 LEU A 322 -3.244 -2.838 -1.444 1.00 0.00 C ATOM 0 H LEU A 322 -3.984 -2.562 3.359 1.00 0.00 H new ATOM 0 HA LEU A 322 -3.690 -4.069 0.761 1.00 0.00 H new ATOM 0 HB2 LEU A 322 -3.860 -1.441 0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 322 -2.272 -1.505 1.624 1.00 0.00 H new ATOM 0 HG LEU A 322 -2.113 -1.117 -0.810 1.00 0.00 H new ATOM 0 HD11 LEU A 322 -0.516 -2.941 -1.361 1.00 0.00 H new ATOM 0 HD12 LEU A 322 -0.285 -2.349 0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 322 -1.132 -3.887 0.015 1.00 0.00 H new ATOM 0 HD21 LEU A 322 -2.767 -2.895 -2.422 1.00 0.00 H new ATOM 0 HD22 LEU A 322 -3.460 -3.845 -1.086 1.00 0.00 H new ATOM 0 HD23 LEU A 322 -4.174 -2.275 -1.526 1.00 0.00 H new ATOM 585 N SER A 323 -1.630 -5.219 1.542 1.00 0.00 N ATOM 586 CA SER A 323 -0.388 -5.919 2.005 1.00 0.00 C ATOM 587 C SER A 323 0.728 -5.756 0.969 1.00 0.00 C ATOM 588 O SER A 323 0.484 -5.581 -0.208 1.00 0.00 O ATOM 589 CB SER A 323 -0.688 -7.403 2.199 1.00 0.00 C ATOM 590 OG SER A 323 0.517 -8.088 2.515 1.00 0.00 O ATOM 0 H SER A 323 -2.146 -5.705 0.809 1.00 0.00 H new ATOM 0 HA SER A 323 -0.062 -5.481 2.948 1.00 0.00 H new ATOM 0 HB2 SER A 323 -1.417 -7.537 2.999 1.00 0.00 H new ATOM 0 HB3 SER A 323 -1.129 -7.818 1.293 1.00 0.00 H new ATOM 0 HG SER A 323 0.328 -9.041 2.642 1.00 0.00 H new ATOM 596 N ILE A 324 1.957 -5.807 1.411 1.00 0.00 N ATOM 597 CA ILE A 324 3.117 -5.647 0.484 1.00 0.00 C ATOM 598 C ILE A 324 4.228 -6.631 0.871 1.00 0.00 C ATOM 599 O ILE A 324 4.358 -7.021 2.015 1.00 0.00 O ATOM 600 CB ILE A 324 3.654 -4.202 0.542 1.00 0.00 C ATOM 601 CG1 ILE A 324 3.740 -3.676 2.004 1.00 0.00 C ATOM 602 CG2 ILE A 324 2.730 -3.288 -0.276 1.00 0.00 C ATOM 603 CD1 ILE A 324 5.130 -3.950 2.595 1.00 0.00 C ATOM 0 H ILE A 324 2.210 -5.955 2.388 1.00 0.00 H new ATOM 0 HA ILE A 324 2.787 -5.857 -0.533 1.00 0.00 H new ATOM 0 HB ILE A 324 4.662 -4.198 0.126 1.00 0.00 H new ATOM 0 HG12 ILE A 324 3.535 -2.606 2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 324 2.977 -4.158 2.615 1.00 0.00 H new ATOM 0 HG21 ILE A 324 3.104 -2.265 -0.239 1.00 0.00 H new ATOM 0 HG22 ILE A 324 2.705 -3.628 -1.311 1.00 0.00 H new ATOM 0 HG23 ILE A 324 1.723 -3.321 0.141 1.00 0.00 H new ATOM 0 HD11 ILE A 324 5.171 -3.575 3.618 1.00 0.00 H new ATOM 0 HD12 ILE A 324 5.321 -5.023 2.594 1.00 0.00 H new ATOM 0 HD13 ILE A 324 5.887 -3.446 1.993 1.00 0.00 H new ATOM 615 N THR A 325 5.016 -7.052 -0.092 1.00 0.00 N ATOM 616 CA THR A 325 6.122 -8.029 0.179 1.00 0.00 C ATOM 617 C THR A 325 7.448 -7.430 -0.290 1.00 0.00 C ATOM 618 O THR A 325 7.739 -7.405 -1.467 1.00 0.00 O ATOM 619 CB THR A 325 5.851 -9.321 -0.606 1.00 0.00 C ATOM 620 OG1 THR A 325 4.731 -9.986 -0.037 1.00 0.00 O ATOM 621 CG2 THR A 325 7.079 -10.245 -0.547 1.00 0.00 C ATOM 0 H THR A 325 4.939 -6.757 -1.065 1.00 0.00 H new ATOM 0 HA THR A 325 6.171 -8.245 1.246 1.00 0.00 H new ATOM 0 HB THR A 325 5.646 -9.072 -1.647 1.00 0.00 H new ATOM 0 HG1 THR A 325 5.041 -10.649 0.615 1.00 0.00 H new ATOM 0 HG21 THR A 325 6.875 -11.158 -1.107 1.00 0.00 H new ATOM 0 HG22 THR A 325 7.939 -9.736 -0.983 1.00 0.00 H new ATOM 0 HG23 THR A 325 7.295 -10.497 0.491 1.00 0.00 H new ATOM 629 N ILE A 326 8.262 -6.961 0.620 1.00 0.00 N ATOM 630 CA ILE A 326 9.574 -6.364 0.219 1.00 0.00 C ATOM 631 C ILE A 326 10.682 -7.402 0.385 1.00 0.00 C ATOM 632 O ILE A 326 11.348 -7.462 1.400 1.00 0.00 O ATOM 633 CB ILE A 326 9.871 -5.154 1.105 1.00 0.00 C ATOM 634 CG1 ILE A 326 8.645 -4.238 1.137 1.00 0.00 C ATOM 635 CG2 ILE A 326 11.064 -4.388 0.530 1.00 0.00 C ATOM 636 CD1 ILE A 326 8.913 -3.053 2.063 1.00 0.00 C ATOM 0 H ILE A 326 8.076 -6.965 1.623 1.00 0.00 H new ATOM 0 HA ILE A 326 9.527 -6.051 -0.824 1.00 0.00 H new ATOM 0 HB ILE A 326 10.104 -5.487 2.116 1.00 0.00 H new ATOM 0 HG12 ILE A 326 8.418 -3.883 0.132 1.00 0.00 H new ATOM 0 HG13 ILE A 326 7.773 -4.793 1.483 1.00 0.00 H new ATOM 0 HG21 ILE A 326 11.279 -3.524 1.159 1.00 0.00 H new ATOM 0 HG22 ILE A 326 11.936 -5.041 0.500 1.00 0.00 H new ATOM 0 HG23 ILE A 326 10.828 -4.052 -0.480 1.00 0.00 H new ATOM 0 HD11 ILE A 326 8.039 -2.403 2.084 1.00 0.00 H new ATOM 0 HD12 ILE A 326 9.119 -3.417 3.070 1.00 0.00 H new ATOM 0 HD13 ILE A 326 9.773 -2.493 1.697 1.00 0.00 H new ATOM 648 N ASP A 327 10.881 -8.208 -0.624 1.00 0.00 N ATOM 649 CA ASP A 327 11.945 -9.257 -0.586 1.00 0.00 C ATOM 650 C ASP A 327 12.058 -9.872 0.811 1.00 0.00 C ATOM 651 O ASP A 327 13.125 -10.279 1.228 1.00 0.00 O ATOM 652 CB ASP A 327 13.287 -8.631 -0.974 1.00 0.00 C ATOM 653 CG ASP A 327 14.351 -9.725 -1.077 1.00 0.00 C ATOM 654 OD1 ASP A 327 13.992 -10.886 -0.972 1.00 0.00 O ATOM 655 OD2 ASP A 327 15.509 -9.384 -1.260 1.00 0.00 O ATOM 0 H ASP A 327 10.341 -8.184 -1.489 1.00 0.00 H new ATOM 0 HA ASP A 327 11.680 -10.045 -1.291 1.00 0.00 H new ATOM 0 HB2 ASP A 327 13.195 -8.108 -1.926 1.00 0.00 H new ATOM 0 HB3 ASP A 327 13.583 -7.890 -0.231 1.00 0.00 H new ATOM 660 N GLY A 328 10.978 -9.956 1.539 1.00 0.00 N ATOM 661 CA GLY A 328 11.068 -10.558 2.899 1.00 0.00 C ATOM 662 C GLY A 328 9.720 -10.503 3.623 1.00 0.00 C ATOM 663 O GLY A 328 8.671 -10.636 3.024 1.00 0.00 O ATOM 0 H GLY A 328 10.051 -9.639 1.257 1.00 0.00 H new ATOM 0 HA2 GLY A 328 11.398 -11.594 2.819 1.00 0.00 H new ATOM 0 HA3 GLY A 328 11.819 -10.028 3.484 1.00 0.00 H new ATOM 667 N GLU A 329 9.752 -10.327 4.920 1.00 0.00 N ATOM 668 CA GLU A 329 8.489 -10.282 5.708 1.00 0.00 C ATOM 669 C GLU A 329 7.514 -9.280 5.083 1.00 0.00 C ATOM 670 O GLU A 329 7.890 -8.202 4.665 1.00 0.00 O ATOM 671 CB GLU A 329 8.813 -9.869 7.151 1.00 0.00 C ATOM 672 CG GLU A 329 9.184 -8.386 7.189 1.00 0.00 C ATOM 673 CD GLU A 329 9.877 -8.051 8.515 1.00 0.00 C ATOM 674 OE1 GLU A 329 10.322 -8.972 9.181 1.00 0.00 O ATOM 675 OE2 GLU A 329 9.954 -6.878 8.839 1.00 0.00 O ATOM 0 H GLU A 329 10.605 -10.212 5.467 1.00 0.00 H new ATOM 0 HA GLU A 329 8.023 -11.267 5.705 1.00 0.00 H new ATOM 0 HB2 GLU A 329 7.954 -10.056 7.795 1.00 0.00 H new ATOM 0 HB3 GLU A 329 9.637 -10.470 7.536 1.00 0.00 H new ATOM 0 HG2 GLU A 329 9.843 -8.146 6.354 1.00 0.00 H new ATOM 0 HG3 GLU A 329 8.288 -7.776 7.073 1.00 0.00 H new ATOM 682 N THR A 330 6.262 -9.637 5.019 1.00 0.00 N ATOM 683 CA THR A 330 5.237 -8.728 4.424 1.00 0.00 C ATOM 684 C THR A 330 4.651 -7.823 5.510 1.00 0.00 C ATOM 685 O THR A 330 4.687 -8.138 6.683 1.00 0.00 O ATOM 686 CB THR A 330 4.114 -9.565 3.806 1.00 0.00 C ATOM 687 OG1 THR A 330 3.028 -8.716 3.461 1.00 0.00 O ATOM 688 CG2 THR A 330 3.639 -10.619 4.809 1.00 0.00 C ATOM 0 H THR A 330 5.899 -10.529 5.356 1.00 0.00 H new ATOM 0 HA THR A 330 5.706 -8.113 3.656 1.00 0.00 H new ATOM 0 HB THR A 330 4.488 -10.064 2.912 1.00 0.00 H new ATOM 0 HG1 THR A 330 3.295 -8.125 2.726 1.00 0.00 H new ATOM 0 HG21 THR A 330 2.840 -11.211 4.363 1.00 0.00 H new ATOM 0 HG22 THR A 330 4.471 -11.272 5.072 1.00 0.00 H new ATOM 0 HG23 THR A 330 3.267 -10.125 5.707 1.00 0.00 H new ATOM 696 N LYS A 331 4.093 -6.703 5.120 1.00 0.00 N ATOM 697 CA LYS A 331 3.474 -5.764 6.105 1.00 0.00 C ATOM 698 C LYS A 331 2.110 -5.344 5.548 1.00 0.00 C ATOM 699 O LYS A 331 1.840 -5.506 4.375 1.00 0.00 O ATOM 700 CB LYS A 331 4.399 -4.533 6.290 1.00 0.00 C ATOM 701 CG LYS A 331 4.802 -4.371 7.764 1.00 0.00 C ATOM 702 CD LYS A 331 3.595 -3.928 8.602 