USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 628 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 410 GLN : amide:sc= 0.555 K(o=2.3,f=-3.3) USER MOD Set 1.2: A 470 LYS NZ :NH3+ -106:sc= 1.74 (180deg=0) USER MOD Set 2.1: A 451 ASN : amide:sc= 1.55 K(o=1.8,f=-3.2!) USER MOD Set 2.2: A 454 SER OG : rot 180:sc= 0.213 USER MOD Set 3.1: A 402 ASN : amide:sc= 1.93 K(o=2.9,f=-6.8!) USER MOD Set 3.2: A 448 SER OG : rot -77:sc= 0.932 USER MOD Single : A 393 SER OG : rot 180:sc= 0.0573 USER MOD Single : A 394 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 415 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 419 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 420 MET CE :methyl 157:sc= -0.0666 (180deg=-0.187) USER MOD Single : A 422 MET CE :methyl -153:sc= 0 (180deg=-0.113) USER MOD Single : A 426 ASN : amide:sc= 0.661 K(o=0.66,f=-0.3) USER MOD Single : A 429 SER OG : rot -112:sc= 0.886 USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 SER OG : rot 180:sc= 0.288 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 443 CYS SG : rot -77:sc= 0.198 USER MOD Single : A 449 TYR OH : rot 23:sc= 0.506 USER MOD Single : A 456 GLN : amide:sc= -0.0238 K(o=-0.024,f=-0.53) USER MOD Single : A 460 GLN : amide:sc= 0.175 X(o=0.18,f=0) USER MOD Single : A 461 SER OG : rot 82:sc= 0.871 USER MOD Single : A 462 MET CE :methyl -161:sc= -0.0404 (180deg=-1.44) USER MOD Single : A 463 ASN : amide:sc= 0.883 K(o=0.88,f=-5.3!) USER MOD Single : A 466 GLN : amide:sc= 0.692 K(o=0.69,f=-3!) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 172 N ALA A 390 -4.654 7.675 -9.824 1.00 0.00 N ATOM 173 CA ALA A 390 -4.554 6.852 -8.619 1.00 0.00 C ATOM 174 C ALA A 390 -3.126 6.372 -8.290 1.00 0.00 C ATOM 175 O ALA A 390 -2.778 6.266 -7.113 1.00 0.00 O ATOM 176 CB ALA A 390 -5.506 5.678 -8.859 1.00 0.00 C ATOM 0 HA ALA A 390 -4.823 7.441 -7.742 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -5.488 5.012 -7.996 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -6.518 6.055 -9.005 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -5.191 5.130 -9.747 1.00 0.00 H new ATOM 182 N ALA A 391 -2.298 6.124 -9.310 1.00 0.00 N ATOM 183 CA ALA A 391 -0.899 5.719 -9.181 1.00 0.00 C ATOM 184 C ALA A 391 0.017 6.895 -8.813 1.00 0.00 C ATOM 185 O ALA A 391 0.174 7.852 -9.575 1.00 0.00 O ATOM 186 CB ALA A 391 -0.489 5.004 -10.477 1.00 0.00 C ATOM 0 H ALA A 391 -2.597 6.203 -10.282 1.00 0.00 H new ATOM 0 HA ALA A 391 -0.787 5.025 -8.348 1.00 0.00 H new ATOM 0 HB1 ALA A 391 0.553 4.691 -10.406 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -1.121 4.129 -10.625 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -0.607 5.684 -11.321 1.00 0.00 H new ATOM 192 N GLY A 392 0.607 6.807 -7.614 1.00 0.00 N ATOM 193 CA GLY A 392 1.416 7.861 -6.991 1.00 0.00 C ATOM 194 C GLY A 392 0.580 8.867 -6.198 1.00 0.00 C ATOM 195 O GLY A 392 1.132 9.817 -5.645 1.00 0.00 O ATOM 0 H GLY A 392 0.531 5.973 -7.032 1.00 0.00 H new ATOM 0 HA2 GLY A 392 2.150 7.404 -6.327 1.00 0.00 H new ATOM 0 HA3 GLY A 392 1.972 8.390 -7.765 1.00 0.00 H new ATOM 199 N SER A 393 -0.736 8.668 -6.117 1.00 0.00 N ATOM 200 CA SER A 393 -1.639 9.508 -5.326 1.00 0.00 C ATOM 201 C SER A 393 -1.644 9.103 -3.842 1.00 0.00 C ATOM 202 O SER A 393 -1.356 7.960 -3.478 1.00 0.00 O ATOM 203 CB SER A 393 -3.055 9.461 -5.919 1.00 