USER MOD reduce.3.24.130724 H: found=0, std=0, add=647, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 635 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 417 HIS : no HD1:sc= -0.786 K(o=-1.9,f=-2.5) USER MOD Set 1.2: A 421 CYS SG : rot -90:sc= 0.713 USER MOD Set 1.3: A 426 CYS SG : rot 152:sc= -0.682 USER MOD Set 1.4: A 429 CYS SG : rot 167:sc= -1.17! USER MOD Set 2.1: A 416 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 420 ASN : amide:sc= 0.929 K(o=0.93,f=0) USER MOD Set 3.1: A 393 HIS :FLIP no HE2:sc= -0.493 F(o=-1.4,f=-0.32) USER MOD Set 3.2: A 397 CYS SG : rot 137:sc= 0.155 USER MOD Set 3.3: A 403 CYS SG : rot 130:sc= -0.302 USER MOD Set 3.4: A 408 CYS SG : rot 80:sc= 0.322 USER MOD Set 4.1: A 362 HIS :FLIP no HD1:sc= 0.25 F(o=-3.3,f=-1.1) USER MOD Set 4.2: A 366 CYS SG : rot -160:sc= -1.17 USER MOD Set 4.3: A 384 CYS SG : rot 85:sc= -0.491 USER MOD Set 4.4: A 388 LYS NZ :NH3+ -177:sc= 0.312 (180deg=-0.0435) USER MOD Single : A 349 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 351 LYS NZ :NH3+ 169:sc= 1.29 (180deg=1.1) USER MOD Single : A 354 GLN : amide:sc= 0.297 X(o=0.3,f=0) USER MOD Single : A 355 GLN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 356 GLN : amide:sc= -0.0593 X(o=-0.059,f=-0.059) USER MOD Single : A 364 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 365 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 367 GLN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : A 371 GLN : amide:sc= 0.966 K(o=0.97,f=-6.6!) USER MOD Single : A 383 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.16) USER MOD Single : A 386 THR OG1 : rot 180:sc= 0 USER MOD Single : A 387 MET CE :methyl 163:sc= -0.263 (180deg=-0.805) USER MOD Single : A 389 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 394 MET CE :methyl 169:sc= -0.53 (180deg=-0.561) USER MOD Single : A 395 THR OG1 : rot -26:sc= 0.636 USER MOD Single : A 396 HIS : no HD1:sc=-0.00642 X(o=-0.0064,f=-0.0064) USER MOD Single : A 398 GLN : amide:sc= 0 X(o=0,f=-0.26) USER MOD Single : A 401 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 404 GLN : amide:sc= 0.527 K(o=0.53,f=-0.008) USER MOD Single : A 407 HIS : no HD1:sc= -0.297 X(o=-0.3,f=-0.035) USER MOD Single : A 410 SER OG : rot 83:sc= 0.703 USER MOD Single : A 411 SER OG : rot 93:sc= 0.36 USER MOD Single : A 413 GLN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 419 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00822) USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 424 HIS : no HE2:sc= 0.557 K(o=0.56,f=-3!) USER MOD ----------------------------------------------------------------- ATOM 84 N PRO A 347 3.432 -15.890 15.397 1.00 0.00 N ATOM 85 CA PRO A 347 3.224 -14.473 15.692 1.00 0.00 C ATOM 86 C PRO A 347 4.182 -13.475 15.031 1.00 0.00 C ATOM 87 O PRO A 347 3.734 -12.394 14.673 1.00 0.00 O ATOM 88 CB PRO A 347 3.261 -14.347 17.217 1.00 0.00 C ATOM 89 CG PRO A 347 2.847 -15.736 17.696 1.00 0.00 C ATOM 90 CD PRO A 347 3.445 -16.658 16.635 1.00 0.00 C ATOM 0 HA PRO A 347 2.268 -14.188 15.253 1.00 0.00 H new ATOM 0 HB2 PRO A 347 4.255 -14.078 17.574 1.00 0.00 H new ATOM 0 HB3 PRO A 347 2.576 -13.578 17.574 1.00 0.00 H new ATOM 0 HG2 PRO A 347 3.241 -15.954 18.689 1.00 0.00 H new ATOM 0 HG3 PRO A 347 1.763 -15.837 17.754 1.00 0.00 H new ATOM 0 HD2 PRO A 347 4.459 -16.956 16.901 1.00 0.00 H new ATOM 0 HD3 PRO A 347 2.860 -17.572 16.535 1.00 0.00 H new ATOM 98 N GLU A 348 5.456 -13.802 14.800 1.00 0.00 N ATOM 99 CA GLU A 348 6.393 -12.908 14.090 1.00 0.00 C ATOM 100 C GLU A 348 5.973 -12.769 12.624 1.00 0.00 C ATOM 101 O GLU A 348 5.996 -11.677 12.054 1.00 0.00 O ATOM 102 CB GLU A 348 7.832 -13.449 14.108 1.00 0.00 C ATOM 103 CG GLU A 348 8.469 -13.619 15.496 1.00 0.00 C ATOM 104 CD GLU A 348 9.079 -12.304 16.015 1.00 0.00 C ATOM 105 OE1 GLU A 348 8.317 -11.360 16.332 1.00 0.00 O ATOM 106 OE2 GLU A 348 10.327 -12.205 16.118 1.00 0.00 O ATOM 0 H GLU A 348 5.871 -14.686 15.095 1.00 0.00 H new ATOM 0 HA GLU A 348 6.363 -11.948 14.605 1.00 0.00 H new ATOM 0 HB2 GLU A 348 7.842 -14.416 13.604 1.00 0.00 H new ATOM 0 HB3 GLU A 348 8.459 -12.777 13.522 1.00 0.00 H new ATOM 0 HG2 GLU A 348 7.715 -13.972 16.200 1.00 0.00 H new ATOM 0 HG3 GLU A 348 9.244 -14.384 15.448 1.00 0.00 H new ATOM 113 N LYS A 349 5.508 -13.870 12.025 1.00 0.00 N ATOM 114 CA LYS A 349 4.986 -13.878 10.660 1.00 0.00 C ATOM 115 C LYS A 349 3.741 -13.006 10.609 1.00 0.00 C ATOM 116 O LYS A 349 3.701 -12.139 9.753 1.00 0.00 O ATOM 117 CB LYS A 349 4.743 -15.301 10.132 1.00 0.00 C ATOM 118 CG LYS A 349 6.062 -15.941 9.677 1.00 0.00 C ATOM 119 CD LYS A 349 5.819 -17.283 8.974 1.00 0.00 C ATOM 120 CE LYS A 349 7.144 -17.813 8.415 1.00 0.00 C ATOM 121 NZ LYS A 349 6.954 -19.098 7.699 1.00 0.00 N ATOM 0 H LYS A 349 5.484 -14.784 12.478 1.00 0.00 H new ATOM 0 HA LYS A 349 5.734 -13.459 9.987 1.00 0.00 H new ATOM 0 HB2 LYS A 349 4.286 -15.911 10.912 1.00 0.00 H new ATOM 0 HB3 LYS A 349 4.041 -15.271 9.299 1.00 0.00 H new ATOM 0 HG2 LYS A 349 6.583 -15.263 9.001 1.00 0.00 H new ATOM 0 HG3 LYS A 349 6.711 -16.092 10.539 1.00 0.00 H new ATOM 0 HD2 LYS A 349 5.394 -18.001 9.675 1.00 0.00 H new ATOM 0 HD3 LYS A 349 5.096 -17.158 8.168 1.00 0.00 H new ATOM 0 HE2 LYS A 349 7.575 -17.077 7.736 1.00 0.00 H new ATOM 0 HE3 LYS A 349 7.855 -17.950 9.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 349 7.869 -19.430 7.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 349 6.566 -19.806 8.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 349 6.294 -18.960 6.907 1.00 0.00 H new ATOM 135 N ARG A 350 2.781 -13.139 11.535 1.00 0.00 N ATOM 136 CA ARG A 350 1.577 -12.273 11.592 1.00 0.00 C ATOM 137 C ARG A 350 1.911 -10.795 11.385 1.00 0.00 C ATOM 138 O ARG A 350 1.466 -10.219 10.391 1.00 0.00 O ATOM 139 CB ARG A 350 0.782 -12.468 12.905 1.00 0.00 C ATOM 140 CG ARG A 350 0.246 -13.880 13.192 1.00 0.00 C ATOM 141 CD ARG A 350 -0.569 -14.492 12.048 1.00 0.00 C ATOM 142 NE ARG A 350 -1.652 -13.600 11.564 1.00 0.00 N ATOM 143 CZ ARG A 350 -2.803 -13.333 12.162 1.00 0.00 C ATOM 144 NH1 ARG A 350 -3.156 -13.907 13.277 1.00 0.00 N ATOM 145 NH2 ARG A 350 -3.636 -12.473 11.648 1.00 0.00 N ATOM 0 H ARG A 350 2.810 -13.847 12.269 1.00 0.00 H new ATOM 0 HA ARG A 350 0.943 -12.589 10.763 1.00 0.00 H new ATOM 0 HB2 ARG A 350 1.423 -12.173 13.736 1.00 0.00 H new ATOM 0 HB3 ARG A 350 -0.063 -11.780 12.895 1.00 0.00 H new ATOM 0 HG2 ARG A 350 1.087 -14.537 13.414 1.00 0.00 H new ATOM 0 HG3 ARG A 350 -0.376 -13.845 14.087 1.00 0.00 H new ATOM 0 HD2 ARG A 350 0.099 -14.726 11.219 1.00 0.00 H new ATOM 0 HD3 ARG A 350 -1.004 -15.434 12.383 1.00 0.00 H new ATOM 0 HE ARG A 350 -1.491 -13.140 10.668 1.00 0.00 H new ATOM 0 HH11 ARG A 350 -2.538 -14.587 13.718 1.00 0.00 H new ATOM 0 HH12 ARG A 350 -4.051 -13.676 13.709 1.00 0.00 H new ATOM 0 HH21 ARG A 350 -3.404 -11.997 10.776 1.00 0.00 H new ATOM 0 HH22 ARG A 350 -4.520 -12.276 12.118 1.00 0.00 H new ATOM 159 N LYS A 351 2.694 -10.209 12.294 1.00 0.00 N ATOM 160 CA LYS A 351 3.116 -8.792 12.268 1.00 0.00 C ATOM 161 C LYS A 351 3.931 -8.429 11.030 1.00 0.00 C ATOM 162 O LYS A 351 3.515 -7.535 10.290 1.00 0.00 O ATOM 163 CB LYS A 351 3.867 -8.356 13.552 1.00 0.00 C ATOM 164 CG LYS A 351 4.368 -9.509 14.424 1.00 0.00 C ATOM 165 CD LYS A 351 5.395 -9.098 15.479 1.00 0.00 C ATOM 166 CE LYS A 351 5.283 -10.034 16.690 1.00 0.00 C ATOM 167 NZ LYS A 351 6.420 -9.862 17.624 1.00 0.00 N ATOM 0 H LYS A 351 3.067 -10.717 13.096 1.00 0.00 H new ATOM 0 HA LYS A 351 2.182 -8.232 12.224 1.00 0.00 H new ATOM 0 HB2 LYS A 351 4.718 -7.738 13.266 1.00 0.00 H new ATOM 0 HB3 LYS A 351 3.204 -7.729 14.149 1.00 0.00 H new ATOM 0 HG2 LYS A 351 3.515 -9.969 14.923 1.00 0.00 H new ATOM 0 HG3 LYS A 351 4.809 -10.270 13.781 1.00 0.00 H new ATOM 0 HD2 LYS A 351 6.401 -9.144 15.061 1.00 0.00 H new ATOM 0 HD3 LYS A 351 5.225 -8.066 15.786 1.00 0.00 H new ATOM 0 HE2 LYS A 351 4.348 -9.839 17.215 1.00 0.00 H new ATOM 0 HE3 LYS A 351 5.246 -11.068 16.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 351 6.220 -10.367 18.