1.00 0.00 C ATOM 703 CE LYS A 331 4.076 -3.343 9.937 1.00 0.00 C ATOM 704 NZ LYS A 331 2.970 -3.405 10.932 1.00 0.00 N ATOM 0 H LYS A 331 4.040 -6.396 4.149 1.00 0.00 H new ATOM 0 HA LYS A 331 3.345 -6.238 7.078 1.00 0.00 H new ATOM 0 HB2 LYS A 331 5.291 -4.647 5.675 1.00 0.00 H new ATOM 0 HB3 LYS A 331 3.888 -3.633 5.947 1.00 0.00 H new ATOM 0 HG2 LYS A 331 5.192 -5.314 8.147 1.00 0.00 H new ATOM 0 HG3 LYS A 331 5.602 -3.636 7.850 1.00 0.00 H new ATOM 0 HD2 LYS A 331 3.015 -3.184 8.056 1.00 0.00 H new ATOM 0 HD3 LYS A 331 2.935 -4.776 8.783 1.00 0.00 H new ATOM 0 HE2 LYS A 331 4.939 -3.901 10.301 1.00 0.00 H new ATOM 0 HE3 LYS A 331 4.398 -2.311 9.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 331 3.295 -3.009 11.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 331 2.159 -2.855 10.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 331 2.683 -4.395 11.071 1.00 0.00 H new ATOM 718 N VAL A 332 1.242 -4.818 6.372 1.00 0.00 N ATOM 719 CA VAL A 332 -0.102 -4.407 5.872 1.00 0.00 C ATOM 720 C VAL A 332 -0.565 -3.143 6.590 1.00 0.00 C ATOM 721 O VAL A 332 -0.126 -2.837 7.680 1.00 0.00 O ATOM 722 CB VAL A 332 -1.098 -5.545 6.119 1.00 0.00 C ATOM 723 CG1 VAL A 332 -2.298 -5.390 5.187 1.00 0.00 C ATOM 724 CG2 VAL A 332 -0.420 -6.887 5.836 1.00 0.00 C ATOM 0 H VAL A 332 1.405 -4.656 7.366 1.00 0.00 H new ATOM 0 HA VAL A 332 -0.044 -4.197 4.804 1.00 0.00 H new ATOM 0 HB VAL A 332 -1.431 -5.509 7.156 1.00 0.00 H new ATOM 0 HG11 VAL A 332 -3.004 -6.201 5.365 1.00 0.00 H new ATOM 0 HG12 VAL A 332 -2.786 -4.435 5.379 1.00 0.00 H new ATOM 0 HG13 VAL A 332 -1.961 -5.424 4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 332 -1.128 -7.697 6.012 1.00 0.00 H new ATOM 0 HG22 VAL A 332 -0.087 -6.915 4.798 1.00 0.00 H new ATOM 0 HG23 VAL A 332 0.439 -7.007 6.496 1.00 0.00 H new ATOM 734 N PHE A 333 -1.448 -2.399 5.970 1.00 0.00 N ATOM 735 CA PHE A 333 -1.946 -1.135 6.593 1.00 0.00 C ATOM 736 C PHE A 333 -3.456 -1.014 6.391 1.00 0.00 C ATOM 737 O PHE A 333 -3.987 -1.359 5.354 1.00 0.00 O ATOM 738 CB PHE A 333 -1.240 0.045 5.932 1.00 0.00 C ATOM 739 CG PHE A 333 0.241 -0.237 5.890 1.00 0.00 C ATOM 740 CD1 PHE A 333 1.049 0.119 6.973 1.00 0.00 C ATOM 741 CD2 PHE A 333 0.804 -0.863 4.773 1.00 0.00 C ATOM 742 CE1 PHE A 333 2.422 -0.147 6.942 1.00 0.00 C ATOM 743 CE2 PHE A 333 2.178 -1.131 4.741 1.00 0.00 C ATOM 744 CZ PHE A 333 2.987 -0.772 5.825 1.00 0.00 C ATOM 0 H PHE A 333 -1.846 -2.614 5.056 1.00 0.00 H new ATOM 0 HA PHE A 333 -1.737 -1.142 7.663 1.00 0.00 H new ATOM 0 HB2 PHE A 333 -1.624 0.198 4.923 1.00 0.00 H new ATOM 0 HB3 PHE A 333 -1.434 0.961 6.489 1.00 0.00 H new ATOM 0 HD1 PHE A 333 0.613 0.600 7.836 1.00 0.00 H new ATOM 0 HD2 PHE A 333 0.180 -1.139 3.936 1.00 0.00 H new ATOM 0 HE1 PHE A 333 3.045 0.130 7.779 1.00 0.00 H new ATOM 0 HE2 PHE A 333 2.614 -1.615 3.879 1.00 0.00 H new ATOM 0 HZ PHE A 333 4.047 -0.977 5.799 1.00 0.00 H new ATOM 754 N HIS A 334 -4.155 -0.530 7.386 1.00 0.00 N ATOM 755 CA HIS A 334 -5.637 -0.387 7.271 1.00 0.00 C ATOM 756 C HIS A 334 -5.983 1.018 6.765 1.00 0.00 C ATOM 757 O HIS A 334 -6.759 1.183 5.845 1.00 0.00 O ATOM 758 CB HIS A 334 -6.273 -0.609 8.655 1.00 0.00 C ATOM 759 CG HIS A 334 -7.715 -1.015 8.494 1.00 0.00 C ATOM 760 ND1 HIS A 334 -8.348 -1.008 7.263 1.00 0.00 N ATOM 761 CD2 HIS A 334 -8.652 -1.451 9.397 1.00 0.00 C ATOM 762 CE1 HIS A 334 -9.612 -1.427 7.454 1.00 0.00 C ATOM 763 NE2 HIS A 334 -9.851 -1.711 8.739 1.00 0.00 N ATOM 0 H HIS A 334 -3.761 -0.227 8.277 1.00 0.00 H new ATOM 0 HA HIS A 334 -6.022 -1.124 6.567 1.00 0.00 H new ATOM 0 HB2 HIS A 334 -5.727 -1.381 9.197 1.00 0.00 H new