0.00 C ATOM 204 OG SER A 393 -3.948 10.291 -5.190 1.00 0.00 O ATOM 0 H SER A 393 -1.212 7.909 -6.605 1.00 0.00 H new ATOM 0 HA SER A 393 -1.274 10.534 -5.372 1.00 0.00 H new ATOM 0 HB2 SER A 393 -3.026 9.781 -6.961 1.00 0.00 H new ATOM 0 HB3 SER A 393 -3.421 8.434 -5.911 1.00 0.00 H new ATOM 0 HG SER A 393 -4.841 10.242 -5.591 1.00 0.00 H new ATOM 210 N GLN A 394 -2.001 10.052 -2.978 1.00 0.00 N ATOM 211 CA GLN A 394 -2.188 9.852 -1.542 1.00 0.00 C ATOM 212 C GLN A 394 -3.605 10.258 -1.111 1.00 0.00 C ATOM 213 O GLN A 394 -3.830 10.687 0.020 1.00 0.00 O ATOM 214 CB GLN A 394 -1.045 10.521 -0.761 1.00 0.00 C ATOM 215 CG GLN A 394 -0.960 12.049 -0.916 1.00 0.00 C ATOM 216 CD GLN A 394 0.314 12.573 -0.259 1.00 0.00 C ATOM 217 OE1 GLN A 394 1.359 12.685 -0.891 1.00 0.00 O ATOM 218 NE2 GLN A 394 0.291 12.865 1.024 1.00 0.00 N ATOM 0 H GLN A 394 -2.174 11.014 -3.269 1.00 0.00 H new ATOM 0 HA GLN A 394 -2.123 8.792 -1.296 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -1.160 10.284 0.297 1.00 0.00 H new ATOM 0 HB3 GLN A 394 -0.100 10.085 -1.084 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -0.970 12.316 -1.973 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -1.832 12.518 -0.461 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -0.577 12.773 1.553 1.00 0.00 H new ATOM 0 HE22 GLN A 394 1.141 13.183 1.490 1.00 0.00 H new ATOM 227 N LYS A 395 -4.583 10.121 -2.016 1.00 0.00 N ATOM 228 CA LYS A 395 -6.009 10.251 -1.710 1.00 0.00 C ATOM 229 C LYS A 395 -6.486 9.040 -0.883 1.00 0.00 C ATOM 230 O LYS A 395 -7.014 8.057 -1.413 1.00 0.00 O ATOM 231 CB LYS A 395 -6.781 10.466 -3.027 1.00 0.00 C ATOM 232 CG LYS A 395 -8.265 10.790 -2.788 1.00 0.00 C ATOM 233 CD LYS A 395 -9.061 10.916 -4.097 1.00 0.00 C ATOM 234 CE LYS A 395 -8.677 12.161 -4.908 1.00 0.00 C ATOM 235 NZ LYS A 395 -9.441 12.238 -6.179 1.00 0.00 N ATOM 0 H LYS A 395 -4.400 9.913 -2.998 1.00 0.00 H new ATOM 0 HA LYS A 395 -6.203 11.123 -1.085 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -6.320 11.279 -3.587 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -6.702 9.570 -3.642 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -8.709 10.009 -2.171 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -8.344 11.722 -2.228 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -8.895 10.027 -4.705 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -10.126 10.951 -3.868 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -8.865 13.056 -4.314 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -7.609 12.141 -5.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -9.158 13.091 -6.703 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -9.242 11.395 -6.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -10.459 12.282 -5.970 1.00 0.00 H new ATOM 249 N GLU A 396 -6.238 9.107 0.425 1.00 0.00 N ATOM 250 CA GLU A 396 -6.523 8.039 1.385 1.00 0.00 C ATOM 251 C GLU A 396 -8.040 7.772 1.475 1.00 0.00 C ATOM 252 O GLU A 396 -8.853 8.701 1.426 1.00 0.00 O ATOM 253 CB GLU A 396 -5.951 8.376 2.778 1.00 0.00 C ATOM 254 CG GLU A 396 -4.507 8.924 2.789 1.00 0.00 C ATOM 255 CD GLU A 396 -3.953 9.111 4.216 1.00 0.00 C ATOM 256 OE1 GLU A 396 -4.259 8.304 5.126 1.00 0.00 O ATOM 257 OE2 GLU A 396 -3.221 10.105 4.443 1.00 0.00 O ATOM 0 H GLU A 396 -5.821 9.930 0.859 1.00 0.00 H new ATOM 0 HA GLU A 396 -6.034 7.133 