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 351 7.285 -10.248 17.193 1.00 0.00 H new ATOM 0 HZ3 LYS A 351 6.555 -8.850 17.824 1.00 0.00 H new ATOM 181 N LEU A 352 5.062 -9.097 10.769 1.00 0.00 N ATOM 182 CA LEU A 352 5.857 -8.756 9.590 1.00 0.00 C ATOM 183 C LEU A 352 5.167 -8.998 8.236 1.00 0.00 C ATOM 184 O LEU A 352 5.205 -8.110 7.389 1.00 0.00 O ATOM 185 CB LEU A 352 7.322 -9.224 9.677 1.00 0.00 C ATOM 186 CG LEU A 352 7.986 -9.298 11.069 1.00 0.00 C ATOM 187 CD1 LEU A 352 9.290 -10.092 11.002 1.00 0.00 C ATOM 188 CD2 LEU A 352 8.303 -7.888 11.571 1.00 0.00 C ATOM 0 H LEU A 352 5.436 -9.854 11.341 1.00 0.00 H new ATOM 0 HA LEU A 352 5.921 -7.668 9.617 1.00 0.00 H new ATOM 0 HB2 LEU A 352 7.382 -10.215 9.227 1.00 0.00 H new ATOM 0 HB3 LEU A 352 7.921 -8.557 9.058 1.00 0.00 H new ATOM 0 HG LEU A 352 7.292 -9.793 11.748 1.00 0.00 H new ATOM 0 HD11 LEU A 352 9.743 -10.133 11.993 1.00 0.00 H new ATOM 0 HD12 LEU A 352 9.082 -11.105 10.656 1.00 0.00 H new ATOM 0 HD13 LEU A 352 9.977 -9.606 10.309 1.00 0.00 H new ATOM 0 HD21 LEU A 352 8.771 -7.948 12.553 1.00 0.00 H new ATOM 0 HD22 LEU A 352 8.983 -7.398 10.874 1.00 0.00 H new ATOM 0 HD23 LEU A 352 7.381 -7.312 11.643 1.00 0.00 H new ATOM 200 N ILE A 353 4.479 -10.125 8.024 1.00 0.00 N ATOM 201 CA ILE A 353 3.773 -10.422 6.762 1.00 0.00 C ATOM 202 C ILE A 353 2.649 -9.412 6.504 1.00 0.00 C ATOM 203 O ILE A 353 2.559 -8.842 5.407 1.00 0.00 O ATOM 204 CB ILE A 353 3.302 -11.906 6.741 1.00 0.00 C ATOM 205 CG1 ILE A 353 3.483 -12.554 5.358 1.00 0.00 C ATOM 206 CG2 ILE A 353 1.864 -12.162 7.246 1.00 0.00 C ATOM 207 CD1 ILE A 353 3.512 -14.088 5.423 1.00 0.00 C ATOM 0 H ILE A 353 4.393 -10.863 8.723 1.00 0.00 H new ATOM 0 HA ILE A 353 4.464 -10.307 5.927 1.00 0.00 H new ATOM 0 HB ILE A 353 3.964 -12.381 7.466 1.00 0.00 H new ATOM 0 HG12 ILE A 353 2.671 -12.237 4.704 1.00 0.00 H new ATOM 0 HG13 ILE A 353 4.411 -12.195 4.912 1.00 0.00 H new ATOM 0 HG21 ILE A 353 1.642 -13.228 7.187 1.00 0.00 H new ATOM 0 HG22 ILE A 353 1.777 -11.830 8.280 1.00 0.00 H new ATOM 0 HG23 ILE A 353 1.157 -11.610 6.627 1.00 0.00 H new ATOM 0 HD11 ILE A 353 3.642 -14.492 4.419 1.00 0.00 H new ATOM 0 HD12 ILE A 353 4.341 -14.410 6.054 1.00 0.00 H new ATOM 0 HD13 ILE A 353 2.574 -14.452 5.842 1.00 0.00 H new ATOM 219 N GLN A 354 1.822 -9.141 7.526 1.00 0.00 N ATOM 220 CA GLN A 354 0.733 -8.177 7.356 1.00 0.00 C ATOM 221 C GLN A 354 1.248 -6.752 7.143 1.00 0.00 C ATOM 222 O GLN A 354 0.686 -6.037 6.319 1.00 0.00 O ATOM 223 CB GLN A 354 -0.307 -8.251 8.489 1.00 0.00 C ATOM 224 CG GLN A 354 0.071 -7.525 9.789 1.00 0.00 C ATOM 225 CD GLN A 354 -0.969 -7.748 10.882 1.00 0.00 C ATOM 226 OE1 GLN A 354 -1.747 -6.874 11.240 1.00 0.00 O ATOM 227 NE2 GLN A 354 -1.019 -8.936 11.445 1.00 0.00 N ATOM 0 H GLN A 354 1.885 -9.564 8.452 1.00 0.00 H new ATOM 0 HA GLN A 354 0.214 -8.465 6.442 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -1.246 -7.836 8.123 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -0.491 -9.300 8.721 1.00 0.00 H new ATOM 0 HG2 GLN A 354 1.043 -7.878 10.134 1.00 0.00 H new ATOM 0 HG3 GLN A 354 0.171 -6.457 9.594 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -0.373 -9.668 11.150 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -1.704 -9.125 12.176 1.00 0.00 H new ATOM 236 N GLN A 355 2.323 -6.327 7.819 1.00 0.00 N ATOM 237 CA GLN A 355 2.828 -4.965 7.662 1.00 0.00 C ATOM 238 C GLN A 355 3.508 -4.785 6.301 1.00 0.00 C ATOM 239 O GLN A 355 3.367 -3.739 5.676 1.00 0.00 O ATOM 240 CB GLN A 355 3.741 -4.633 8.838 1.00 0.00 C ATOM 241 CG GLN A 355 4.335 -3.216 8.788 1.00 0.00 C ATOM 242 CD GLN A 355 5.189 -2.897 10.017 1.00 0.00 C ATOM 243 OE1 GLN A 355 6.042 -3.667 10.441 1.00 0.00 O ATOM 244 NE2 GLN A 355 5.004 -1.751 10.639 1.00 0.00 N ATOM 0 H GLN A 355 2.853 -6.903 8.473 1.00 0.00 H new ATOM 0 HA GLN A 355 2.000 -4.256 7.674 1.00 0.00 H new ATOM 0 HB2 GLN A 355 3.179 -4.748 9.765 1.00 0.00 H new ATOM 0 HB3 GLN A 355 4.556 -5.357 8.868 1.00 0.00 H new ATOM 0 HG2 GLN A 355 4.943 -3.112 7.889 1.00 0.00 H new ATOM 0 HG3 GLN A 355 3.527 -2.489 8.712 1.00 0.00 H new ATOM 0 HE21 GLN A 355 4.299 -1.096 10.302 1.00 0.00 H new ATOM 0 HE22 GLN A 355 5.566 -1.519 11.458 1.00 0.00 H new ATOM 253 N GLN A 356 4.209 -5.815 5.821 1.00 0.00 N ATOM 254 CA GLN A 356 4.909 -5.817 4.536 1.00 0.00 C ATOM 255 C GLN A 356 3.879 -5.607 3.426 1.00 0.00 C ATOM 256 O GLN A 356 3.976 -4.664 2.646 1.00 0.00 O ATOM 257 CB GLN A 356 5.490 -7.217 4.327 1.00 0.00 C ATOM 258 CG GLN A 356 6.900 -7.343 4.912 1.00 0.00 C ATOM 259 CD GLN A 356 7.957 -6.553 4.143 1.00 0.00 C ATOM 260 OE1 GLN A 356 8.310 -6.870 3.015 1.00 0.00 O ATOM 261 NE2 GLN A 356 8.519 -5.512 4.719 1.00 0.00 N ATOM 0 H GLN A 356 4.307 -6.694 6.330 1.00 0.00 H new ATOM 0 HA GLN A 356 5.678 -5.044 4.521 1.00 0.00 H new ATOM 0 HB2 GLN A 356 4.836 -7.955 4.793 1.00 0.00 H new ATOM 0 HB3 GLN A 356 5.518 -7.443 3.261 1.00 0.00 H new ATOM 0 HG2 GLN A 356 6.886 -7.002 5.947 1.00 0.00 H new ATOM 0 HG3 GLN A 356 7.185 -8.395 4.927 1.00 0.00 H new ATOM 0 HE21 GLN A 356 8.236 -5.235 5.659 1.00 0.00 H new ATOM 0 HE22 GLN A 356 9.238 -4.982 4.226 1.00 0.00 H new ATOM 270 N LEU A 357 2.869 -6.488 3.393 1.00 0.00 N ATOM 271 CA LEU A 357 1.771 -6.460 2.434 1.00 0.00 C ATOM 272 C LEU A 357 1.006 -5.122 2.533 1.00 0.00 C ATOM 273 O LEU A 357 0.847 -4.440 1.525 1.00 0.00 O ATOM 274 CB LEU A 357 0.961 -7.737 2.734 1.00 0.00 C ATOM 275 CG LEU A 357 -0.162 -8.080 1.749 1.00 0.00 C ATOM 276 CD1 LEU A 357 -0.633 -9.525 1.929 1.00 0.00 C ATOM 277 CD2 LEU A 357 -1.338 -7.161 2.030 1.00 0.00 C ATOM 0 H LEU A 357 2.798 -7.260 4.055 1.00 0.00 H new ATOM 0 HA LEU A 357 2.077 -6.481 1.388 1.00 0.00 H new ATOM 0 HB2 LEU A 357 1.652 -8.579 2.770 1.00 0.00 H new ATOM 0 HB3 LEU A 357 0.525 -7.639 3.728 1.00 0.00 H new ATOM 0 HG LEU A 357 0.213 -7.956 0.733 1.00 0.00 H new ATOM 0 HD11 LEU A 357 -1.430 -9.739 1.217 1.00 0.00 H new ATOM 0 HD12 LEU A 357 0.202 -10.204 1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 357 -1.007 -9.662 2.944 1.00 0.00 H new ATOM 0 HD21 LEU A 357 -2.150 -7.388 1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 357 -1.680 -7.311 3.054 1.00 0.00 H new ATOM 0 HD23 LEU A 357 -1.029 -6.124 1.899 1.00 0.00 H new ATOM 289 N VAL A 358 0.571 -4.689 3.722 1.00 0.00 N ATOM 290 CA VAL A 358 -0.148 -3.407 3.907 1.00 0.00 C ATOM 291 C VAL A 358 0.668 -2.194 3.426 1.00 0.00 C ATOM 292 O VAL A 358 0.112 -1.296 2.790 1.00 0.00 O ATOM 293 CB VAL A 358 -0.572 -3.241 5.383 1.00 0.00 C ATOM 294 CG1 VAL A 358 -1.063 -1.830 5.741 1.00 0.00 C ATOM 295 CG2 VAL A 358 -1.705 -4.219 5.743 1.00 0.00 C ATOM 0 H VAL A 358 0.704 -5.212 4.588 1.00 0.00 H new ATOM 0 HA VAL A 358 -1.041 -3.443 3.283 1.00 0.00 H new ATOM 0 HB VAL A 358 0.336 -3.445 5.951 1.00 0.00 H new ATOM 0 HG11 VAL A 358 -1.341 -1.798 6.794 1.00 0.00 H new ATOM 0 HG12 VAL A 358 -0.267 -1.109 5.554 1.00 0.00 H new ATOM 0 HG13 VAL A 358 -1.930 -1.580 5.129 1.00 0.00 H new ATOM 0 HG21 VAL A 358 -1.986 -4.082 6.787 1.00 0.00 H new ATOM 0 HG22 VAL A 358 -2.569 -4.025 5.107 1.00 0.00 H new ATOM 0 HG23 VAL A 358 -1.364 -5.243 5.590 1.00 0.00 H new ATOM 305 N LEU A 359 1.983 -2.164 3.665 1.00 0.00 N ATOM 306 CA LEU A 359 2.856 -1.064 3.233 1.00 0.00 C ATOM 307 C LEU A 359 3.155 -1.127 1.730 1.00 0.00 C ATOM 308 O LEU A 359 3.306 -0.086 1.100 1.00 0.00 O ATOM 309 CB LEU A 359 4.162 -1.038 4.038 1.00 0.00 C ATOM 310 CG LEU A 359 4.039 -0.557 5.496 1.00 0.00 C ATOM 311 CD1 LEU A 359 5.401 -0.684 6.181 1.00 0.00 C ATOM 312 CD2 LEU A 359 3.608 0.908 5.597 1.00 0.00 C ATOM 0 H LEU A 359 2.475 -2.904 4.165 1.00 0.00 H new ATOM 0 HA LEU A 359 2.314 -0.138 3.426 1.00 0.00 H new ATOM 0 HB2 LEU A 359 4.586 -2.042 4.041 1.00 0.00 H new ATOM 0 HB3 LEU A 359 4.873 -0.394 3.521 1.00 0.00 H new ATOM 0 HG LEU A 359 3.280 -1.177 5.973 1.00 0.00 H new ATOM 0 HD11 LEU A 359 5.322 -0.345 7.214 1.00 0.00 H new ATOM 0 HD12 LEU A 359 5.721 -1.726 6.164 1.00 0.00 H new ATOM 0 HD13 LEU A 359 6.132 -0.072 5.653 1.00 0.00 H new ATOM 0 HD21 LEU A 359 3.537 1.195 6.646 1.00 0.00 H new ATOM 0 HD22 LEU A 359 4.343 1.539 5.097 1.00 0.00 H new ATOM 0 HD23 LEU A 359 2.636 1.035 5.120 1.00 0.00 H new ATOM 324 N LEU A 360 3.178 -2.321 1.138 1.00 0.00 N ATOM 325 CA LEU A 360 3.304 -2.532 -0.307 1.00 0.00 C ATOM 326 C LEU A 360 2.095 -1.941 -1.030 1.00 0.00 C ATOM 327 O LEU A 360 2.227 -1.233 -2.029 1.00 0.00 O ATOM 328 CB LEU A 360 3.350 -4.048 -0.564 1.00 0.00 C ATOM 329 CG LEU A 360 4.685 -4.639 -1.050 1.00 0.00 C ATOM 330 CD1 LEU A 360 5.949 -3.926 -0.568 1.00 0.00 C ATOM 331 CD2 LEU A 360 4.770 -6.092 -0.587 1.00 0.00 C ATOM 0 H LEU A 360 3.108 -3.193 1.663 1.00 0.00 H new ATOM 0 HA LEU A 360 4.208 -2.047 -0.676 1.00 0.00 H new ATOM 0 HB2 LEU A 360 3.072 -4.556 0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 360 2.585 -4.289 -1.302 1.00 0.00 H new ATOM 0 HG LEU A 360 4.668 -4.522 -2.134 1.00 0.00 H new ATOM 0 HD11 LEU A 360 6.827 -4.429 -0.972 1.00 0.00 H new ATOM 0 HD12 LEU A 360 5.935 -2.891 -0.909 1.00 0.00 H new ATOM 0 HD13 LEU A 360 5.987 -3.949 0.521 1.00 0.00 H new ATOM 0 HD21 LEU A 360 5.711 -6.527 -0.923 1.00 0.00 H new ATOM 0 HD22 LEU A 360 4.721 -6.131 0.501 1.00 0.00 H new ATOM 0 HD23 LEU A 360 3.938 -6.657 -1.008 1.00 0.00 H new ATOM 343 N LEU A 361 0.909 -2.222 -0.496 1.00 0.00 N ATOM 344 CA LEU A 361 -0.338 -1.691 -1.023 1.00 0.00 C ATOM 345 C LEU A 361 -0.392 -0.179 -0.818 1.00 0.00 C ATOM 346 O LEU A 361 -0.775 0.523 -1.753 1.00 0.00 O ATOM 347 CB LEU A 361 -1.513 -2.430 -0.385 1.00 0.00 C ATOM 348 CG LEU A 361 -1.506 -3.938 -0.725 1.00 0.00 C ATOM 349 CD1 LEU A 361 -2.685 -4.591 -0.011 1.00 0.00 C ATOM 350 CD2 LEU A 361 -1.643 -4.227 -2.222 1.00 0.00 C ATOM 0 H LEU A 361 0.789 -2.827 0.317 1.00 0.00 H new ATOM 0 HA LEU A 361 -0.400 -1.857 -2.098 1.00 0.00 H new ATOM 0 HB2 LEU A 361 -1.476 -2.303 0.697 1.00 0.00 H new ATOM 0 HB3 LEU A 361 -2.448 -1.986 -0.727 1.00 0.00 H new ATOM 0 HG LEU A 361 -0.544 -4.336 -0.403 1.00 0.00 H new ATOM 0 HD11 LEU A 361 -2.701 -5.657 -0.236 1.00 0.00 H new ATOM 0 HD12 LEU A 361 -2.583 -4.449 1.065 1.00 0.00 H new ATOM 0 HD13 LEU A 361 -3.614 -4.134 -0.351 1.00 0.00 H new ATOM 0 HD21 LEU A 361 -1.630 -5.304 -2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 361 -2.583 -3.815 -2.588 1.00 0.00 H new ATOM 0 HD23 LEU A 361 -0.813 -3.768 -2.759 1.00 0.00 H new ATOM 362 N HIS A 362 0.067 0.336 0.334 1.00 0.00 N ATOM 363 CA HIS A 362 0.190 1.782 0.536 1.00 0.00 C ATOM 364 C HIS A 362 1.152 2.370 -0.505 1.00 0.00 C ATOM 365 O HIS A 362 0.822 3.373 -1.119 1.00 