ATOM 0 HB3 HIS A 334 -6.206 0.304 9.247 1.00 0.00 H new ATOM 0 HD2 HIS A 334 -8.485 -1.574 10.457 1.00 0.00 H new ATOM 0 HE1 HIS A 334 -10.344 -1.522 6.666 1.00 0.00 H new ATOM 0 HE2 HIS A 334 -10.723 -2.046 9.148 1.00 0.00 H new ATOM 771 N ASP A 335 -5.418 2.032 7.367 1.00 0.00 N ATOM 772 CA ASP A 335 -5.718 3.429 6.932 1.00 0.00 C ATOM 773 C ASP A 335 -4.714 3.870 5.864 1.00 0.00 C ATOM 774 O ASP A 335 -3.710 3.226 5.634 1.00 0.00 O ATOM 775 CB ASP A 335 -5.621 4.364 8.138 1.00 0.00 C ATOM 776 CG ASP A 335 -6.410 3.769 9.306 1.00 0.00 C ATOM 777 OD1 ASP A 335 -7.439 3.164 9.052 1.00 0.00 O ATOM 778 OD2 ASP A 335 -5.972 3.926 10.434 1.00 0.00 O ATOM 0 H ASP A 335 -4.760 1.953 8.143 1.00 0.00 H new ATOM 0 HA ASP A 335 -6.724 3.468 6.514 1.00 0.00 H new ATOM 0 HB2 ASP A 335 -4.578 4.502 8.422 1.00 0.00 H new ATOM 0 HB3 ASP A 335 -6.015 5.348 7.882 1.00 0.00 H new ATOM 783 N LYS A 336 -4.986 4.966 5.210 1.00 0.00 N ATOM 784 CA LYS A 336 -4.058 5.462 4.152 1.00 0.00 C ATOM 785 C LYS A 336 -2.870 6.174 4.794 1.00 0.00 C ATOM 786 O LYS A 336 -1.780 6.175 4.262 1.00 0.00 O ATOM 787 CB LYS A 336 -4.799 6.443 3.242 1.00 0.00 C ATOM 788 CG LYS A 336 -5.417 7.560 4.087 1.00 0.00 C ATOM 789 CD LYS A 336 -6.198 8.511 3.180 1.00 0.00 C ATOM 790 CE LYS A 336 -6.885 9.579 4.033 1.00 0.00 C ATOM 791 NZ LYS A 336 -7.927 8.937 4.885 1.00 0.00 N ATOM 0 H LYS A 336 -5.814 5.542 5.363 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.699 4.615 3.568 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -4.111 6.865 2.509 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.577 5.921 2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.078 7.136 4.843 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -4.636 8.105 4.617 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -5.525 8.981 2.462 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -6.940 7.956 2.606 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -6.152 10.088 4.658 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -7.338 10.336 3.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -8.828 9.445 4.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -8.050 7.946 4.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -7.631 8.972 5.881 1.00 0.00 H new ATOM 805 N THR A 337 -3.072 6.781 5.927 1.00 0.00 N ATOM 806 CA THR A 337 -1.954 7.500 6.595 1.00 0.00 C ATOM 807 C THR A 337 -0.861 6.513 6.984 1.00 0.00 C ATOM 808 O THR A 337 0.281 6.649 6.593 1.00 0.00 O ATOM 809 CB THR A 337 -2.466 8.182 7.865 1.00 0.00 C ATOM 810 OG1 THR A 337 -3.455 9.143 7.524 1.00 0.00 O ATOM 811 CG2 THR A 337 -1.297 8.871 8.575 1.00 0.00 C ATOM 0 H THR A 337 -3.964 6.811 6.421 1.00 0.00 H new ATOM 0 HA THR A 337 -1.554 8.243 5.905 1.00 0.00 H new ATOM 0 HB THR A 337 -2.906 7.437 8.529 1.00 0.00 H new ATOM 0 HG1 THR A 337 -3.783 9.578 8.339 1.00 0.00 H new ATOM 0 HG21 THR A 337 -1.658 9.358 9.481 1.00 0.00 H new ATOM 0 HG22 THR A 337 -0.543 8.129 8.838 1.00 0.00 H new ATOM 0 HG23 THR A 337 -0.857 9.616 7.912 1.00 0.00 H new ATOM 819 N LYS A 338 -1.197 5.532 7.771 1.00 0.00 N ATOM 820 CA LYS A 338 -0.179 4.547 8.213 1.00 0.00 C ATOM 821 C LYS A 338 0.679 4.102 7.021 1.00 0.00 C ATOM 822 O LYS A 338 1.869 3.902 7.153 1.00 0.00 O ATOM 823 CB LYS A 338 -0.904 3.349 8.849 1.00 0.00 C ATOM 824 CG LYS A 338 -0.046 2.712 9.951 1.00 0.00 C ATOM 825 CD LYS A 338 -0.917 1.747 10.750 1.00 0.00 C ATOM 826 CE LYS A 338 -0.045 0.936 11.714 1.00 0.00 C ATOM 827 NZ LYS A 338 -0.904 0.329 12.770 1.00 0.00 N ATOM 0 H LYS A 338 -2.139 5.371 8.128 1.00 0.00 H new ATOM 0 HA LYS A 338 0.487 4.998 8.949 1.00 0.00 H new ATOM 0 HB2 LYS A 338 -1.856 3.675 9.267 1.00 0.00 H new ATOM 0 HB3 LYS A 338 -1.129 2.607 8.083 1.00 0.00 H new ATOM 0 HG2 LYS A 338 0.801 2.183 9.513 1.00 0.00 H new ATOM 0 HG3 LYS A 338 0.363 3.482 10.605 1.00 0.00 H new ATOM 0 HD2 LYS A 338 -1.672 2.301 11.307 1.00 0.00 H new ATOM 0 HD3 LYS A 338 -1.448 1.077 10.074 1.00 0.00 H new ATOM 0 HE2 LYS A 338 0.488 0.156 11.171 1.00 0.00 H new ATOM 0 HE3 LYS A 338 0.709 1.579 12.168 1.00 0.00 H new ATOM 0 HZ1 LYS A 338 -0.312 -0.222 13.