1.028 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -6.603 9.110 3.251 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.984 7.476 3.393 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -3.859 8.241 2.239 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -4.481 9.880 2.265 1.00 0.00 H new ATOM 264 N GLY A 397 -8.423 6.499 1.611 1.00 0.00 N ATOM 265 CA GLY A 397 -9.814 6.038 1.720 1.00 0.00 C ATOM 266 C GLY A 397 -10.378 6.132 3.149 1.00 0.00 C ATOM 267 O GLY A 397 -9.690 6.631 4.049 1.00 0.00 O ATOM 0 H GLY A 397 -7.751 5.733 1.650 1.00 0.00 H new ATOM 0 HA2 GLY A 397 -10.439 6.630 1.051 1.00 0.00 H new ATOM 0 HA3 GLY A 397 -9.874 5.004 1.381 1.00 0.00 H new ATOM 271 N PRO A 398 -11.622 5.661 3.375 1.00 0.00 N ATOM 272 CA PRO A 398 -12.285 5.697 4.678 1.00 0.00 C ATOM 273 C PRO A 398 -11.681 4.686 5.670 1.00 0.00 C ATOM 274 O PRO A 398 -10.805 3.892 5.324 1.00 0.00 O ATOM 275 CB PRO A 398 -13.765 5.424 4.378 1.00 0.00 C ATOM 276 CG PRO A 398 -13.722 4.550 3.127 1.00 0.00 C ATOM 277 CD PRO A 398 -12.515 5.097 2.367 1.00 0.00 C ATOM 0 HA PRO A 398 -12.152 6.659 5.173 1.00 0.00 H new ATOM 0 HB2 PRO A 398 -14.255 4.913 5.207 1.00 0.00 H new ATOM 0 HB3 PRO A 398 -14.316 6.348 4.203 1.00 0.00 H new ATOM 0 HG2 PRO A 398 -13.599 3.496 3.375 1.00 0.00 H new ATOM 0 HG3 PRO A 398 -14.639 4.635 2.544 1.00 0.00 H new ATOM 0 HD2 PRO A 398 -12.018 4.307 1.805 1.00 0.00 H new ATOM 0 HD3 PRO A 398 -12.820 5.857 1.647 1.00 0.00 H new ATOM 285 N GLU A 399 -12.156 4.723 6.919 1.00 0.00 N ATOM 286 CA GLU A 399 -11.677 3.869 8.013 1.00 0.00 C ATOM 287 C GLU A 399 -11.793 2.372 7.664 1.00 0.00 C ATOM 288 O GLU A 399 -12.867 1.874 7.317 1.00 0.00 O ATOM 289 CB GLU A 399 -12.447 4.212 9.302 1.00 0.00 C ATOM 290 CG GLU A 399 -11.883 3.490 10.533 1.00 0.00 C ATOM 291 CD GLU A 399 -12.620 3.926 11.809 1.00 0.00 C ATOM 292 OE1 GLU A 399 -13.643 3.295 12.169 1.00 0.00 O ATOM 293 OE2 GLU A 399 -12.177 4.897 12.467 1.00 0.00 O ATOM 0 H GLU A 399 -12.899 5.360 7.205 1.00 0.00 H new ATOM 0 HA GLU A 399 -10.617 4.065 8.171 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -12.410 5.289 9.468 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -13.496 3.944 9.177 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -11.979 2.412 10.403 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -10.819 3.706 10.631 1.00 0.00 H new ATOM 300 N GLY A 400 -10.662 1.658 7.739 1.00 0.00 N ATOM 301 CA GLY A 400 -10.551 0.225 7.428 1.00 0.00 C ATOM 302 C GLY A 400 -10.379 -0.099 5.939 1.00 0.00 C ATOM 303 O GLY A 400 -10.171 -1.262 5.604 1.00 0.00 O ATOM 0 H GLY A 400 -9.775 2.072 8.025 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -9.703 -0.186 7.975 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -11.443 -0.282 7.795 1.00 0.00 H new ATOM 307 N ALA A 401 -10.443 0.896 5.046 1.00 0.00 N ATOM 308 CA ALA A 401 -10.270 0.725 3.596 1.00 0.00 C ATOM 309 C ALA A 401 -8.819 0.925 3.111 1.00 0.00 C ATOM 310 O ALA A 401 -8.528 0.725 1.932 1.00 0.00 O ATOM 311 CB ALA A 401 -11.239 1.676 2.888 1.00 0.00 C ATOM 0 H ALA A 401 -10.620 1.864 5.316 1.00 0.00 H new ATOM 0 HA ALA A 401 -10.497 -0.311 3.346 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -11.131 1.569 1.809 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -12.262 1.434 3.176 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -11.015 