0.00 O ATOM 366 CB HIS A 362 0.646 2.150 1.957 1.00 0.00 C ATOM 367 CG HIS A 362 0.679 3.652 2.165 1.00 0.00 C ATOM 368 ND1 HIS A 362 1.607 4.530 1.662 1.00 0.00 N flip ATOM 369 CD2 HIS A 362 -0.262 4.409 2.825 1.00 0.00 C flip ATOM 370 CE1 HIS A 362 1.220 5.831 2.003 1.00 0.00 C flip ATOM 371 NE2 HIS A 362 0.093 5.704 2.723 1.00 0.00 N flip ATOM 0 H HIS A 362 0.357 -0.227 1.134 1.00 0.00 H new ATOM 0 HA HIS A 362 -0.803 2.213 0.408 1.00 0.00 H new ATOM 0 HB2 HIS A 362 -0.028 1.697 2.684 1.00 0.00 H new ATOM 0 HB3 HIS A 362 1.637 1.736 2.140 1.00 0.00 H new ATOM 0 HD2 HIS A 362 -1.134 4.030 3.336 1.00 0.00 H new ATOM 0 HE1 HIS A 362 1.724 6.749 1.741 1.00 0.00 H new ATOM 0 HE2 HIS A 362 -0.423 6.481 3.136 1.00 0.00 H new ATOM 379 N ALA A 363 2.314 1.756 -0.745 1.00 0.00 N ATOM 380 CA ALA A 363 3.283 2.210 -1.738 1.00 0.00 C ATOM 381 C ALA A 363 2.668 2.297 -3.147 1.00 0.00 C ATOM 382 O ALA A 363 2.859 3.310 -3.817 1.00 0.00 O ATOM 383 CB ALA A 363 4.516 1.303 -1.681 1.00 0.00 C ATOM 0 H ALA A 363 2.609 0.917 -0.246 1.00 0.00 H new ATOM 0 HA ALA A 363 3.593 3.228 -1.500 1.00 0.00 H new ATOM 0 HB1 ALA A 363 5.246 1.634 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 363 4.958 1.353 -0.686 1.00 0.00 H new ATOM 0 HB3 ALA A 363 4.222 0.276 -1.897 1.00 0.00 H new ATOM 389 N HIS A 364 1.894 1.293 -3.581 1.00 0.00 N ATOM 390 CA HIS A 364 1.186 1.298 -4.866 1.00 0.00 C ATOM 391 C HIS A 364 0.196 2.474 -4.951 1.00 0.00 C ATOM 392 O HIS A 364 0.270 3.319 -5.846 1.00 0.00 O ATOM 393 CB HIS A 364 0.446 -0.038 -5.041 1.00 0.00 C ATOM 394 CG HIS A 364 -0.199 -0.179 -6.397 1.00 0.00 C ATOM 395 ND1 HIS A 364 0.451 -0.249 -7.609 1.00 0.00 N ATOM 396 CD2 HIS A 364 -1.543 -0.222 -6.657 1.00 0.00 C ATOM 397 CE1 HIS A 364 -0.477 -0.334 -8.578 1.00 0.00 C ATOM 398 NE2 HIS A 364 -1.713 -0.322 -8.045 1.00 0.00 N ATOM 0 H HIS A 364 1.741 0.442 -3.040 1.00 0.00 H new ATOM 0 HA HIS A 364 1.914 1.421 -5.668 1.00 0.00 H new ATOM 0 HB2 HIS A 364 1.148 -0.858 -4.891 1.00 0.00 H new ATOM 0 HB3 HIS A 364 -0.319 -0.128 -4.269 1.00 0.00 H new ATOM 0 HD2 HIS A 364 -2.333 -0.185 -5.922 1.00 0.00 H new ATOM 0 HE1 HIS A 364 -0.261 -0.402 -9.634 1.00 0.00 H new ATOM 0 HE2 HIS A 364 -2.597 -0.375 -8.550 1.00 0.00 H new ATOM 406 N LYS A 365 -0.687 2.552 -3.948 1.00 0.00 N ATOM 407 CA LYS A 365 -1.668 3.623 -3.700 1.00 0.00 C ATOM 408 C LYS A 365 -1.069 5.025 -3.784 1.00 0.00 C ATOM 409 O LYS A 365 -1.561 5.893 -4.505 1.00 0.00 O ATOM 410 CB LYS A 365 -2.270 3.333 -2.305 1.00 0.00 C ATOM 411 CG LYS A 365 -2.733 4.545 -1.489 1.00 0.00 C ATOM 412 CD LYS A 365 -3.410 4.079 -0.191 1.00 0.00 C ATOM 413 CE LYS A 365 -3.942 5.312 0.549 1.00 0.00 C ATOM 414 NZ LYS A 365 -4.763 4.946 1.727 1.00 0.00 N ATOM 0 H LYS A 365 -0.741 1.821 -3.239 1.00 0.00 H new ATOM 0 HA LYS A 365 -2.433 3.619 -4.476 1.00 0.00 H new ATOM 0 HB2 LYS A 365 -3.121 2.665 -2.434 1.00 0.00 H new ATOM 0 HB3 LYS A 365 -1.526 2.793 -1.719 1.00 0.00 H new ATOM 0 HG2 LYS A 365 -1.881 5.183 -1.255 1.00 0.00 H new ATOM 0 HG3 LYS A 365 -3.428 5.145 -2.076 1.00 0.00 H new ATOM 0 HD2 LYS A 365 -4.225 3.390 -0.415 1.00 0.00 H new ATOM 0 HD3 LYS A 365 -2.699 3.539 0.434 1.00 0.00 H new ATOM 0 HE2 LYS A 365 -3.104 5.931 0.870 1.00 0.00 H new ATOM 0 HE3 LYS A 365 -4.539 5.915 -0.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 365 -5.101 5.810 2.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 365 -5.578 4.378 1.419 1.00 0.00 H new ATOM 0 HZ3 LYS A 365 -4.187 4.393 2.393 1.00 0.00 H new ATOM 428 N CYS A 366 -0.024 5.238 -3.000 1.00 0.00 N ATOM 429 CA CYS A 366 0.662 6.497 -2.815 1.00 0.00 C ATOM 430 C CYS A 366 1.461 6.886 -4.063 1.00 0.00 C ATOM 431 O CYS A 366 1.373 8.027 -4.510 1.00 0.00 O ATOM 432 CB CYS A 366 1.393 6.350 -1.486 1.00 0.00 C ATOM 433 SG CYS A 366 2.342 7.786 -0.951 1.00 0.00 S ATOM 0 H CYS A 366 0.389 4.489 -2.445 1.00 0.00 H new ATOM 0 HA CYS A 366 0.017 7.371 -2.729 1.00 0.00 H new ATOM 0 HB2 CYS A 366 0.661 6.114 -0.714 1.00 0.00 H new ATOM 0 HB3 CYS A 366 2.068 5.497 -1.556 1.00 0.00 H new ATOM 0 HG CYS A 366 3.233 7.417 -0.079 1.00 0.00 H new ATOM 438 N GLN A 367 2.145 5.935 -4.706 1.00 0.00 N ATOM 439 CA GLN A 367 2.795 6.177 -5.998 1.00 0.00 C ATOM 440 C GLN A 367 1.746 6.694 -6.993 1.00 0.00 C ATOM 441 O GLN A 367 1.923 7.770 -7.558 1.00 0.00 O ATOM 442 CB GLN A 367 3.479 4.886 -6.483 1.00 0.00 C ATOM 443 CG GLN A 367 4.191 5.045 -7.836 1.00 0.00 C ATOM 444 CD GLN A 367 4.858 3.742 -8.284 1.00 0.00 C ATOM 445 OE1 GLN A 367 4.253 2.679 -8.331 1.00 0.00 O ATOM 446 NE2 GLN A 367 6.126 3.765 -8.637 1.00 0.00 N ATOM 0 H GLN A 367 2.263 4.986 -4.351 1.00 0.00 H new ATOM 0 HA GLN A 367 3.571 6.936 -5.905 1.00 0.00 H new ATOM 0 HB2 GLN A 367 4.203 4.564 -5.735 1.00 0.00 H new ATOM 0 HB3 GLN A 367 2.732 4.096 -6.564 1.00 0.00 H new ATOM 0 HG2 GLN A 367 3.471 5.363 -8.590 1.00 0.00 H new ATOM 0 HG3 GLN A 367 4.942 5.831 -7.761 1.00 0.00 H new ATOM 0 HE21 GLN A 367 6.648 4.640 -8.605 1.00 0.00 H new ATOM 0 HE22 GLN A 367 6.586 2.907 -8.942 1.00 0.00 H new ATOM 455 N ARG A 368 0.628 5.973 -7.158 1.00 0.00 N ATOM 456 CA ARG A 368 -0.471 6.338 -8.062 1.00 0.00 C ATOM 457 C ARG A 368 -1.102 7.701 -7.778 1.00 0.00 C ATOM 458 O ARG A 368 -1.241 8.492 -8.709 1.00 0.00 O ATOM 459 CB ARG A 368 -1.506 5.198 -8.060 1.00 0.00 C ATOM 460 CG ARG A 368 -2.635 5.319 -9.099 1.00 0.00 C ATOM 461 CD ARG A 368 -2.202 5.057 -10.552 1.00 0.00 C ATOM 462 NE ARG A 368 -1.530 6.207 -11.193 1.00 0.00 N ATOM 463 CZ ARG A 368 -2.101 7.258 -11.756 1.00 0.00 C ATOM 464 NH1 ARG A 368 -3.388 7.462 -11.737 1.00 0.00 N ATOM 465 NH2 ARG A 368 -1.358 8.122 -12.380 1.00 0.00 N ATOM 0 H ARG A 368 0.459 5.101 -6.656 1.00 0.00 H new ATOM 0 HA ARG A 368 -0.052 6.459 -9.061 1.00 0.00 H new ATOM 0 HB2 ARG A 368 -0.983 4.257 -8.227 1.00 0.00 H new ATOM 0 HB3 ARG A 368 -1.955 5.141 -7.068 1.00 0.00 H new ATOM 0 HG2 ARG A 368 -3.427 4.617 -8.838 1.00 0.00 H new ATOM 0 HG3 ARG A 368 -3.062 6.320 -9.036 1.00 0.00 H new ATOM 0 HD2 ARG A 368 -1.530 4.199 -10.571 1.00 0.00 H new ATOM 0 HD3 ARG A 368 -3.080 4.788 -11.140 1.00 0.00 H new ATOM 0 HE ARG A 368 -0.510 6.187 -11.202 1.00 0.00 H new ATOM 0 HH11 ARG A 368 -4.003 6.794 -11.273 1.00 0.00 H new ATOM 0 HH12 ARG A 368 -3.780 8.289 -12.187 1.00 0.00 H new ATOM 0 HH21 ARG A 368 -0.349 7.984 -12.431 1.00 0.00 H new ATOM 0 HH22 ARG A 368 -1.784 8.938 -12.819 1.00 0.00 H new ATOM 479 N ARG A 369 -1.485 8.006 -6.533 1.00 0.00 N ATOM 480 CA ARG A 369 -2.165 9.283 -6.216 1.00 0.00 C ATOM 481 C ARG A 369 -1.246 10.510 -6.256 1.00 0.00 C ATOM 482 O ARG A 369 -1.679 11.578 -6.683 1.00 0.00 O ATOM 483 CB ARG A 369 -3.090 9.172 -4.977 1.00 0.00 C ATOM 484 CG ARG A 369 -2.688 9.913 -3.690 1.00 0.00 C ATOM 485 CD ARG A 369 -1.477 9.291 -2.997 1.00 0.00 C ATOM 486 NE ARG A 369 -0.931 10.176 -1.958 1.00 0.00 N ATOM 487 CZ ARG A 369 -0.525 9.876 -0.740 1.00 0.00 C ATOM 488 NH1 ARG A 369 -0.785 8.739 -0.162 1.00 0.00 N ATOM 489 NH2 ARG A 369 0.169 10.755 -0.079 1.00 0.00 N ATOM 0 H ARG A 369 -1.340 7.396 -5.728 1.00 0.00 H new ATOM 0 HA ARG A 369 -2.848 9.481 -7.043 1.00 0.00 H new ATOM 0 HB2 ARG A 369 -4.078 9.527 -5.269 1.00 0.00 H new ATOM 0 HB3 ARG A 369 -3.191 8.115 -4.733 1.00 0.00 H new ATOM 0 HG2 ARG A 369 -2.468 10.953 -3.930 1.00 0.00 H new ATOM 0 HG3 ARG A 369 -3.532 9.917 -3.001 1.00 0.00 H new ATOM 0 HD2 ARG A 369 -1.763 8.339 -2.550 1.00 0.00 H new ATOM 0 HD3 ARG A 369 -0.705 9.078 -3.736 1.00 0.00 H new ATOM 0 HE ARG A 369 -0.856 11.160 -2.215 1.00 0.00 H new ATOM 0 HH11 ARG A 369 -1.327 8.029 -0.654 1.00 0.00 H new ATOM 0 HH12 ARG A 369 -0.446 8.558 0.783 1.00 0.00 H new ATOM 0 HH21 ARG A 369 0.389 11.656 -0.504 1.00 0.00 H new ATOM 0 HH22 ARG A 369 0.493 10.544 0.865 1.00 0.00 H new ATOM 503 N GLU A 370 0.028 10.375 -5.887 1.00 0.00 N ATOM 504 CA GLU A 370 0.999 11.491 -5.972 1.00 0.00 C ATOM 505 C GLU A 370 1.352 11.750 -7.428 1.00 0.00 C ATOM 506 O GLU A 370 1.356 12.889 -7.894 1.00 0.00 O ATOM 507 CB GLU A 370 2.286 11.168 -5.207 1.00 0.00 C ATOM 508 CG GLU A 370 1.975 11.039 -3.729 1.00 0.00 C ATOM 509 CD GLU A 370 1.526 12.361 -3.083 1.00 0.00 C ATOM 510 OE1 GLU A 370 2.342 13.294 -2.938 1.00 0.00 O ATOM 511 OE2 GLU A 370 0.342 12.489 -2.691 1.00 0.00 O ATOM 0 H GLU A 370 0.422 9.507 -5.525 1.00 0.00 H new ATOM 0 HA GLU A 370 0.536 12.372 -5.527 1.00 0.00 H new ATOM 0 HB2 GLU A 370 2.721 10.241 -5.580 1.00 0.00 H new ATOM 0 HB3 GLU A 370 3.024 11.954 -5.367 1.00 0.00 H new ATOM 0 HG2 GLU A 370 1.192 10.292 -3.593 1.00 0.00 H new ATOM 0 HG3 GLU A 370 2.860 10.671 -3.210 1.00 0.00 H new ATOM 518 N GLN A 371 1.565 10.653 -8.152 1.00 0.00 N ATOM 519 CA GLN A 371 1.776 10.677 -9.610 1.00 0.00 C ATOM 520 C GLN A 371 0.573 11.334 -10.317 1.00 0.00 C ATOM 521 O GLN A 371 0.759 12.100 -11.265 1.00 0.00 O ATOM 522 CB GLN A 371 2.022 9.252 -10.135 1.00 0.00 C ATOM 523 CG GLN A 371 2.332 9.150 -11.637 1.00 0.00 C ATOM 524 CD GLN A 371 2.294 7.696 -12.103 1.00 0.00 C ATOM 525 OE1 GLN A 371 1.252 7.049 -12.082 1.00 0.00 O ATOM 526 NE2 GLN A 371 3.393 7.127 -12.547 1.00 0.00 N ATOM 0 H GLN A 371 1.597 9.717 -7.749 1.00 0.00 H new ATOM 0 HA GLN A 371 2.660 11.275 -9.830 1.00 0.00 H new ATOM 0 HB2 GLN A 371 2.852 8.816 -9.579 1.00 0.00 H new ATOM 0 HB3 GLN A 371 1.141 8.646 -9.921 1.00 0.00 H new ATOM 0 HG2 GLN A 371 1.608 9.737 -12.203 