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 338 -1.393 1.082 13.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 338 -1.607 -0.297 12.328 1.00 0.00 H new ATOM 841 N PHE A 339 0.100 3.959 5.856 1.00 0.00 N ATOM 842 CA PHE A 339 0.929 3.545 4.687 1.00 0.00 C ATOM 843 C PHE A 339 1.998 4.607 4.444 1.00 0.00 C ATOM 844 O PHE A 339 3.177 4.330 4.472 1.00 0.00 O ATOM 845 CB PHE A 339 0.066 3.395 3.431 1.00 0.00 C ATOM 846 CG PHE A 339 0.950 2.960 2.282 1.00 0.00 C ATOM 847 CD1 PHE A 339 1.630 3.916 1.518 1.00 0.00 C ATOM 848 CD2 PHE A 339 1.101 1.598 1.993 1.00 0.00 C ATOM 849 CE1 PHE A 339 2.460 3.510 0.461 1.00 0.00 C ATOM 850 CE2 PHE A 339 1.934 1.192 0.940 1.00 0.00 C ATOM 851 CZ PHE A 339 2.613 2.147 0.175 1.00 0.00 C ATOM 0 H PHE A 339 -0.891 4.108 5.666 1.00 0.00 H new ATOM 0 HA PHE A 339 1.390 2.581 4.903 1.00 0.00 H new ATOM 0 HB2 PHE A 339 -0.722 2.661 3.600 1.00 0.00 H new ATOM 0 HB3 PHE A 339 -0.423 4.340 3.194 1.00 0.00 H new ATOM 0 HD1 PHE A 339 1.516 4.966 1.742 1.00 0.00 H new ATOM 0 HD2 PHE A 339 0.576 0.860 2.581 1.00 0.00 H new ATOM 0 HE1 PHE A 339 2.980 4.248 -0.131 1.00 0.00 H new ATOM 0 HE2 PHE A 339 2.051 0.141 0.719 1.00 0.00 H new ATOM 0 HZ PHE A 339 3.255 1.834 -0.635 1.00 0.00 H new ATOM 861 N THR A 340 1.604 5.828 4.210 1.00 0.00 N ATOM 862 CA THR A 340 2.628 6.889 3.974 1.00 0.00 C ATOM 863 C THR A 340 3.655 6.857 5.111 1.00 0.00 C ATOM 864 O THR A 340 4.848 6.828 4.885 1.00 0.00 O ATOM 865 CB THR A 340 1.959 8.268 3.932 1.00 0.00 C ATOM 866 OG1 THR A 340 1.896 8.799 5.248 1.00 0.00 O ATOM 867 CG2 THR A 340 0.544 8.142 3.371 1.00 0.00 C ATOM 0 H THR A 340 0.632 6.136 4.172 1.00 0.00 H new ATOM 0 HA THR A 340 3.122 6.705 3.020 1.00 0.00 H new ATOM 0 HB THR A 340 2.542 8.931 3.292 1.00 0.00 H new ATOM 0 HG1 THR A 340 1.470 9.681 5.225 1.00 0.00 H new ATOM 0 HG21 THR A 340 0.074 9.125 3.344 1.00 0.00 H new ATOM 0 HG22 THR A 340 0.588 7.733 2.362 1.00 0.00 H new ATOM 0 HG23 THR A 340 -0.042 7.478 4.007 1.00 0.00 H new ATOM 875 N GLN A 341 3.194 6.854 6.332 1.00 0.00 N ATOM 876 CA GLN A 341 4.131 6.816 7.493 1.00 0.00 C ATOM 877 C GLN A 341 5.148 5.703 7.281 1.00 0.00 C ATOM 878 O GLN A 341 6.336 5.905 7.432 1.00 0.00 O ATOM 879 CB GLN A 341 3.339 6.558 8.777 1.00 0.00 C ATOM 880 CG GLN A 341 2.257 7.633 8.938 1.00 0.00 C ATOM 881 CD GLN A 341 2.897 8.942 9.405 1.00 0.00 C ATOM 882 OE1 GLN A 341 3.602 8.970 10.393 1.00 0.00 O ATOM 883 NE2 GLN A 341 2.675 10.038 8.731 1.00 0.00 N ATOM 0 H GLN A 341 2.204 6.876 6.577 1.00 0.00 H new ATOM 0 HA GLN A 341 4.652 7.770 7.578 1.00 0.00 H new ATOM 0 HB2 GLN A 341 2.881 5.569 8.742 1.00 0.00 H new ATOM 0 HB3 GLN A 341 4.008 6.569 9.637 1.00 0.00 H new ATOM 0 HG2 GLN A 341 1.740 7.787 7.991 1.00 0.00 H new ATOM 0 HG3 GLN A 341 1.509 7.305 9.660 1.00 0.00 H new ATOM 0 HE21 GLN A 341 2.083 10.015 7.901 1.00 0.00 H new ATOM 0 HE22 GLN A 341 3.094 10.917 9.035 1.00 0.00 H new ATOM 892 N TYR A 342 4.700 4.532 6.915 1.00 0.00 N ATOM 893 CA TYR A 342 5.662 3.415 6.678 1.00 0.00 C ATOM 894 C TYR A 342 6.795 3.924 5.786 1.00 0.00 C ATOM 895 O TYR A 342 7.959 3.679 6.026 1.00 0.00 O ATOM 896 CB TYR A 