1.00 0.00 H new ATOM 0 HG3 GLN A 371 3.315 9.576 -11.839 1.00 0.00 H new ATOM 0 HE21 GLN A 371 4.266 7.653 -12.570 1.00 0.00 H new ATOM 0 HE22 GLN A 371 3.372 6.159 -12.868 1.00 0.00 H new ATOM 535 N ALA A 372 -0.656 11.080 -9.840 1.00 0.00 N ATOM 536 CA ALA A 372 -1.875 11.687 -10.391 1.00 0.00 C ATOM 537 C ALA A 372 -1.945 13.203 -10.107 1.00 0.00 C ATOM 538 O ALA A 372 -2.330 13.982 -10.983 1.00 0.00 O ATOM 539 CB ALA A 372 -3.107 10.958 -9.842 1.00 0.00 C ATOM 0 H ALA A 372 -0.831 10.447 -9.060 1.00 0.00 H new ATOM 0 HA ALA A 372 -1.852 11.577 -11.475 1.00 0.00 H new ATOM 0 HB1 ALA A 372 -4.010 11.410 -10.252 1.00 0.00 H new ATOM 0 HB2 ALA A 372 -3.065 9.907 -10.128 1.00 0.00 H new ATOM 0 HB3 ALA A 372 -3.123 11.038 -8.755 1.00 0.00 H new ATOM 652 N LEU A 381 4.271 7.923 7.153 1.00 0.00 N ATOM 653 CA LEU A 381 5.373 7.240 7.849 1.00 0.00 C ATOM 654 C LEU A 381 6.629 7.108 6.953 1.00 0.00 C ATOM 655 O LEU A 381 6.488 6.876 5.750 1.00 0.00 O ATOM 656 CB LEU A 381 4.919 5.871 8.431 1.00 0.00 C ATOM 657 CG LEU A 381 3.831 5.053 7.696 1.00 0.00 C ATOM 658 CD1 LEU A 381 4.180 4.692 6.256 1.00 0.00 C ATOM 659 CD2 LEU A 381 3.574 3.741 8.443 1.00 0.00 C ATOM 0 HA LEU A 381 5.660 7.866 8.694 1.00 0.00 H new ATOM 0 HB2 LEU A 381 5.804 5.240 8.510 1.00 0.00 H new ATOM 0 HB3 LEU A 381 4.563 6.049 9.446 1.00 0.00 H new ATOM 0 HG LEU A 381 2.954 5.701 7.675 1.00 0.00 H new ATOM 0 HD11 LEU A 381 3.363 4.120 5.816 1.00 0.00 H new ATOM 0 HD12 LEU A 381 4.335 5.604 5.680 1.00 0.00 H new ATOM 0 HD13 LEU A 381 5.091 4.094 6.241 1.00 0.00 H new ATOM 0 HD21 LEU A 381 2.807 3.169 7.921 1.00 0.00 H new ATOM 0 HD22 LEU A 381 4.495 3.159 8.484 1.00 0.00 H new ATOM 0 HD23 LEU A 381 3.237 3.959 9.456 1.00 0.00 H new ATOM 671 N PRO A 382 7.861 7.238 7.498 1.00 0.00 N ATOM 672 CA PRO A 382 9.110 7.137 6.725 1.00 0.00 C ATOM 673 C PRO A 382 9.264 5.851 5.897 1.00 0.00 C ATOM 674 O PRO A 382 9.845 5.879 4.810 1.00 0.00 O ATOM 675 CB PRO A 382 10.247 7.245 7.751 1.00 0.00 C ATOM 676 CG PRO A 382 9.618 8.009 8.909 1.00 0.00 C ATOM 677 CD PRO A 382 8.169 7.527 8.895 1.00 0.00 C ATOM 0 HA PRO A 382 9.119 7.932 5.979 1.00 0.00 H new ATOM 0 HB2 PRO A 382 10.598 6.262 8.064 1.00 0.00 H new ATOM 0 HB3 PRO A 382 11.107 7.775 7.341 1.00 0.00 H new ATOM 0 HG2 PRO A 382 10.109 7.783 9.855 1.00 0.00 H new ATOM 0 HG3 PRO A 382 9.686 9.087 8.765 1.00 0.00 H new ATOM 0 HD2 PRO A 382 8.046 6.639 9.515 1.00 0.00 H new ATOM 0 HD3 PRO A 382 7.499 8.289 9.294 1.00 0.00 H new ATOM 685 N HIS A 383 8.736 4.727 6.399 1.00 0.00 N ATOM 686 CA HIS A 383 8.793 3.408 5.753 1.00 0.00 C ATOM 687 C HIS A 383 8.161 3.371 4.349 1.00 0.00 C ATOM 688 O HIS A 383 8.518 2.510 3.540 1.00 0.00 O ATOM 689 CB HIS A 383 8.116 2.367 6.662 1.00 0.00 C ATOM 690 CG HIS A 383 8.583 2.391 8.099 1.00 0.00 C ATOM 691 ND1 HIS A 383 9.885 2.306 8.544 1.00 0.00 N ATOM 692 CD2 HIS A 383 7.789 2.524 9.207 1.00 0.00 C ATOM 693 CE1 HIS A 383 9.877 2.389 9.886 1.00 0.00 C ATOM 694 NE2 HIS A 383 8.617 2.524 10.338 1.00 0.00 N ATOM 0 H HIS A 383 8.243 4.709 7.292 1.00 0.00 H new ATOM 0 HA HIS A 383 9.848 3.174 5.612 1.00 0.00 H new ATOM 0 HB2 HIS A 383 7.039 2.531 6.641 1.00 0.00 H new ATOM 0 HB3 HIS A 383 8.296 1.373 6.251 1.00 0.00 H new ATOM 0 HD2 HIS A 383 6.713 2.613 9.209 1.00 0.00 H new ATOM 0 HE1 HIS A 383 10.756 2.353 10.512 1.00 0.00 H new ATOM 0 HE2 HIS A 383 8.323 2.609 11.311 1.00 0.00 H new ATOM 702 N CYS A 384 7.254 4.310 4.047 1.00 0.00 N ATOM 703 CA CYS A 384 6.579 4.442 2.760 1.00 0.00 C ATOM 704 C CYS A 384 7.575 4.496 1.589 1.00 0.00 C ATOM 705 O CYS A 384 7.478 3.702 0.655 1.00 0.00 O ATOM 706 CB CYS A 384 5.700 5.697 2.842 1.00 0.00 C ATOM 707 SG CYS A 384 4.684 5.883 1.355 1.00 0.00 S ATOM 0 H CYS A 384 6.964 5.020 4.719 1.00 0.00 H new ATOM 0 HA CYS A 384 5.962 3.566 2.560 1.00 0.00 H new ATOM 0 HB2 CYS A 384 5.057 5.637 3.720 1.00 0.00 H new ATOM 0 HB3 CYS A 384 6.330 6.578 2.968 1.00 0.00 H new ATOM 0 HG CYS A 384 3.599 5.177 1.480 1.00 0.00 H new ATOM 712 N ARG A 385 8.578 5.385 1.656 1.00 0.00 N ATOM 713 CA ARG A 385 9.614 5.544 0.616 1.00 0.00 C ATOM 714 C ARG A 385 10.484 4.297 0.429 1.00 0.00 C ATOM 715 O ARG A 385 10.819 3.951 -0.703 1.00 0.00 O ATOM 716 CB ARG A 385 10.479 6.780 0.899 1.00 0.00 C ATOM 717 CG ARG A 385 9.829 8.088 0.420 1.00 0.00 C ATOM 718 CD ARG A 385 8.595 8.524 1.229 1.00 0.00 C ATOM 719 NE ARG A 385 8.292 9.956 1.018 1.00 0.00 N ATOM 720 CZ ARG A 385 8.942 10.987 1.532 1.00 0.00 C ATOM 721 NH1 ARG A 385 9.932 10.845 2.369 1.00 0.00 N ATOM 722 NH2 ARG A 385 8.619 12.204 1.207 1.00 0.00 N ATOM 0 H ARG A 385 8.696 6.023 2.443 1.00 0.00 H new ATOM 0 HA ARG A 385 9.086 5.687 -0.327 1.00 0.00 H new ATOM 0 HB2 ARG A 385 10.670 6.846 1.970 1.00 0.00 H new ATOM 0 HB3 ARG A 385 11.446 6.660 0.410 1.00 0.00 H new ATOM 0 HG2 ARG A 385 10.573 8.884 0.460 1.00 0.00 H new ATOM 0 HG3 ARG A 385 9.540 7.973 -0.625 1.00 0.00 H new ATOM 0 HD2 ARG A 385 7.735 7.921 0.937 1.00 0.00 H new ATOM 0 HD3 ARG A 385 8.769 8.339 2.289 1.00 0.00 H new ATOM 0 HE ARG A 385 7.499 10.171 0.413 1.00 0.00 H new ATOM 0 HH11 ARG A 385 10.232 9.912 2.651 1.00 0.00 H new ATOM 0 HH12 ARG A 385 10.406 11.667 2.742 1.00 0.00 H new ATOM 0 HH21 ARG A 385 7.857 12.371 0.549 1.00 0.00 H new ATOM 0 HH22 ARG A 385 9.127 12.991 1.610 1.00 0.00 H new ATOM 736 N THR A 386 10.803 3.589 1.509 1.00 0.00 N ATOM 737 CA THR A 386 11.571 2.333 1.471 1.00 0.00 C ATOM 738 C THR A 386 10.767 1.264 0.734 1.00 0.00 C ATOM 739 O THR A 386 11.265 0.624 -0.189 1.00 0.00 O ATOM 740 CB THR A 386 11.916 1.849 2.891 1.00 0.00 C ATOM 741 OG1 THR A 386 12.545 2.890 3.610 1.00 0.00 O ATOM 742 CG2 THR A 386 12.873 0.655 2.883 1.00 0.00 C ATOM 0 H THR A 386 10.535 3.870 2.452 1.00 0.00 H new ATOM 0 HA THR A 386 12.506 2.516 0.942 1.00 0.00 H new ATOM 0 HB THR A 386 10.977 1.548 3.356 1.00 0.00 H new ATOM 0 HG1 THR A 386 12.762 2.579 4.514 1.00 0.00 H new ATOM 0 HG21 THR A 386 13.085 0.352 3.908 1.00 0.00 H new ATOM 0 HG22 THR A 386 12.414 -0.175 2.347 1.00 0.00 H new ATOM 0 HG23 THR A 386 13.803 0.937 2.388 1.00 0.00 H new ATOM 750 N MET A 387 9.490 1.105 1.087 1.00 0.00 N ATOM 751 CA MET A 387 8.580 0.156 0.441 1.00 0.00 C ATOM 752 C MET A 387 8.274 0.544 -1.013 1.00 0.00 C ATOM 753 O MET A 387 8.231 -0.325 -1.878 1.00 0.00 O ATOM 754 CB MET A 387 7.304 0.074 1.277 1.00 0.00 C ATOM 755 CG MET A 387 7.560 -0.665 2.605 1.00 0.00 C ATOM 756 SD MET A 387 7.217 -2.452 2.665 1.00 0.00 S ATOM 757 CE MET A 387 8.563 -3.164 1.674 1.00 0.00 C ATOM 0 H MET A 387 9.053 1.638 1.839 1.00 0.00 H new ATOM 0 HA MET A 387 9.058 -0.823 0.393 1.00 0.00 H new ATOM 0 HB2 MET A 387 6.934 1.079 1.481 1.00 0.00 H new ATOM 0 HB3 MET A 387 6.528 -0.443 0.713 1.00 0.00 H new ATOM 0 HG2 MET A 387 8.606 -0.516 2.875 1.00 0.00 H new ATOM 0 HG3 MET A 387 6.960 -0.183 3.377 1.00 0.00 H new ATOM 0 HE1 MET A 387 8.642 -4.231 1.881 1.00 0.00 H new ATOM 0 HE2 MET A 387 8.354 -3.014 0.615 1.00 0.00 H new ATOM 0 HE3 MET A 387 9.502 -2.674 1.931 1.00 0.00 H new ATOM 767 N LYS A 388 8.138 1.837 -1.321 1.00 0.00 N ATOM 768 CA LYS A 388 8.012 2.367 -2.692 1.00 0.00 C ATOM 769 C LYS A 388 9.248 1.998 -3.520 1.00 0.00 C ATOM 770 O LYS A 388 9.109 1.582 -4.669 1.00 0.00 O ATOM 771 CB LYS A 388 7.847 3.893 -2.622 1.00 0.00 C ATOM 772 CG LYS A 388 6.412 4.381 -2.352 1.00 0.00 C ATOM 773 CD LYS A 388 6.469 5.832 -1.852 1.00 0.00 C ATOM 774 CE LYS A 388 5.118 6.555 -1.772 1.00 0.00 C ATOM 775 NZ LYS A 388 4.684 7.085 -3.087 1.00 0.00 N ATOM 0 H LYS A 388 8.111 2.567 -0.609 1.00 0.00 H new ATOM 0 HA LYS A 388 7.139 1.929 -3.176 1.00 0.00 H new ATOM 0 HB2 LYS A 388 8.499 4.278 -1.838 1.00 0.00 H new ATOM 0 HB3 LYS A 388 8.190 4.324 -3.563 1.00 0.00 H new ATOM 0 HG2 LYS A 388 5.815 4.318 -3.262 1.00 0.00 H new ATOM 0 HG3 LYS A 388 5.930 3.745 -1.610 1.00 0.00 H new ATOM 0 HD2 LYS A 388 6.925 5.839 -0.862 1.00 0.00 H new ATOM 0 HD3 LYS A 388 7.127 6.399 -2.510 1.00 0.00 H new ATOM 0 HE2 LYS A 388 4.362 5.867 -1.393 1.00 0.00 H new ATOM 0 HE3 LYS A 388 5.189 7.375 -1.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 388 3.792 7.608 -2.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 388 5.415 7.723 -3.462 1.00 0.00 H new ATOM 0 HZ3 LYS A 388 4.540 6.296 -3.749 1.00 0.00 H new ATOM 789 N ASN A 389 10.448 2.083 -2.933 1.00 0.00 N ATOM 790 CA ASN A 389 11.688 1.676 -3.606 1.00 0.00 C ATOM 791 C ASN A 389 11.707 0.154 -3.855 1.00 0.00 C ATOM 792 O ASN A 389 12.050 -0.292 -4.947 1.00 0.00 O ATOM 793 CB ASN A 389 12.903 2.149 -2.789 1.00 0.00 C ATOM 794 CG ASN A 389 14.214 1.804 -3.480 1.00 0.00 C ATOM 795 OD1 ASN A 389 14.493 2.237 -4.588 1.00 0.00 O ATOM 796 ND2 ASN A 389 15.059 1.012 -2.857 1.00 0.00 N ATOM 0 H ASN A 389 10.587 2.433 -1.985 1.00 0.00 H new ATOM 0 HA ASN A 389 11.738 2.152 -4.585 1.00 0.00 H new ATOM 0 HB2 ASN A 389 12.843 3.227 -2.639 1.00 0.00 H new ATOM 0 HB3 ASN A 389 12.880 1.688 -1.802 1.00 0.00 H new ATOM 0 HD21 ASN A 389 15.944 0.761 -3.299 1.00 0.00 H new ATOM 0 HD22 ASN A 389 14.830 0.648 -1.932 1.00 0.00 H new ATOM 803 N VAL A 390 11.276 -0.641 -2.870 1.00 0.00 N ATOM 804 CA VAL A 390 11.130 -2.108 -2.967 1.00 0.00 C ATOM 805 C VAL A 390 10.111 -2.486 -4.052 1.00 0.00 C ATOM 806 O VAL A 390 10.324 -3.446 -4.790 1.00 0.00 O ATOM 807 CB VAL A 390 10.697 -2.664 -1.599 1.00 0.00 C ATOM 808 CG1 VAL A 390 10.230 -4.118 -1.624 1.00 0.00 C ATOM 809 CG2 VAL A 390 11.824 -2.586 -0.565 1.00 0.00 C ATOM 0 H VAL A 390 11.010 -0.277 -1.955 1.00 0.00 H new ATOM 0 HA VAL A 390 12.088 -2.545 -3.248 1.00 0.00 H new ATOM 0 HB VAL A 390 9.856 -2.026 -1.327 1.00 0.00 H new ATOM 0 HG11 VAL A 390 9.944 -4.426 -0.618 1.00 0.00 H new ATOM 0 HG12 VAL A 390 9.372 -4.213 -2.290 1.00 0.00 H new ATOM 0 HG13 VAL A 390 11.040 -4.754 -1.982 1.00 0.00 H new ATOM 0 HG21 VAL A 390 11.474 -2.989 0.385 1.00 0.00 H new ATOM 0 HG22 VAL A 390 12.678 -3.167 -0.913 1.00 0.00 H new ATOM 0 HG23 VAL A 390 12.123 -1.546 -0.430 1.00 0.00 H new ATOM 819 N LEU A 391 9.019 -1.728 -4.191 1.00 0.00 N ATOM 820 CA LEU A 391 7.998 -1.948 -5.218 1.00 0.00 C ATOM 821 C LEU A 391 8.575 -1.632 -6.610 1.00 0.00 C ATOM 822 O LEU A 391 8.519 -2.467 -7.509 1.00 0.00 O ATOM 823 CB LEU A 391 6.745 -1.114 -4.879 1.00 0.00 C ATOM 824 CG LEU A 391 5.423 -1.661 -5.453 1.00 0.00 C ATOM 825 CD1 LEU A 391 4.275 -0.773 -4.981 1.00 0.00 C ATOM 826 CD2 LEU A 391 5.362 -1.711 -6.980 1.00 0.00 C ATOM 0 H LEU A 391 8.817 -0.933 -3.584 1.00 0.00 H new ATOM 0 HA LEU A 391 7.695 -2.995 -5.238 1.00 0.00 H new ATOM 0 HB2 LEU A 391 6.653 -1.048 -3.795 1.00 0.00 H new ATOM 0 HB3 LEU A 391 6.892 -0.099 -5.249 1.00 0.00 H new ATOM 0 HG LEU A 391 5.349 -2.687 -5.093 1.00 0.00 H new ATOM 0 HD11 LEU A 391 3.334 -1.151 -5.381 1.00 0.00 H new ATOM 0 HD12 LEU A 391 4.234 -0.779 -3.892 1.00 0.00 H new ATOM 0 HD13 LEU A 391 4.435 0.246 -5.332 1.00 0.00 H new ATOM 0 HD21 LEU A 391 4.397 -2.109 -7.293 1.00 0.00 H new ATOM 0 HD22 LEU A 391 5.488 -0.706 -7.382 1.00 0.00 H new ATOM 0 HD23 LEU A 391 6.158 -2.354 -7.355 1.00 0.00 H new ATOM 838 N ASN A 392 9.214 -0.470 -6.785 1.00 0.00 N ATOM 839 CA ASN A 392 9.883 -0.120 -8.045 1.00 0.00 C ATOM 840 C ASN A 392 10.987 -1.143 -8.390 1.00 0.00 C ATOM 841 O ASN A 392 11.195 -1.475 -9.559 1.00 0.00 O ATOM 842 CB ASN A 392 10.424 1.315 -7.936 1.00 0.00 C ATOM 843 CG ASN A 392 11.164 1.750 -9.192 1.00 0.00 C ATOM 844 OD1 ASN A 392 12.383 1.832 -9.227 1.00 0.00 O ATOM 845 ND2 ASN A 392 10.458 2.039 -10.262 1.00 0.00 N ATOM 0 H ASN A 392 9.283 0.249 -6.065 1.00 0.00 H new ATOM 0 HA ASN A 392 9.169 -0.158 -8.868 1.00 0.00 H new ATOM 0 HB2 ASN A 392 9.597 2.000 -7.749 1.00 0.00 H new ATOM 0 HB3 ASN A 392 11.095 1.384 -7.080 1.00 0.00 H new ATOM 0 HD21 ASN A 392 10.927 2.331 -11.119 1.00 0.00 H new ATOM 0 HD22 ASN A 392 9.441 1.971 -10.235 1.00 0.00 H new ATOM 852 N HIS A 393 11.647 -1.717 -7.379 1.00 0.00 N ATOM 853 CA HIS A 393 12.569 -2.820 -7.610 1.00 0.00 C ATOM 854 C HIS A 393 11.778 -4.026 -8.123 1.00 0.00 C ATOM 855 O HIS A 393 12.153 -4.567 -9.156 1.00 0.00 O ATOM 856 CB HIS A 393 13.378 -3.179 -6.361 1.00 0.00 C ATOM 857 CG HIS A 393 14.199 -4.430 -6.584 1.00 0.00 C ATOM 858 ND1 HIS A 393 13.713 -5.708 -6.510 1.00 0.00 N flip ATOM 859 CD2 HIS A 393 15.451 -4.514 -7.155 1.00 0.00 C flip ATOM 860 CE1 HIS A 393 14.649 -6.573 -7.088 1.00 0.00 C flip ATOM 861 NE2 HIS A 393 15.695 -5.806 -7.441 1.00 0.00 N flip ATOM 0 H HIS A 393 11.558 -1.435 -6.403 1.00 0.00 H new ATOM 0 HA HIS A 393 13.297 -2.510 -8.359 1.00 0.00 H new ATOM 0 HB2 HIS A 393 14.036 -2.350 -6.100 1.00 0.00 H new ATOM 0 HB3 HIS A 393 12.704 -3.329 -5.518 1.00 0.00 H new ATOM 0 HD1 HIS A 393 12.819 -5.983 -6.102 1.00 0.00 H new ATOM 0 HD2 HIS A 393 16.120 -3.687 -7.341 1.00 0.00 H new ATOM 0 HE1 HIS A 393 14.551 -7.640 -7.223 1.00 0.00 H new ATOM 869 N MET A 394 10.679 -4.433 -7.466 1.00 0.00 N ATOM 870 CA MET A 394 9.874 -5.573 -7.929 1.00 0.00 C ATOM 871 C MET A 394 9.334 -5.378 -9.356 1.00 0.00 C ATOM 872 O MET A 394 9.105 -6.375 -10.044 1.00 0.00 O ATOM 873 CB MET A 394 8.769 -6.004 -6.940 1.00 0.00 C ATOM 874 CG MET A 394 7.382 -5.351 -7.078 1.00 0.00 C ATOM 875 SD MET A 394 5.999 -6.346 -6.445 1.00 0.00 S ATOM 876 CE MET A 394 6.456 -6.493 -4.699 1.00 0.00 C ATOM 0 H MET A 394 10.330 -3.991 -6.616 1.00 0.00 H new ATOM 0 HA MET A 394 10.571 -6.410 -7.966 1.00 0.00 H new ATOM 0 HB2 MET A 394 8.641 -7.083 -7.031 1.00 0.00 H new ATOM 0 HB3 MET A 394 9.130 -5.810 -5.930 1.00 0.00 H new ATOM 0 HG2 MET A 394 7.393 -4.396 -6.553 1.00 0.00 H new ATOM 0 HG3 MET A 394 7.202 -5.134 -8.131 1.00 0.00 H new ATOM 0 HE1 MET A 394 5.618 -6.905 -4.137 1.00 0.00 H new ATOM 0 HE2 MET A 394 7.317 -7.154 -4.603 1.00 0.00 H new ATOM 0 HE3 MET A 394 6.708 -5.509 -4.305 1.00 0.00 H new ATOM 886 N THR A 395 9.153 -4.131 -9.824 1.00 0.00 N ATOM 887 CA THR A 395 8.720 -3.870 -11.217 1.00 0.00 C ATOM 888 C THR A 395 9.896 -3.976 -12.195 1.00 0.00 C ATOM 889 O THR A 395 9.742 -4.535 -13.283 1.00 0.00 O ATOM 890 CB THR A 395 7.996 -2.527 -11.431 1.00 0.00 C ATOM 891 OG1 THR A 395 8.834 -1.413 -11.243 1.00 0.00 O ATOM 892 CG2 THR A 395 6.795 -2.338 -10.513 1.00 0.00 C ATOM 0 H THR A 395 9.298 -3.290 -9.266 1.00 0.00 H new ATOM 0 HA THR A 395 7.986 -4.650 -11.420 1.00 0.00 H new ATOM 0 HB THR A 395 7.667 -2.580 -12.469 1.00 0.00 H new ATOM 0 HG1 THR A 395 9.567 -1.653 -10.639 1.00 0.00 H new ATOM 0 HG21 THR A 395 6.331 -1.373 -10.715 1.00 0.00 H new ATOM 0 HG22 THR A 395 6.071 -3.133 -10.692 1.00 0.00 H new ATOM 0 HG23 THR A 395 7.122 -2.373 -9.474 1.00 0.00 H new ATOM 900 N HIS A 396 11.081 -3.489 -11.808 1.00 0.00 N ATOM 901 CA HIS A 396 12.318 -3.570 -12.600 1.00 0.00 C ATOM 902 C HIS A 396 13.004 -4.962 -12.539 1.00 0.00 C ATOM 903 O HIS A 396 13.909 -5.255 -13.327 1.00 0.00 O ATOM 904 CB HIS A 396 13.263 -2.461 -12.105 1.00 0.00 C ATOM 905 CG HIS A 396 14.498 -2.268 -12.951 1.00 0.00 C ATOM 906 ND1 HIS A 396 15.800 -2.495 -12.563 1.00 0.00 N ATOM 907 CD2 HIS A 396 14.538 -1.828 -14.248 1.00 0.00 C ATOM 908 CE1 HIS A 396 16.605 -2.205 -13.599 1.00 0.00 C ATOM 909 NE2 HIS A 396 15.880 -1.791 -14.655 1.00 0.00 N ATOM 0 H HIS A 396 11.211 -3.016 -10.914 1.00 0.00 H new ATOM 0 HA HIS A 396 12.067 -3.429 -13.651 1.00 0.00 H new ATOM 0 HB2 HIS A 396 12.712 -1.521 -12.069 1.00 0.00 H new ATOM 0 HB3 HIS A 396 13.569 -2.691 -11.084 1.00 0.00 H new ATOM 0 HD2 HIS A 396 13.685 -1.557 -14.852 1.00 0.00 H new ATOM 0 HE1 HIS A 396 17.681 -2.292 -13.586 1.00 0.00 H new ATOM 0 HE2 HIS A 396 16.235 -1.507 -15.568 1.00 0.00 H new ATOM 917 N CYS A 397 12.588 -5.807 -11.587 1.00 0.00 N ATOM 918 CA CYS A 397 13.087 -7.142 -11.269 1.00 0.00 C ATOM 919 C CYS A 397 13.193 -8.089 -12.478 1.00 0.00 C ATOM 920 O CYS A 397 12.454 -7.968 -13.461 1.00 0.00 O ATOM 921 CB CYS A 397 12.148 -7.706 -10.195 1.00 0.00 C ATOM 922 SG CYS A 397 12.953 -8.972 -9.187 1.00 0.00 S ATOM 0 H CYS A 397 11.823 -5.545 -10.965 1.00 0.00 H new ATOM 0 HA CYS A 397 14.115 -7.062 -10.917 1.00 0.00 H new ATOM 0 HB2 CYS A 397 11.804 -6.895 -9.552 1.00 0.00 H new ATOM 0 HB3 CYS A 397 11.265 -8.130 -10.672 1.00 0.00 H new ATOM 0 HG CYS A 397 12.652 -8.787 -7.936 1.00 0.00 H new ATOM 927 N GLN A 398 14.101 -9.066 -12.374 1.00 0.00 N ATOM 928 CA GLN A 398 14.378 -10.066 -13.418 1.00 0.00 C ATOM 929 C GLN A 398 14.269 -11.521 -12.924 1.00 0.00 C ATOM 930 O GLN A 398 14.803 -12.451 -13.533 1.00 0.00 O ATOM 931 CB GLN A 398 15.721 -9.746 -14.107 1.00 0.00 C ATOM 932 CG GLN A 398 15.735 -8.353 -14.766 1.00 0.00 C ATOM 933 CD GLN A 398 17.051 -8.007 -15.466 1.00 0.00 C ATOM 934 OE1 GLN A 398 17.891 -8.846 -15.773 1.00 0.00 O ATOM 935 NE2 GLN A 398 17.289 -6.741 -15.745 1.00 0.00 N ATOM 0 H GLN A 398 14.679 -9.188 -11.542 1.00 0.00 H new ATOM 0 HA GLN A 398 13.591 -9.992 -14.169 1.00 0.00 H new ATOM 0 HB2 GLN A 398 16.524 -9.804 -13.372 1.00 0.00 H new ATOM 0 HB3 GLN A 398 15.926 -10.503 -14.864 1.00 0.00 H new ATOM 0 HG2 GLN A 398 14.924 -8.298 -15.492 1.00 0.00 H new ATOM 0 HG3 GLN A 398 15.532 -7.600 -14.004 1.00 0.00 H new ATOM 0 HE21 GLN A 398 16.604 -6.027 -15.498 1.00 0.00 H new ATOM 0 HE22 GLN A 398 18.158 -6.475 -16.208 1.00 0.00 H new ATOM 944 N ALA A 399 13.531 -11.710 -11.830 1.00 0.00 N ATOM 945 CA ALA A 399 13.222 -13.009 -11.231 1.00 0.00 C ATOM 946 C ALA A 399 11.910 -12.996 -10.437 1.00 0.00 C ATOM 947 O ALA A 399 11.165 -13.975 -10.473 1.00 0.00 O ATOM 948 CB ALA A 399 14.344 -13.409 -10.267 1.00 0.00 C ATOM 0 H ALA A 399 13.116 -10.932 -11.317 1.00 0.00 H new ATOM 0 HA ALA A 399 13.124 -13.717 -12.054 1.00 0.00 H new ATOM 0 HB1 ALA A 399 14.113 -14.377 -9.821 1.00 0.00 H new ATOM 0 HB2 ALA A 399 15.285 -13.476 -10.812 1.00 0.00 H new ATOM 0 HB3 ALA A 399 14.433 -12.659 -9.481 1.00 0.00 H new ATOM 954 N PRO A 400 11.659 -11.904 -9.710 1.00 0.00 N ATOM 955 CA PRO A 400 10.525 -11.683 -8.804 1.00 0.00 C ATOM 956 C PRO A 400 10.406 -12.693 -7.644 1.00 0.00 C ATOM 957 O PRO A 400 10.609 -12.348 -6.482 1.00 0.00 O ATOM 961 N LYS A 401 10.098 -13.956 -7.961 1.00 0.00 N ATOM 962 CA LYS A 401 9.950 -15.085 -7.019 1.00 0.00 C ATOM 963 C LYS A 401 11.308 -15.668 -6.613 1.00 0.00 C ATOM 964 O LYS A 401 11.562 -15.919 -5.435 1.00 0.00 O ATOM 965 CB LYS A 401 9.035 -16.138 -7.672 1.00 0.00 C ATOM 966 CG LYS A 401 8.689 -17.308 -6.736 1.00 0.00 C ATOM 967 CD LYS A 401 7.643 -18.229 -7.387 1.00 0.00 C ATOM 968 CE LYS A 401 7.165 -19.349 -6.450 1.00 0.00 C ATOM 969 NZ LYS A 401 8.221 -20.362 -6.184 1.00 0.00 N ATOM 0 H LYS A 401 9.936 -14.238 -8.928 1.00 0.00 H new ATOM 0 HA LYS A 401 9.494 -14.736 -6.093 1.00 0.00 H new ATOM 0 HB2 LYS A 401 8.113 -15.656 -7.996 1.00 0.00 H new ATOM 0 HB3 LYS A 401 9.522 -16.528 -8.565 1.00 0.00 H new ATOM 0 HG2 LYS A 401 9.590 -17.877 -6.507 1.00 0.00 H new ATOM 0 HG3 LYS A 401 8.306 -16.924 -5.791 1.00 0.00 H new ATOM 0 HD2 LYS A 401 6.786 -17.633 -7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 401 8.067 -18.672 -8.288 1.00 0.00 H new ATOM 0 HE2 LYS A 401 6.839 -18.913 -5.506 1.00 0.00 H new ATOM 0 HE3 LYS A 401 6.298 -19.841 -6.