342 4.954 2.253 5.983 1.00 0.00 C ATOM 897 CG TYR A 342 5.953 1.152 5.757 1.00 0.00 C ATOM 898 CD1 TYR A 342 6.491 0.482 6.853 1.00 0.00 C ATOM 899 CD2 TYR A 342 6.342 0.805 4.460 1.00 0.00 C ATOM 900 CE1 TYR A 342 7.425 -0.543 6.659 1.00 0.00 C ATOM 901 CE2 TYR A 342 7.273 -0.216 4.261 1.00 0.00 C ATOM 902 CZ TYR A 342 7.817 -0.893 5.360 1.00 0.00 C ATOM 903 OH TYR A 342 8.735 -1.903 5.166 1.00 0.00 O ATOM 0 H TYR A 342 3.717 4.301 6.771 1.00 0.00 H new ATOM 0 HA TYR A 342 6.060 3.068 7.632 1.00 0.00 H new ATOM 0 HB2 TYR A 342 4.126 1.894 6.594 1.00 0.00 H new ATOM 0 HB3 TYR A 342 4.530 2.581 5.034 1.00 0.00 H new ATOM 0 HD1 TYR A 342 6.188 0.753 7.853 1.00 0.00 H new ATOM 0 HD2 TYR A 342 5.923 1.326 3.612 1.00 0.00 H new ATOM 0 HE1 TYR A 342 7.842 -1.063 7.509 1.00 0.00 H new ATOM 0 HE2 TYR A 342 7.574 -0.484 3.259 1.00 0.00 H new ATOM 0 HH TYR A 342 8.659 -2.558 5.891 1.00 0.00 H new ATOM 913 N LEU A 343 6.448 4.648 4.765 1.00 0.00 N ATOM 914 CA LEU A 343 7.485 5.211 3.856 1.00 0.00 C ATOM 915 C LEU A 343 8.193 6.358 4.569 1.00 0.00 C ATOM 916 O LEU A 343 9.398 6.506 4.473 1.00 0.00 O ATOM 917 CB LEU A 343 6.831 5.735 2.575 1.00 0.00 C ATOM 918 CG LEU A 343 6.161 4.588 1.802 1.00 0.00 C ATOM 919 CD1 LEU A 343 5.648 5.125 0.469 1.00 0.00 C ATOM 920 CD2 LEU A 343 7.173 3.468 1.525 1.00 0.00 C ATOM 0 H LEU A 343 5.486 4.877 4.517 1.00 0.00 H new ATOM 0 HA LEU A 343 8.201 4.432 3.594 1.00 0.00 H new ATOM 0 HB2 LEU A 343 6.090 6.495 2.823 1.00 0.00 H new ATOM 0 HB3 LEU A 343 7.582 6.214 1.947 1.00 0.00 H new ATOM 0 HG LEU A 343 5.340 4.190 2.398 1.00 0.00 H new ATOM 0 HD11 LEU A 343 5.170 4.319 -0.088 1.00 0.00 H new ATOM 0 HD12 LEU A 343 4.924 5.919 0.651 1.00 0.00 H new ATOM 0 HD13 LEU A 343 6.483 5.521 -0.109 1.00 0.00 H new ATOM 0 HD21 LEU A 343 6.684 2.663 0.977 1.00 0.00 H new ATOM 0 HD22 LEU A 343 7.998 3.862 0.932 1.00 0.00 H new ATOM 0 HD23 LEU A 343 7.557 3.083 2.470 1.00 0.00 H new ATOM 932 N SER A 344 7.467 7.155 5.305 1.00 0.00 N ATOM 933 CA SER A 344 8.118 8.271 6.043 1.00 0.00 C ATOM 934 C SER A 344 9.229 7.682 6.913 1.00 0.00 C ATOM 935 O SER A 344 10.009 8.395 7.513 1.00 0.00 O ATOM 936 CB SER A 344 7.088 8.982 6.925 1.00 0.00 C ATOM 937 OG SER A 344 7.598 10.254 7.306 1.00 0.00 O ATOM 0 H SER A 344 6.457 7.081 5.426 1.00 0.00 H new ATOM 0 HA SER A 344 8.532 8.996 5.342 1.00 0.00 H new ATOM 0 HB2 SER A 344 6.149 9.100 6.385 1.00 0.00 H new ATOM 0 HB3 SER A 344 6.874 8.383 7.810 1.00 0.00 H new ATOM 0 HG SER A 344 8.543 10.167 7.552 1.00 0.00 H new ATOM 943 N THR A 345 9.304 6.373 6.973 1.00 0.00 N ATOM 944 CA THR A 345 10.356 5.699 7.785 1.00 0.00 C ATOM 945 C THR A 345 11.004 4.591 6.939 1.00 0.00 C ATOM 946 O THR A 345 11.790 3.803 7.428 1.00 0.00 O ATOM 947 CB THR A 345 9.722 5.126 9.067 1.00 0.00 C ATOM 948 OG1 THR A 345 10.748 4.648 9.926 1.00 0.00 O ATOM 949 CG2 THR A 345 8.753 3.982 8.751 1.00 0.00 C ATOM 0 H THR A 345 8.671 5.739 6.486 1.00 0.00 H new ATOM 0 HA THR A 345 11.129 6.410 8.077 1.00 0.00 H new ATOM 0 HB THR A 345 9.160 5.923 9.553 1.00 0.00 H new ATOM 0 HG1 THR A 345 11.408 4.150 9.401 1.00 0.00 H new ATOM 0 HG21 THR A 345 8.324 3.602 9.678 1.00 0.00 H new ATOM 0 HG22 THR A 345 7.955 4.349 8.106 1.00 0.00 H new ATOM 0 HG23 THR A 345 9.290 3.180 8.244 1.00 0.00 H new ATOM 957 N ASN A 346 10.705 4.553 5.658 1.00 0.00 N ATOM 958 CA ASN A 346 11.326 3.527 4.756 1.00 0.00 C ATOM 959 C ASN A 346 11.634 4.191 3.407 1.00 0.00 C ATOM 960 O ASN A 346 11.044 3.866 2.395 1.00 0.00 O ATOM 961 CB ASN A 346 10.366 2.348 4.542 1.00 0.00 C ATOM 962 CG ASN A 346 11.137 1.161 3.961 1.00 0.00 C ATOM 963 OD1 ASN A 346 11.875 0.499 4.664 1.00 0.00 O ATOM 964 ND2 ASN A 346 10.996 0.862 2.698 1.00 0.00 N ATOM 0 H ASN A 346 10.055 5.191 5.198 1.00 0.00 H new ATOM 0 HA ASN A 346 12.241 3.147 5.211 1.00 0.00 H new ATOM 0 HB2 ASN A 346 9.902 2.066 5.487 1.00 0.00 H new ATOM 0 HB3 ASN A 346 9.561 2.638 3.866 1.00 0.00 H new ATOM 0 HD21 ASN A 346 11.505 0.073 2.301 1.00 0.00 H new ATOM 0 HD22 ASN A 346 10.376 1.418 2.108 1.00 0.00 H new ATOM 971 N PRO A 347 12.554 5.126 3.407 1.00 0.00 N ATOM 972 CA PRO A 347 12.964 5.877 2.181 1.00 0.00 C ATOM 973 C PRO A 347 13.185 4.971 0.965 1.00 0.00 C ATOM 974 O PRO A 347 12.823 5.316 -0.140 1.00 0.00 O ATOM 975 CB PRO A 347 14.277 6.548 2.600 1.00 0.00 C ATOM 976 CG PRO A 347 14.143 6.753 4.071 1.00 0.00 C ATOM 977 CD PRO A 347 13.314 5.572 4.589 1.00 0.00 C ATOM 0 HA PRO A 347 12.190 6.575 1.862 1.00 0.00 H new ATOM 0 HB2 PRO A 347 15.136 5.920 2.364 1.00 0.00 H new ATOM 0 HB3 PRO A 347 14.422 7.495 2.080 1.00 0.00 H new ATOM 0 HG2 PRO A 347 15.121 6.783 4.551 1.00 0.00 H new ATOM 0 HG3 PRO A 347 13.651 7.701 4.290 1.00 0.00 H new ATOM 0 HD2 PRO A 347 13.951 4.777 4.978 1.00 0.00 H new ATOM 0 HD3 PRO A 347 12.651 5.874 5.399 1.00 0.00 H new ATOM 985 N ALA A 348 13.791 3.828 1.165 1.00 0.00 N ATOM 986 CA ALA A 348 14.063 2.892 0.026 1.00 0.00 C ATOM 987 C ALA A 348 12.879 2.871 -0.947 1.00 0.00 C ATOM 988 O ALA A 348 13.033 3.086 -2.135 1.00 0.00 O ATOM 989 CB ALA A 348 14.296 1.482 0.573 1.00 0.00 C ATOM 0 H ALA A 348 14.112 3.499 2.075 1.00 0.00 H new ATOM 0 HA ALA A 348 14.949 3.236 -0.507 1.00 0.00 H new ATOM 0 HB1 ALA A 348 14.494 0.799 -0.253 1.00 0.00 H new ATOM 0 HB2 ALA A 348 15.151 1.491 1.249 1.00 0.00 H new ATOM 0 HB3 ALA A 348 13.409 1.150 1.113 1.00 0.00 H new ATOM 995 N LEU A 349 11.697 2.628 -0.460 1.00 0.00 N ATOM 996 CA LEU A 349 10.521 2.610 -1.374 1.00 0.00 C ATOM 997 C LEU A 349 10.219 4.051 -1.804 1.00 0.00 C ATOM 998 O LEU A 349 10.030 4.340 -2.969 1.00 0.00 O ATOM 999 CB LEU A 349 9.296 2.030 -0.638 1.00 0.00 C ATOM 1000 CG LEU A 349 9.206 0.506 -0.799 1.00 0.00 C ATOM 1001 CD1 LEU A 349 8.013 0.004 0.025 1.00 0.00 C ATOM 1002 CD2 LEU A 349 9.014 0.118 -2.283 1.00 0.00 C ATOM 0 H LEU A 349 11.493 2.442 0.522 1.00 0.00 H new ATOM 0 HA LEU A 349 10.738 1.992 -2.245 1.00 0.00 H new ATOM 0 HB2 LEU A 349 9.355 2.281 0.421 1.00 0.00 H new ATOM 0 HB3 LEU A 349 8.387 2.491 -1.025 1.00 0.00 H new ATOM 0 HG LEU A 349 10.132 0.050 -0.449 1.00 0.00 H new ATOM 0 HD11 LEU A 349 7.931 -1.078 -0.076 1.00 0.00 H new ATOM 0 HD12 LEU A 349 8.162 0.261 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 349 7.098 0.472 -0.337 1.00 0.00 H new ATOM 0 HD21 LEU A 349 8.953 -0.967 -2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 349 8.094 0.565 -2.660 1.00 0.00 H new ATOM 0 HD23 LEU A 349 9.859 0.482 -2.867 1.00 0.00 H new ATOM 1014 N GLN A 350 10.156 4.946 -0.857 1.00 0.00 N ATOM 1015 CA GLN A 350 9.849 6.366 -1.166 1.00 0.00 C ATOM 1016 C GLN A 350 10.612 6.830 -2.417 1.00 0.00 C ATOM 1017 O GLN A 350 10.060 7.501 -3.267 1.00 0.00 O ATOM 1018 CB GLN A 350 10.238 7.222 0.051 1.00 0.00 C ATOM 1019 CG GLN A 350 9.292 8.414 0.176 1.00 0.00 C ATOM 1020 CD GLN A 350 9.800 9.364 1.261 1.00 0.00 C ATOM 1021 OE1 GLN A 350 9.982 10.540 1.019 1.00 0.00 O ATOM 1022 NE2 GLN A 350 10.040 8.900 2.457 1.00 0.00 N ATOM 0 H GLN A 350 10.307 4.748 0.132 1.00 0.00 H new ATOM 0 HA GLN A 350 8.784 6.475 -1.373 1.00 0.00 H new ATOM 0 HB2 GLN A 350 10.198 6.619 0.958 1.00 0.00 H new ATOM 0 HB3 GLN A 350 11.265 7.572 -0.054 1.00 0.00 H new ATOM 0 HG2 GLN A 350 9.224 8.938 -0.777 1.00 0.00 H new ATOM 0 HG3 GLN A 350 8.288 8.069 