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 401 7.847 -21.094 -5.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 401 8.516 -20.800 -7.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 401 9.040 -19.901 -5.738 1.00 0.00 H new ATOM 983 N ALA A 402 12.177 -15.833 -7.611 1.00 0.00 N ATOM 984 CA ALA A 402 13.557 -16.310 -7.517 1.00 0.00 C ATOM 985 C ALA A 402 14.538 -15.224 -7.012 1.00 0.00 C ATOM 986 O ALA A 402 15.700 -15.525 -6.731 1.00 0.00 O ATOM 987 CB ALA A 402 13.965 -16.960 -8.849 1.00 0.00 C ATOM 0 H ALA A 402 11.916 -15.622 -8.574 1.00 0.00 H new ATOM 0 HA ALA A 402 13.613 -17.080 -6.747 1.00 0.00 H new ATOM 0 HB1 ALA A 402 14.993 -17.316 -8.780 1.00 0.00 H new ATOM 0 HB2 ALA A 402 13.304 -17.800 -9.062 1.00 0.00 H new ATOM 0 HB3 ALA A 402 13.888 -16.226 -9.651 1.00 0.00 H new ATOM 993 N CYS A 403 14.083 -13.962 -6.915 1.00 0.00 N ATOM 994 CA CYS A 403 14.784 -12.769 -6.446 1.00 0.00 C ATOM 995 C CYS A 403 14.863 -12.777 -4.921 1.00 0.00 C ATOM 996 O CYS A 403 14.365 -11.904 -4.214 1.00 0.00 O ATOM 997 CB CYS A 403 14.144 -11.475 -6.933 1.00 0.00 C ATOM 998 SG CYS A 403 15.293 -10.086 -6.655 1.00 0.00 S ATOM 0 H CYS A 403 13.127 -13.739 -7.190 1.00 0.00 H new ATOM 0 HA CYS A 403 15.788 -12.802 -6.870 1.00 0.00 H new ATOM 0 HB2 CYS A 403 13.901 -11.553 -7.993 1.00 0.00 H new ATOM 0 HB3 CYS A 403 13.208 -11.298 -6.404 1.00 0.00 H new ATOM 0 HG CYS A 403 15.412 -9.396 -7.750 1.00 0.00 H new ATOM 1003 N GLN A 404 15.484 -13.851 -4.470 1.00 0.00 N ATOM 1004 CA GLN A 404 15.870 -14.274 -3.122 1.00 0.00 C ATOM 1005 C GLN A 404 16.337 -13.135 -2.183 1.00 0.00 C ATOM 1006 O GLN A 404 16.444 -13.367 -0.976 1.00 0.00 O ATOM 1007 CB GLN A 404 16.914 -15.402 -3.281 1.00 0.00 C ATOM 1008 CG GLN A 404 17.343 -16.139 -1.999 1.00 0.00 C ATOM 1009 CD GLN A 404 16.176 -16.777 -1.244 1.00 0.00 C ATOM 1010 OE1 GLN A 404 15.821 -17.932 -1.446 1.00 0.00 O ATOM 1011 NE2 GLN A 404 15.532 -16.052 -0.354 1.00 0.00 N ATOM 0 H GLN A 404 15.777 -14.560 -5.142 1.00 0.00 H new ATOM 0 HA GLN A 404 14.983 -14.640 -2.604 1.00 0.00 H new ATOM 0 HB2 GLN A 404 16.514 -16.138 -3.978 1.00 0.00 H new ATOM 0 HB3 GLN A 404 17.805 -14.977 -3.742 1.00 0.00 H new ATOM 0 HG2 GLN A 404 18.065 -16.914 -2.259 1.00 0.00 H new ATOM 0 HG3 GLN A 404 17.852 -15.437 -1.339 1.00 0.00 H new ATOM 0 HE21 GLN A 404 15.818 -15.089 -0.177 1.00 0.00 H new ATOM 0 HE22 GLN A 404 14.747 -16.453 0.159 1.00 0.00 H new ATOM 1020 N VAL A 405 16.555 -11.907 -2.687 1.00 0.00 N ATOM 1021 CA VAL A 405 16.828 -10.713 -1.861 1.00 0.00 C ATOM 1022 C VAL A 405 15.685 -10.583 -0.850 1.00 0.00 C ATOM 1023 O VAL A 405 14.539 -10.413 -1.256 1.00 0.00 O ATOM 1024 CB VAL A 405 16.890 -9.423 -2.706 1.00 0.00 C ATOM 1025 CG1 VAL A 405 17.295 -8.226 -1.837 1.00 0.00 C ATOM 1026 CG2 VAL A 405 17.892 -9.521 -3.855 1.00 0.00 C ATOM 0 H VAL A 405 16.547 -11.712 -3.688 1.00 0.00 H new ATOM 0 HA VAL A 405 17.796 -10.835 -1.376 1.00 0.00 H new ATOM 0 HB VAL A 405 15.890 -9.287 -3.118 1.00 0.00 H new ATOM 0 HG11 VAL A 405 17.333 -7.327 -2.452 1.00 0.00 H new ATOM 0 HG12 VAL A 405 16.563 -8.091 -1.040 1.00 0.00 H new ATOM 0 HG13 VAL A 405 18.277 -8.409 -1.401 1.00 0.00 H new ATOM 0 HG21 VAL A 405 17.895 -8.587 -4.416 1.00 0.00 H new ATOM 0 HG22 VAL A 405 18.888 -9.706 -3.454 1.00 0.00 H new ATOM 0 HG23 VAL A 405 17.609 -10.340 -4.516 1.00 0.00 H new ATOM 1036 N ALA A 406 15.981 -10.709 0.447 1.00 0.00 N ATOM 1037 CA ALA A 406 15.013 -10.737 1.551 1.00 0.00 C ATOM 1038 C ALA A 406 13.721 -9.928 1.335 1.00 0.00 C ATOM 1039 O ALA A 406 12.621 -10.494 1.278 1.00 0.00 O ATOM 1040 CB ALA A 406 15.748 -10.285 2.816 1.00 0.00 C ATOM 0 H ALA A 406 16.944 -10.798 0.772 1.00 0.00 H new ATOM 0 HA ALA A 406 14.647 -11.761 1.631 1.00 0.00 H new ATOM 0 HB1 ALA A 406 15.058 -10.293 3.660 1.00 0.00 H new ATOM 0 HB2 ALA A 406 16.576 -10.964 3.018 1.00 0.00 H new ATOM 0 HB3 ALA A 406 16.133 -9.276 2.672 1.00 0.00 H new ATOM 1046 N HIS A 407 13.869 -8.607 1.197 1.00 0.00 N ATOM 1047 CA HIS A 407 12.747 -7.694 1.007 1.00 0.00 C ATOM 1048 C HIS A 407 11.932 -7.995 -0.256 1.00 0.00 C ATOM 1049 O HIS A 407 10.727 -8.159 -0.115 1.00 0.00 O ATOM 1050 CB HIS A 407 13.193 -6.222 1.087 1.00 0.00 C ATOM 1051 CG HIS A 407 14.313 -5.810 0.158 1.00 0.00 C ATOM 1052 ND1 HIS A 407 15.625 -5.595 0.519 1.00 0.00 N ATOM 1053 CD2 HIS A 407 14.208 -5.480 -1.169 1.00 0.00 C ATOM 1054 CE1 HIS A 407 16.293 -5.151 -0.560 1.00 0.00 C ATOM 1055 NE2 HIS A 407 15.469 -5.070 -1.619 1.00 0.00 N ATOM 0 H HIS A 407 14.777 -8.142 1.215 1.00 0.00 H new ATOM 0 HA HIS A 407 12.064 -7.867 1.839 1.00 0.00 H new ATOM 0 HB2 HIS A 407 12.328 -5.591 0.882 1.00 0.00 H new ATOM 0 HB3 HIS A 407 13.504 -6.014 2.111 1.00 0.00 H new ATOM 0 HD2 HIS A 407 13.308 -5.528 -1.764 1.00 0.00 H new ATOM 0 HE1 HIS A 407 17.342 -4.896 -0.574 1.00 0.00 H new ATOM 0 HE2 HIS A 407 15.714 -4.770 -2.563 1.00 0.00 H new ATOM 1063 N CYS A 408 12.544 -8.115 -1.444 1.00 0.00 N ATOM 1064 CA CYS A 408 11.840 -8.375 -2.713 1.00 0.00 C ATOM 1065 C CYS A 408 11.230 -9.786 -2.777 1.00 0.00 C ATOM 1066 O CYS A 408 10.069 -9.916 -3.166 1.00 0.00 O ATOM 1067 CB CYS A 408 12.842 -8.153 -3.861 1.00 0.00 C ATOM 1068 SG CYS A 408 12.101 -8.487 -5.493 1.00 0.00 S ATOM 0 H CYS A 408 13.555 -8.033 -1.554 1.00 0.00 H new ATOM 0 HA CYS A 408 10.998 -7.688 -2.798 1.00 0.00 H new ATOM 0 HB2 CYS A 408 13.204 -7.125 -3.831 1.00 0.00 H new ATOM 0 HB3 CYS A 408 13.707 -8.800 -3.717 1.00 0.00 H new ATOM 0 HG CYS A 408 11.393 -7.463 -5.866 1.00 0.00 H new ATOM 1073 N ALA A 409 11.948 -10.832 -2.353 1.00 0.00 N ATOM 1074 CA ALA A 409 11.407 -12.194 -2.318 1.00 0.00 C ATOM 1075 C ALA A 409 10.150 -12.241 -1.432 1.00 0.00 C ATOM 1076 O ALA A 409 9.099 -12.728 -1.866 1.00 0.00 O ATOM 1077 CB ALA A 409 12.470 -13.188 -1.829 1.00 0.00 C ATOM 0 H ALA A 409 12.912 -10.759 -2.027 1.00 0.00 H new ATOM 0 HA ALA A 409 11.123 -12.486 -3.329 1.00 0.00 H new ATOM 0 HB1 ALA A 409 12.048 -14.193 -1.811 1.00 0.00 H new ATOM 0 HB2 ALA A 409 13.326 -13.167 -2.504 1.00 0.00 H new ATOM 0 HB3 ALA A 409 12.792 -12.911 -0.825 1.00 0.00 H new ATOM 1083 N SER A 410 10.233 -11.666 -0.220 1.00 0.00 N ATOM 1084 CA SER A 410 9.072 -11.587 0.676 1.00 0.00 C ATOM 1085 C SER A 410 7.958 -10.784 0.003 1.00 0.00 C ATOM 1086 O SER A 410 6.852 -11.283 -0.175 1.00 0.00 O ATOM 1087 CB SER A 410 9.433 -10.949 2.024 1.00 0.00 C ATOM 1088 OG SER A 410 10.435 -11.699 2.690 1.00 0.00 O ATOM 0 H SER A 410 11.086 -11.253 0.157 1.00 0.00 H new ATOM 0 HA SER A 410 8.731 -12.604 0.873 1.00 0.00 H new ATOM 0 HB2 SER A 410 9.783 -9.929 1.865 1.00 0.00 H new ATOM 0 HB3 SER A 410 8.543 -10.887 2.651 1.00 0.00 H new ATOM 0 HG SER A 410 11.317 -11.442 2.349 1.00 0.00 H new ATOM 1094 N SER A 411 8.276 -9.564 -0.432 1.00 0.00 N ATOM 1095 CA SER A 411 7.406 -8.614 -1.129 1.00 0.00 C ATOM 1096 C SER A 411 6.614 -9.227 -2.280 1.00 0.00 C ATOM 1097 O SER A 411 5.388 -9.124 -2.302 1.00 0.00 O ATOM 1098 CB SER A 411 8.298 -7.468 -1.620 1.00 0.00 C ATOM 1099 OG SER A 411 8.435 -6.515 -0.591 1.00 0.00 O ATOM 0 H SER A 411 9.214 -9.187 -0.297 1.00 0.00 H new ATOM 0 HA SER A 411 6.644 -8.262 -0.434 1.00 0.00 H new ATOM 0 HB2 SER A 411 9.276 -7.851 -1.910 1.00 0.00 H new ATOM 0 HB3 SER A 411 7.862 -7.005 -2.505 1.00 0.00 H new ATOM 0 HG SER A 411 9.237 -6.715 -0.065 1.00 0.00 H new ATOM 1105 N ARG A 412 7.273 -9.913 -3.215 1.00 0.00 N ATOM 1106 CA ARG A 412 6.611 -10.608 -4.324 1.00 0.00 C ATOM 1107 C ARG A 412 5.745 -11.751 -3.807 1.00 0.00 C ATOM 1108 O ARG A 412 4.628 -11.898 -4.295 1.00 0.00 O ATOM 1109 CB ARG A 412 7.662 -11.100 -5.332 1.00 0.00 C ATOM 1110 CG ARG A 412 7.986 -10.016 -6.377 1.00 0.00 C ATOM 1111 CD ARG A 412 7.018 -10.091 -7.566 1.00 0.00 C ATOM 1112 NE ARG A 412 7.453 -9.244 -8.696 1.00 0.00 N ATOM 1113 CZ ARG A 412 7.043 -9.343 -9.949 1.00 0.00 C ATOM 1114 NH1 ARG A 412 6.172 -10.235 -10.328 1.00 0.00 N ATOM 1115 NH2 ARG A 412 7.507 -8.541 -10.863 1.00 0.00 N ATOM 0 H ARG A 412 8.289 -10.004 -3.226 1.00 0.00 H new ATOM 0 HA ARG A 412 5.948 -9.911 -4.838 1.00 0.00 H new ATOM 0 HB2 ARG A 412 8.572 -11.382 -4.803 1.00 0.00 H new ATOM 0 HB3 ARG A 412 7.296 -11.995 -5.835 1.00 0.00 H new ATOM 0 HG2 ARG A 412 7.925 -9.031 -5.915 1.00 0.00 H new ATOM 0 HG3 ARG A 412 9.010 -10.140 -6.729 1.00 0.00 H new ATOM 0 HD2 ARG A 412 6.936 -11.125 -7.900 1.00 0.00 H new ATOM 0 HD3 ARG A 412 6.024 -9.780 -7.243 1.00 0.00 H new ATOM 0 HE ARG A 412 8.134 -8.514 -8.490 1.00 0.00 H new ATOM 0 HH11 ARG A 412 5.782 -10.888 -9.648 1.00 0.00 H new ATOM 0 HH12 ARG A 412 5.880 -10.280 -11.304 1.00 0.00 H new ATOM 0 HH21 ARG A 412 8.193 -7.828 -10.615 1.00 0.00 H new ATOM 0 HH22 ARG A 412 7.184 -8.625 -11.827 1.00 0.00 H new ATOM 1129 N GLN A 413 6.193 -12.517 -2.807 1.00 0.00 N ATOM 1130 CA GLN A 413 5.370 -13.584 -2.223 1.00 0.00 C ATOM 1131 C GLN A 413 4.077 -13.037 -1.572 1.00 0.00 C ATOM 1132 O GLN A 413 3.000 -13.565 -1.858 1.00 0.00 O ATOM 1133 CB GLN A 413 6.201 -14.443 -1.248 1.00 0.00 C ATOM 1134 CG GLN A 413 6.835 -15.691 -1.895 1.00 0.00 C ATOM 1135 CD GLN A 413 7.851 -15.429 -3.014 1.00 0.00 C ATOM 1136 OE1 GLN A 413 7.537 -14.923 -4.084 1.00 0.00 O ATOM 1137 NE2 GLN A 413 9.097 -15.825 -2.846 1.00 0.00 N ATOM 0 H GLN A 413 7.117 -12.420 -2.386 1.00 0.00 H new ATOM 0 HA GLN A 413 5.043 -14.233 -3.036 1.00 0.00 H new ATOM 0 HB2 GLN A 413 6.992 -13.827 -0.821 1.00 0.00 H new ATOM 0 HB3 GLN A 413 5.562 -14.759 -0.423 1.00 0.00 H new ATOM 0 HG2 GLN A 413 7.327 -16.270 -1.114 1.00 0.00 H new ATOM 0 HG3 GLN A 413 6.035 -16.313 -2.297 1.00 0.00 H new ATOM 0 HE21 GLN A 413 9.383 -16.249 -1.964 1.00 0.00 H new ATOM 0 HE22 GLN A 413 9.775 -15.707 -3.598 1.00 0.00 H new ATOM 1146 N ILE A 414 4.132 -11.964 -0.766 1.00 0.00 N ATOM 1147 CA ILE A 414 2.921 -11.358 -0.176 1.00 0.00 C ATOM 1148 C ILE A 414 1.983 -10.721 -1.198 1.00 0.00 C ATOM 1149 O ILE A 414 0.774 -10.946 -1.146 1.00 0.00 O ATOM 1150 CB ILE A 414 3.169 -10.371 0.994 1.00 0.00 C ATOM 1151 CG1 ILE A 414 4.474 -9.547 1.056 1.00 0.00 C ATOM 1152 CG2 ILE A 414 2.832 -11.088 2.310 1.00 0.00 C ATOM 1153 CD1 ILE A 414 5.491 -9.972 2.129 1.00 0.00 C ATOM 0 H ILE A 414 5.001 -11.496 -0.506 1.00 0.00 H new ATOM 0 HA ILE A 414 2.426 -12.230 0.250 1.00 0.00 H new ATOM 0 HB ILE A 414 2.492 -9.542 0.787 1.00 0.00 H new ATOM 0 HG12 ILE A 414 4.960 -9.600 0.082 1.00 0.00 H new ATOM 0 HG13 ILE A 414 4.213 -8.502 1.225 1.00 0.00 H new ATOM 0 HG21 ILE A 414 3.000 -10.410 3.147 1.00 0.00 H new ATOM 0 HG22 ILE A 414 1.787 -11.398 2.298 1.00 0.00 H new ATOM 0 HG23 ILE A 414 3.470 -11.965 2.420 1.00 0.00 H new ATOM 0 HD11 ILE A 414 6.366 -9.324 2.078 1.00 0.00 H new ATOM 0 HD12 ILE A 414 5.035 -9.890 3.116 1.00 0.00 H new ATOM 0 HD13 ILE A 414 5.794 -11.004 1.954 1.00 0.00 H new ATOM 1165 N ILE A 415 2.516 -9.944 -2.137 1.00 0.00 N ATOM 1166 CA ILE A 415 1.692 -9.315 -3.178 1.00 0.00 C ATOM 1167 C ILE A 415 1.079 -10.371 -4.114 1.00 0.00 C ATOM 1168 O ILE A 415 -0.092 -10.258 -4.469 1.00 0.00 O ATOM 1169 CB ILE A 415 2.487 -8.179 -3.853 1.00 0.00 C ATOM 1170 CG1 ILE A 415 2.072 -6.826 -3.221 1.00 0.00 C ATOM 1171 CG2 ILE A 415 2.359 -8.206 -5.381 1.00 0.00 C ATOM 1172 CD1 ILE A 415 2.618 -5.588 -3.945 1.00 0.00 C ATOM 0 H ILE A 415 3.512 -9.732 -2.203 1.00 0.00 H new ATOM 0 HA ILE A 415 0.819 -8.828 -2.743 1.00 0.00 H new ATOM 0 HB ILE A 415 3.551 -8.325 -3.668 1.00 0.00 H new ATOM 0 HG12 ILE A 415 0.984 -6.768 -3.201 1.00 0.00 H new ATOM 0 HG13 ILE A 415 2.412 -6.804 -2.186 1.00 0.00 H new ATOM 0 HG21 ILE A 415 2.937 -7.387 -5.809 1.00 0.00 H new ATOM 0 HG22 ILE A 415 2.738 -9.155 -5.761 1.00 0.00 H new ATOM 0 HG23 ILE A 415 1.311 -8.096 -5.660 1.00 0.00 H new ATOM 0 HD11 ILE A 415 2.277 -4.688 -3.434 1.00 0.00 H new ATOM 0 HD12 ILE A 415 3.708 -5.616 -3.943 1.00 0.00 H new ATOM 0 HD13 ILE A 415 2.257 -5.580 -4.974 1.00 0.00 H new ATOM 1184 N SER A 416 1.813 -11.430 -4.462 1.00 0.00 N ATOM 1185 CA SER A 416 1.298 -12.539 -5.273 1.00 0.00 C ATOM 1186 C SER A 416 0.200 -13.293 -4.518 1.00 0.00 C ATOM 1187 O SER A 416 -0.830 -13.616 -5.115 1.00 0.00 O ATOM 1188 CB SER A 416 2.412 -13.477 -5.708 1.00 0.00 C ATOM 1189 OG SER A 416 1.908 -14.478 -6.576 1.00 0.00 O ATOM 0 H SER A 416 2.789 -11.544 -4.188 1.00 0.00 H new ATOM 0 HA SER A 416 0.861 -12.117 -6.178 1.00 0.00 H new ATOM 0 HB2 SER A 416 3.196 -12.911 -6.212 1.00 0.00 H new ATOM 0 HB3 SER A 416 2.867 -13.941 -4.833 1.00 0.00 H new ATOM 0 HG SER A 416 2.638 -15.073 -6.848 1.00 0.00 H new ATOM 1195 N HIS A 417 0.356 -13.505 -3.200 1.00 0.00 N ATOM 1196 CA HIS A 417 -0.714 -14.071 -2.375 1.00 0.00 C ATOM 1197 C HIS A 417 -1.954 -13.170 -2.484 1.00 0.00 C ATOM 1198 O HIS A 417 -3.018 -13.649 -2.861 1.00 0.00 O ATOM 1199 CB HIS A 417 -0.287 -14.246 -0.901 1.00 0.00 C ATOM 1200 CG HIS A 417 -1.476 -14.536 -0.006 1.00 0.00 C ATOM 1201 ND1 HIS A 417 -2.151 -15.734 0.075 1.00 0.00 N ATOM 1202 CD2 HIS A 417 -2.276 -13.588 0.583 1.00 0.00 C ATOM 1203 CE1 HIS A 417 -3.348 -15.506 0.645 1.00 0.00 C ATOM 1204 NE2 HIS A 417 -3.474 -14.206 0.956 1.00 0.00 N ATOM 0 H HIS A 417 1.212 -13.292 -2.688 1.00 0.00 H new ATOM 0 HA HIS A 417 -0.946 -15.069 -2.747 1.00 0.00 H new ATOM 0 HB2 HIS A 417 0.434 -15.060 -0.825 1.00 0.00 H new ATOM 0 HB3 HIS A 417 0.216 -13.342 -0.557 1.00 0.00 H new ATOM 0 HD2 HIS A 417 -2.024 -12.548 0.732 1.00 0.00 H new ATOM 0 HE1 HIS A 417 -4.099 -16.260 0.826 1.00 0.00 H new ATOM 0 HE2 HIS A 417 -4.285 -13.757 1.381 1.00 0.00 H new ATOM 1212 N TRP A 418 -1.820 -11.866 -2.205 1.00 0.00 N ATOM 1213 CA TRP A 418 -2.938 -10.918 -2.265 1.00 0.00 C ATOM 1214 C TRP A 418 -3.620 -10.866 -3.644 1.00 0.00 C ATOM 1215 O TRP A 418 -4.845 -10.737 -3.720 1.00 0.00 O ATOM 1216 CB TRP A 418 -2.480 -9.530 -1.798 1.00 0.00 C ATOM 1217 CG TRP A 418 -3.583 -8.683 -1.239 1.00 0.00 C ATOM 1218 CD1 TRP A 418 -4.208 -8.907 -0.060 1.00 0.00 C ATOM 1219 CD2 TRP A 418 -4.235 -7.507 -1.815 1.00 0.00 C ATOM 1220 NE1 TRP A 418 -5.183 -7.952 0.142 1.00 0.00 N ATOM 1221 CE2 TRP A 418 -5.243 -7.059 -0.907 1.00 0.00 C ATOM 1222 CE3 TRP A 418 -4.082 -6.772 -3.013 1.00 0.00 C ATOM 1223 CZ2 TRP A 418 -6.049 -5.941 -1.164 1.00 0.00 C ATOM 1224 CZ3 TRP A 418 -4.885 -5.644 -3.282 1.00 0.00 C ATOM 1225 CH2 TRP A 418 -5.864 -5.228 -2.361 1.00 0.00 C ATOM 0 H TRP A 418 -0.934 -11.440 -1.932 1.00 0.00 H new ATOM 0 HA TRP A 418 -3.705 -11.281 -1.581 1.00 0.00 H new ATOM 0 HB2 TRP A 418 -1.707 -9.650 -1.039 1.00 0.00 H new ATOM 0 HB3 TRP A 418 -2.024 -9.007 -2.638 1.00 0.00 H new ATOM 0 HD1 TRP A 418 -3.978 -9.713 0.621 1.00 0.00 H new ATOM 0 HE1 TRP A 418 -5.785 -7.912 0.965 1.00 0.00 H new ATOM 0 HE3 TRP A 418 -3.338 -7.079 -3.734 1.00 0.00 H new ATOM 0 HZ2 TRP A 418 -6.801 -5.632 -0.453 1.00 0.00 H new ATOM 0 HZ3 TRP A 418 -4.747 -5.095 -4.202 1.00 0.00 H new ATOM 0 HH2 TRP A 418 -6.473 -4.362 -2.574 1.00 0.00 H new ATOM 1236 N LYS A 419 -2.852 -11.011 -4.737 1.00 0.00 N ATOM 1237 CA LYS A 419 -3.387 -11.063 -6.112 1.00 0.00 C ATOM 1238 C LYS A 419 -4.212 -12.330 -6.378 1.00 0.00 C ATOM 1239 O LYS A 419 -5.296 -12.251 -6.959 1.00 0.00 O ATOM 1240 CB LYS A 419 -2.227 -11.001 -7.123 1.00 0.00 C ATOM 1241 CG LYS A 419 -1.663 -9.588 -7.312 1.00 0.00 C ATOM 1242 CD LYS A 419 -0.371 -9.645 -8.144 1.00 0.00 C ATOM 1243 CE LYS A 419 0.220 -8.258 -8.408 1.00 0.00 C ATOM 1244 NZ LYS A 419 -0.628 -7.438 -9.319 1.00 0.00 N ATOM 0 H LYS A 419 -1.836 -11.096 -4.693 1.00 0.00 H new ATOM 0 HA LYS A 419 -4.049 -10.205 -6.228 1.00 0.00 H new ATOM 0 HB2 LYS A 419 -1.427 -11.662 -6.789 1.00 0.00 H new ATOM 0 HB3 LYS A 419 -2.572 -11.379 -8.085 1.00 0.00 H new ATOM 0 HG2 LYS A 419 -2.399 -8.957 -7.811 1.00 0.00 H new ATOM 0 HG3 LYS A 419 -1.461 -9.135 -6.341 1.00 0.00 H new ATOM 0 HD2 LYS A 419 0.366 -10.257 -7.623 1.00 0.00 H new ATOM 0 HD3 LYS A 419 -0.577 -10.135 -9.095 1.00 0.00 H new ATOM 0 HE2 LYS A 419 0.342 -7.733 -7.461 1.00 0.00 H new ATOM 0 HE3 LYS A 419 1.214 -8.367 -8.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 419 -0.159 -6.529 -9.506 1.00 0.00 H new ATOM 0 HZ2 LYS A 419 -0.767 -7.946 -10.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 419 -1.551 -7.266 -8.872 1.00 0.00 H new ATOM 1258 N ASN A 420 -3.687 -13.495 -5.992 1.00 0.00 N ATOM 1259 CA ASN A 420 -4.304 -14.808 -6.228 1.00 0.00 C ATOM 1260 C ASN A 420 -5.431 -15.203 -5.251 1.00 0.00 C ATOM 1261 O ASN A 420 -6.328 -15.960 -5.633 1.00 0.00 O ATOM 1262 CB ASN A 420 -3.192 -15.873 -6.228 1.00 0.00 C ATOM 1263 CG ASN A 420 -2.357 -15.831 -7.499 1.00 0.00 C ATOM 1264 OD1 ASN A 420 -2.719 -16.389 -8.525 1.00 0.00 O ATOM 1265 ND2 ASN A 420 -1.224 -15.168 -7.485 1.00 0.00 N ATOM 0 H ASN A 420 -2.799 -13.556 -5.494 1.00 0.00 H new ATOM 0 HA ASN A 420 -4.805 -14.742 -7.194 1.00 0.00 H new ATOM 0 HB2 ASN A 420 -2.545 -15.720 -5.365 1.00 0.00 H new ATOM 0 HB3 ASN A 420 -3.638 -16.862 -6.121 1.00 0.00 H new ATOM 0 HD21 ASN A 420 -0.651 -15.120 -8.327 1.00 0.00 H new ATOM 0 HD22 ASN A 420 -0.917 -14.701 -6.632 1.00 0.00 H new ATOM 1272 N CYS A 421 -5.373 -14.749 -3.998 1.00 0.00 N ATOM 1273 CA CYS A 421 -6.302 -15.102 -2.928 1.00 0.00 C ATOM 1274 C CYS A 421 -7.770 -14.715 -3.196 1.00 0.00 C ATOM 1275 O CYS A 421 -8.087 -13.611 -3.652 1.00 0.00 O ATOM 1276 CB CYS A 421 -5.788 -14.482 -1.622 1.00 0.00 C ATOM 1277 SG CYS A 421 -6.688 -15.119 -0.178 1.00 0.00 S ATOM 0 H CYS A 421 -4.649 -14.100 -3.691 1.00 0.00 H new ATOM 0 HA CYS A 421 -6.325 -16.190 -2.861 1.00 0.00 H new ATOM 0 HB2 CYS A 421 -4.725 -14.695 -1.511 1.00 0.00 H new ATOM 0 HB3 CYS A 421 -5.893 -13.398 -1.667 1.00 0.00 H new ATOM 0 HG CYS A 421 -7.719 -14.363 0.059 1.00 0.00 H new ATOM 1282 N THR A 422 -8.662 -15.648 -2.858 1.00 0.00 N ATOM 1283 CA THR A 422 -10.129 -15.544 -2.942 1.00 0.00 C ATOM 1284 C THR A 422 -10.803 -15.825 -1.588 1.00 0.00 C ATOM 1285 O THR A 422 -12.033 -15.783 -1.485 1.00 0.00 O ATOM 1286 CB THR A 422 -10.681 -16.521 -3.995 1.00 0.00 C ATOM 1287 OG1 THR A 422 -10.387 -17.856 -3.625 1.00 0.00 O ATOM 1288 CG2 THR A 422 -10.062 -16.287 -5.372 1.00 0.00 C ATOM 0 H THR A 422 -8.366 -16.554 -2.495 1.00 0.00 H new ATOM 0 HA THR A 422 -10.359 -14.519 -3.234 1.00 0.00 H new ATOM 0 HB THR A 422 -11.756 -16.350 -4.044 1.00 0.00 H new ATOM 0 HG1 THR A 422 -10.744 -18.469 -4.301 1.00 0.00 H new ATOM 0 HG21 THR A 422 -10.480 -16.998 -6.084 1.00 0.00 H