0.422 1.00 0.00 H new ATOM 0 HE21 GLN A 350 9.887 7.912 2.661 1.00 0.00 H new ATOM 0 HE22 GLN A 350 10.380 9.525 3.188 1.00 0.00 H new ATOM 1031 N ARG A 351 11.870 6.495 -2.542 1.00 0.00 N ATOM 1032 CA ARG A 351 12.625 6.949 -3.747 1.00 0.00 C ATOM 1033 C ARG A 351 12.155 6.171 -4.983 1.00 0.00 C ATOM 1034 O ARG A 351 12.138 6.698 -6.077 1.00 0.00 O ATOM 1035 CB ARG A 351 14.134 6.764 -3.539 1.00 0.00 C ATOM 1036 CG ARG A 351 14.418 5.342 -3.078 1.00 0.00 C ATOM 1037 CD ARG A 351 15.906 5.022 -3.254 1.00 0.00 C ATOM 1038 NE ARG A 351 16.724 6.177 -2.792 1.00 0.00 N ATOM 1039 CZ ARG A 351 17.995 6.015 -2.539 1.00 0.00 C ATOM 1040 NH1 ARG A 351 18.545 4.839 -2.685 1.00 0.00 N ATOM 1041 NH2 ARG A 351 18.714 7.026 -2.138 1.00 0.00 N ATOM 0 H ARG A 351 12.400 5.936 -1.874 1.00 0.00 H new ATOM 0 HA ARG A 351 12.430 8.010 -3.903 1.00 0.00 H new ATOM 0 HB2 ARG A 351 14.667 6.969 -4.468 1.00 0.00 H new ATOM 0 HB3 ARG A 351 14.499 7.476 -2.799 1.00 0.00 H new ATOM 0 HG2 ARG A 351 14.134 5.226 -2.032 1.00 0.00 H new ATOM 0 HG3 ARG A 351 13.816 4.638 -3.652 1.00 0.00 H new ATOM 0 HD2 ARG A 351 16.166 4.129 -2.686 1.00 0.00 H new ATOM 0 HD3 ARG A 351 16.121 4.807 -4.301 1.00 0.00 H new ATOM 0 HE ARG A 351 16.292 7.094 -2.673 1.00 0.00 H new ATOM 0 HH11 ARG A 351 17.982 4.048 -2.997 1.00 0.00 H new ATOM 0 HH12 ARG A 351 19.538 4.712 -2.488 1.00 0.00 H new ATOM 0 HH21 ARG A 351 18.284 7.944 -2.022 1.00 0.00 H new ATOM 0 HH22 ARG A 351 19.707 6.899 -1.940 1.00 0.00 H new ATOM 1055 N ILE A 352 11.759 4.930 -4.833 1.00 0.00 N ATOM 1056 CA ILE A 352 11.285 4.169 -6.031 1.00 0.00 C ATOM 1057 C ILE A 352 9.854 4.604 -6.369 1.00 0.00 C ATOM 1058 O ILE A 352 9.585 5.091 -7.449 1.00 0.00 O ATOM 1059 CB ILE A 352 11.309 2.657 -5.752 1.00 0.00 C ATOM 1060 CG1 ILE A 352 12.755 2.193 -5.563 1.00 0.00 C ATOM 1061 CG2 ILE A 352 10.702 1.905 -6.944 1.00 0.00 C ATOM 1062 CD1 ILE A 352 12.772 0.743 -5.077 1.00 0.00 C ATOM 0 H ILE A 352 11.743 4.419 -3.950 1.00 0.00 H new ATOM 0 HA ILE A 352 11.947 4.380 -6.871 1.00 0.00 H new ATOM 0 HB ILE A 352 10.732 2.452 -4.850 1.00 0.00 H new ATOM 0 HG12 ILE A 352 13.300 2.278 -6.503 1.00 0.00 H new ATOM 0 HG13 ILE A 352 13.262 2.834 -4.842 1.00 0.00 H new ATOM 0 HG21 ILE A 352 10.719 0.833 -6.745 1.00 0.00 H new ATOM 0 HG22 ILE A 352 9.672 2.230 -7.093 1.00 0.00 H new ATOM 0 HG23 ILE A 352 11.283 2.117 -7.842 1.00 0.00 H new ATOM 0 HD11 ILE A 352 13.803 0.416 -4.944 1.00 0.00 H new ATOM 0 HD12 ILE A 352 12.243 0.672 -4.127 1.00 0.00 H new ATOM 0 HD13 ILE A 352 12.282 0.107 -5.814 1.00 0.00 H new ATOM 1074 N ILE A 353 8.934 4.435 -5.457 1.00 0.00 N ATOM 1075 CA ILE A 353 7.528 4.838 -5.737 1.00 0.00 C ATOM 1076 C ILE A 353 7.496 6.314 -6.142 1.00 0.00 C ATOM 1077 O ILE A 353 8.458 7.036 -5.970 1.00 0.00 O ATOM 1078 CB ILE A 353 6.674 4.619 -4.477 1.00 0.00 C ATOM 1079 CG1 ILE A 353 7.162 5.535 -3.321 1.00 0.00 C ATOM 1080 CG2 ILE A 353 6.779 3.146 -4.056 1.00 0.00 C ATOM 1081 CD1 ILE A 353 6.289 6.799 -3.227 1.00 0.00 C ATOM 0 H ILE A 353 9.096 4.036 -4.532 1.00 0.00 H new ATOM 0 HA ILE A 353 7.125 4.235 -6.550 1.00 0.00 H new ATOM 0 HB ILE A 353 5.636 4.870 -4.697 1.00 0.00 H new ATOM 0 HG12 ILE A 353 7.125 4.990 -2.378 1.00 0.00 H new ATOM 0 HG13 ILE A 353 8.202 5.816 -3.487 1.00 0.00 H new ATOM 0 HG21 ILE A 353 6.177 2.979 -3.163 1.00 0.00 H new ATOM 0 HG22 ILE A 353 6.415 2.510 -4.863 1.00 0.00 H new ATOM 0 HG23 ILE A 353 7.820 2.902 -3.843 1.00 0.00 H new ATOM 0 HD11 ILE A 353 6.646 7.428 -2.412 1.00 0.00 H new ATOM 0 HD12 ILE A 353 6.347 7.352 -4.164 1.00 0.00 H new ATOM 0 HD13 ILE A 353 5.254 6.513 -3.038 1.00 0.00 H new