new ATOM 0 HG22 THR A 422 -10.281 -15.272 -5.702 1.00 0.00 H new ATOM 0 HG23 THR A 422 -8.982 -16.424 -5.314 1.00 0.00 H new ATOM 1296 N ARG A 423 -10.015 -16.108 -0.537 1.00 0.00 N ATOM 1297 CA ARG A 423 -10.486 -16.426 0.819 1.00 0.00 C ATOM 1298 C ARG A 423 -11.182 -15.231 1.480 1.00 0.00 C ATOM 1299 O ARG A 423 -10.564 -14.218 1.807 1.00 0.00 O ATOM 1300 CB ARG A 423 -9.310 -16.960 1.661 1.00 0.00 C ATOM 1301 CG ARG A 423 -9.763 -17.473 3.039 1.00 0.00 C ATOM 1302 CD ARG A 423 -8.609 -17.995 3.902 1.00 0.00 C ATOM 1303 NE ARG A 423 -8.018 -19.230 3.353 1.00 0.00 N ATOM 1304 CZ ARG A 423 -6.834 -19.372 2.781 1.00 0.00 C ATOM 1305 NH1 ARG A 423 -6.003 -18.380 2.618 1.00 0.00 N ATOM 1306 NH2 ARG A 423 -6.460 -20.542 2.349 1.00 0.00 N ATOM 0 H ARG A 423 -8.998 -16.122 -0.612 1.00 0.00 H new ATOM 0 HA ARG A 423 -11.243 -17.208 0.753 1.00 0.00 H new ATOM 0 HB2 ARG A 423 -8.816 -17.767 1.120 1.00 0.00 H new ATOM 0 HB3 ARG A 423 -8.573 -16.168 1.795 1.00 0.00 H new ATOM 0 HG2 ARG A 423 -10.269 -16.667 3.570 1.00 0.00 H new ATOM 0 HG3 ARG A 423 -10.493 -18.271 2.900 1.00 0.00 H new ATOM 0 HD2 ARG A 423 -7.838 -17.228 3.978 1.00 0.00 H new ATOM 0 HD3 ARG A 423 -8.970 -18.185 4.913 1.00 0.00 H new ATOM 0 HE ARG A 423 -8.589 -20.072 3.423 1.00 0.00 H new ATOM 0 HH11 ARG A 423 -6.256 -17.445 2.938 1.00 0.00 H new ATOM 0 HH12 ARG A 423 -5.100 -18.539 2.171 1.00 0.00 H new ATOM 0 HH21 ARG A 423 -7.080 -21.346 2.452 1.00 0.00 H new ATOM 0 HH22 ARG A 423 -5.548 -20.655 1.907 1.00 0.00 H new ATOM 1320 N HIS A 424 -12.482 -15.387 1.710 1.00 0.00 N ATOM 1321 CA HIS A 424 -13.387 -14.451 2.379 1.00 0.00 C ATOM 1322 C HIS A 424 -13.040 -14.132 3.854 1.00 0.00 C ATOM 1323 O HIS A 424 -13.663 -13.256 4.453 1.00 0.00 O ATOM 1324 CB HIS A 424 -14.834 -14.961 2.223 1.00 0.00 C ATOM 1325 CG HIS A 424 -15.058 -16.453 2.374 1.00 0.00 C ATOM 1326 ND1 HIS A 424 -14.449 -17.330 3.251 1.00 0.00 N ATOM 1327 CD2 HIS A 424 -15.921 -17.199 1.612 1.00 0.00 C ATOM 1328 CE1 HIS A 424 -14.928 -18.563 3.019 1.00 0.00 C ATOM 1329 NE2 HIS A 424 -15.833 -18.536 2.024 1.00 0.00 N ATOM 0 H HIS A 424 -12.969 -16.233 1.413 1.00 0.00 H new ATOM 0 HA HIS A 424 -13.266 -13.488 1.882 1.00 0.00 H new ATOM 0 HB2 HIS A 424 -15.455 -14.449 2.958 1.00 0.00 H new ATOM 0 HB3 HIS A 424 -15.194 -14.662 1.239 1.00 0.00 H new ATOM 0 HD1 HIS A 424 -13.754 -17.083 3.955 1.00 0.00 H new ATOM 0 HD2 HIS A 424 -16.560 -16.820 0.828 1.00 0.00 H new ATOM 0 HE1 HIS A 424 -14.629 -19.451 3.556 1.00 0.00 H new ATOM 1337 N ASP A 425 -12.096 -14.861 4.458 1.00 0.00 N ATOM 1338 CA ASP A 425 -11.692 -14.789 5.865 1.00 0.00 C ATOM 1339 C ASP A 425 -10.182 -15.062 6.068 1.00 0.00 C ATOM 1340 O ASP A 425 -9.788 -15.890 6.894 1.00 0.00 O ATOM 1341 CB ASP A 425 -12.604 -15.702 6.714 1.00 0.00 C ATOM 1342 CG ASP A 425 -12.459 -17.210 6.425 1.00 0.00 C ATOM 1343 OD1 ASP A 425 -12.476 -17.609 5.234 1.00 0.00 O ATOM 1344 OD2 ASP A 425 -12.396 -18.011 7.390 1.00 0.00 O ATOM 0 H ASP A 425 -11.560 -15.561 3.945 1.00 0.00 H new ATOM 0 HA ASP A 425 -11.829 -13.766 6.215 1.00 0.00 H new ATOM 0 HB2 ASP A 425 -12.390 -15.526 7.768 1.00 0.00 H new ATOM 0 HB3 ASP A 425 -13.641 -15.412 6.547 1.00 0.00 H new ATOM 1349 N CYS A 426 -9.320 -14.384 5.297 1.00 0.00 N ATOM 1350 CA CYS A 426 -7.863 -14.591 5.350 1.00 0.00 C ATOM 1351 C CYS A 426 -7.218 -13.710 6.460 1.00 0.00 C ATOM 1352 O CYS A 426 -7.744 -12.629 6.745 1.00 0.00 O ATOM 1353 CB CYS A 426 -7.340 -14.284 3.946 1.00 0.00 C ATOM 1354 SG CYS A 426 -5.854 -15.239 3.507 1.00 0.00 S ATOM 0 H CYS A 426 -9.611 -13.678 4.620 1.00 0.00 H new ATOM 0 HA CYS A 426 -7.600 -15.613 5.622 1.00 0.00 H new ATOM 0 HB2 CYS A 426 -8.125 -14.493 3.220 1.00 0.00 H new ATOM 0 HB3 CYS A 426 -7.114 -13.220 3.874 1.00 0.00 H new ATOM 0 HG CYS A 426 -5.810 -15.405 2.218 1.00 0.00 H new ATOM 1359 N PRO A 427 -6.095 -14.123 7.087 1.00 0.00 N ATOM 1360 CA PRO A 427 -5.402 -13.403 8.170 1.00 0.00 C ATOM 1361 C PRO A 427 -5.014 -11.939 7.894 1.00 0.00 C ATOM 1362 O PRO A 427 -4.718 -11.205 8.839 1.00 0.00 O ATOM 1363 CB PRO A 427 -4.141 -14.223 8.477 1.00 0.00 C ATOM 1364 CG PRO A 427 -4.473 -15.624 7.985 1.00 0.00 C ATOM 1365 CD PRO A 427 -5.382 -15.351 6.794 1.00 0.00 C ATOM 0 HA PRO A 427 -6.103 -13.320 9.000 1.00 0.00 H new ATOM 0 HB2 PRO A 427 -3.269 -13.818 7.964 1.00 0.00 H new ATOM 0 HB3 PRO A 427 -3.914 -14.219 9.543 1.00 0.00 H new ATOM 0 HG2 PRO A 427 -3.578 -16.174 7.694 1.00 0.00 H new ATOM 0 HG3 PRO A 427 -4.975 -16.214 8.751 1.00 0.00 H new ATOM 0 HD2 PRO A 427 -4.800 -15.251 5.878 1.00 0.00 H new ATOM 0 HD3 PRO A 427 -6.078 -16.176 6.641 1.00 0.00 H new ATOM 1373 N VAL A 428 -4.976 -11.527 6.620 1.00 0.00 N ATOM 1374 CA VAL A 428 -4.595 -10.178 6.158 1.00 0.00 C ATOM 1375 C VAL A 428 -5.634 -9.587 5.185 1.00 0.00 C ATOM 1376 O VAL A 428 -5.965 -8.397 5.280 1.00 0.00 O ATOM 1377 CB VAL A 428 -3.193 -10.232 5.528 1.00 0.00 C ATOM 1378 CG1 VAL A 428 -2.730 -8.820 5.141 1.00 0.00 C ATOM 1379 CG2 VAL A 428 -2.166 -10.825 6.499 1.00 0.00 C ATOM 0 H VAL A 428 -5.219 -12.147 5.848 1.00 0.00 H new ATOM 0 HA VAL A 428 -4.571 -9.509 7.018 1.00 0.00 H new ATOM 0 HB VAL A 428 -3.260 -10.866 4.644 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -1.736 -8.872 4.696 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -3.428 -8.393 4.421 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -2.697 -8.191 6.031 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -1.186 -10.849 6.022 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -2.118 -10.210 7.398 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -2.463 -11.839 6.768 1.00 0.00 H new ATOM 1389 N CYS A 429 -6.218 -10.420 4.313 1.00 0.00 N ATOM 1390 CA CYS A 429 -7.326 -10.030 3.446 1.00 0.00 C ATOM 1391 C CYS A 429 -8.560 -9.538 4.209 1.00 0.00 C ATOM 1392 O CYS A 429 -9.015 -8.446 3.899 1.00 0.00 O ATOM 1393 CB CYS A 429 -7.648 -11.082 2.369 1.00 0.00 C ATOM 1394 SG CYS A 429 -6.161 -12.014 1.867 1.00 0.00 S ATOM 0 H CYS A 429 -5.928 -11.391 4.192 1.00 0.00 H new ATOM 0 HA CYS A 429 -6.971 -9.156 2.901 1.00 0.00 H new ATOM 0 HB2 CYS A 429 -8.399 -11.774 2.750 1.00 0.00 H new ATOM 0 HB3 CYS A 429 -8.080 -10.590 1.498 1.00 0.00 H new ATOM 0 HG CYS A 429 -6.515 -13.054 1.173 1.00 0.00 H new ATOM 1399 N LEU A 430 -9.087 -10.257 5.212 1.00 0.00 N ATOM 1400 CA LEU A 430 -10.231 -9.780 5.999 1.00 0.00 C ATOM 1401 C LEU A 430 -9.994 -8.370 6.603 1.00 0.00 C ATOM 1402 O LEU A 430 -10.799 -7.464 6.336 1.00 0.00 O ATOM 1403 CB LEU A 430 -10.665 -10.838 7.019 1.00 0.00 C ATOM 1404 CG LEU A 430 -12.127 -11.270 6.894 1.00 0.00 C ATOM 1405 CD1 LEU A 430 -12.496 -12.173 8.077 1.00 0.00 C ATOM 1406 CD2 LEU A 430 -13.155 -10.146 6.863 1.00 0.00 C ATOM 0 H LEU A 430 -8.737 -11.172 5.496 1.00 0.00 H new ATOM 0 HA LEU A 430 -11.075 -9.641 5.324 1.00 0.00 H new ATOM 0 HB2 LEU A 430 -10.028 -11.716 6.908 1.00 0.00 H new ATOM 0 HB3 LEU A 430 -10.498 -10.448 8.023 1.00 0.00 H new ATOM 0 HG LEU A 430 -12.174 -11.771 5.927 1.00 0.00 H new ATOM 0 HD11 LEU A 430 -13.538 -12.481 7.988 1.00 0.00 H new ATOM 0 HD12 LEU A 430 -11.855 -13.055 8.075 1.00 0.00 H new ATOM 0 HD13 LEU A 430 -12.358 -11.626 9.009 1.00 0.00 H new ATOM 0 HD21 LEU A 430 -14.155 -10.570 6.772 1.00 0.00 H new ATOM 0 HD22 LEU A 430 -13.089 -9.567 7.784 1.00 0.00 H new ATOM 0 HD23 LEU A 430 -12.958 -9.496 6.010 1.00 0.00 H new ATOM 1418 N PRO A 431 -8.884 -8.137 7.342 1.00 0.00 N ATOM 1419 CA PRO A 431 -8.483 -6.802 7.786 1.00 0.00 C ATOM 1420 C PRO A 431 -8.544 -5.743 6.676 1.00 0.00 C ATOM 1421 O PRO A 431 -9.259 -4.753 6.821 1.00 0.00 O ATOM 1422 CB PRO A 431 -7.039 -6.960 8.264 1.00 0.00 C ATOM 1423 CG PRO A 431 -7.001 -8.385 8.795 1.00 0.00 C ATOM 1424 CD PRO A 431 -7.906 -9.119 7.808 1.00 0.00 C ATOM 0 HA PRO A 431 -9.166 -6.449 8.559 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -6.328 -6.814 7.451 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -6.790 -6.235 9.039 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -5.990 -8.791 8.800 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -7.375 -8.449 9.817 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -7.329 -9.519 6.974 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -8.401 -9.964 8.288 1.00 0.00 H new ATOM 1432 N LEU A 432 -7.833 -5.947 5.557 1.00 0.00 N ATOM 1433 CA LEU A 432 -7.828 -4.993 4.431 1.00 0.00 C ATOM 1434 C LEU A 432 -9.195 -4.821 3.773 1.00 0.00 C ATOM 1435 O LEU A 432 -9.522 -3.734 3.297 1.00 0.00 O ATOM 1436 CB LEU A 432 -6.822 -5.439 3.362 1.00 0.00 C ATOM 1437 CG LEU A 432 -5.441 -4.823 3.655 1.00 0.00 C ATOM 1438 CD1 LEU A 432 -4.340 -5.703 3.077 1.00 0.00 C ATOM 1439 CD2 LEU A 432 -5.314 -3.427 3.039 1.00 0.00 C ATOM 0 H LEU A 432 -7.249 -6.769 5.405 1.00 0.00 H new ATOM 0 HA LEU A 432 -7.544 -4.031 4.857 1.00 0.00 H new ATOM 0 HB2 LEU A 432 -6.750 -6.527 3.349 1.00 0.00 H new ATOM 0 HB3 LEU A 432 -7.166 -5.130 2.375 1.00 0.00 H new ATOM 0 HG LEU A 432 -5.340 -4.750 4.738 1.00 0.00 H new ATOM 0 HD11 LEU A 432 -3.368 -5.257 3.290 1.00 0.00 H new ATOM 0 HD12 LEU A 432 -4.392 -6.694 3.528 1.00 0.00 H new ATOM 0 HD13 LEU A 432 -4.471 -5.788 1.998 1.00 0.00 H new ATOM 0 HD21 LEU A 432 -4.329 -3.019 3.263 1.00 0.00 H new ATOM 0 HD22 LEU A 432 -5.442 -3.493 1.959 1.00 0.00 H new ATOM 0 HD23 LEU A 432 -6.081 -2.774 3.456 1.00 0.00 H new