2.703 3.175 1.00 0.00 H new ATOM 317 N ASN A 402 -7.904 1.309 4.007 1.00 0.00 N ATOM 318 CA ASN A 402 -6.498 1.577 3.699 1.00 0.00 C ATOM 319 C ASN A 402 -5.603 0.406 4.122 1.00 0.00 C ATOM 320 O ASN A 402 -5.682 -0.070 5.257 1.00 0.00 O ATOM 321 CB ASN A 402 -6.063 2.880 4.388 1.00 0.00 C ATOM 322 CG ASN A 402 -6.851 4.077 3.872 1.00 0.00 C ATOM 323 OD1 ASN A 402 -6.999 4.265 2.671 1.00 0.00 O ATOM 324 ND2 ASN A 402 -7.399 4.894 4.752 1.00 0.00 N ATOM 0 H ASN A 402 -8.128 1.445 4.993 1.00 0.00 H new ATOM 0 HA ASN A 402 -6.390 1.691 2.620 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -6.204 2.788 5.465 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -4.999 3.044 4.219 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -7.951 5.690 4.434 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -7.270 4.729 5.750 1.00 0.00 H new ATOM 331 N LEU A 403 -4.722 -0.027 3.216 1.00 0.00 N ATOM 332 CA LEU A 403 -3.773 -1.123 3.408 1.00 0.00 C ATOM 333 C LEU A 403 -2.326 -0.647 3.350 1.00 0.00 C ATOM 334 O LEU A 403 -1.992 0.260 2.586 1.00 0.00 O ATOM 335 CB LEU A 403 -3.963 -2.192 2.316 1.00 0.00 C ATOM 336 CG LEU A 403 -5.335 -2.882 2.292 1.00 0.00 C ATOM 337 CD1 LEU A 403 -5.293 -4.008 1.257 1.00 0.00 C ATOM 338 CD2 LEU A 403 -5.698 -3.470 3.659 1.00 0.00 C ATOM 0 H LEU A 403 -4.649 0.395 2.290 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.972 -1.537 4.397 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -3.793 -1.727 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -3.195 -2.955 2.443 1.00 0.00 H new ATOM 0 HG LEU A 403 -6.091 -2.140 2.036 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -6.260 -4.510 1.226 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -5.069 -3.591 0.275 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -4.520 -4.726 1.532 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -6.675 -3.949 3.601 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.949 -4.207 3.949 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -5.729 -2.673 4.402 1.00 0.00 H new ATOM 350 N PHE A 404 -1.489 -1.352 4.107 1.00 0.00 N ATOM 351 CA PHE A 404 -0.033 -1.297 4.099 1.00 0.00 C ATOM 352 C PHE A 404 0.504 -2.654 3.631 1.00 0.00 C ATOM 353 O PHE A 404 0.104 -3.706 4.135 1.00 0.00 O ATOM 354 CB PHE A 404 0.447 -0.962 5.513 1.00 0.00 C ATOM 355 CG PHE A 404 1.924 -1.191 5.769 1.00 0.00 C ATOM 356 CD1 PHE A 404 2.884 -0.276 5.296 1.00 0.00 C ATOM 357 CD2 PHE A 404 2.337 -2.297 6.533 1.00 0.00 C ATOM 358 CE1 PHE A 404 4.236 -0.431 5.648 1.00 0.00 C ATOM 359 CE2 PHE A 404 3.689 -2.459 6.877 1.00 0.00 C ATOM 360 CZ PHE A 404 4.634 -1.506 6.461 1.00 0.00 C ATOM 0 H PHE A 404 -1.837 -2.024 4.790 1.00 0.00 H new ATOM 0 HA PHE A 404 0.333 -0.529 3.418 1.00 0.00 H new ATOM 0 HB2 PHE A 404 0.218 0.084 5.718 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -0.125 -1.559 6.224 1.00 0.00 H new ATOM 0 HD1 PHE A 404 2.582 0.545 4.663 1.00 0.00 H new ATOM 0 HD2 PHE A 404 1.610 -3.027 6.857 1.00 0.00 H new ATOM 0 HE1 PHE A 404 4.970 0.277 5.293 1.00 0.00 H new ATOM 0 HE2 PHE A 404 4.001 -3.313 7.459 1.00 0.00 H new ATOM 0 HZ PHE A 404 5.666 -1.600 6.766 1.00 0.00 H new ATOM 370 N ILE A 405 1.405 -2.613 2.653 1.00 0.00 N ATOM 371 CA ILE A 405 2.059 -3.756 2.007 1.00 0.00 C ATOM 372 C ILE A 405 3.568 -3.642 2.259 1.00 0.00 C ATOM 373 O ILE A 405 4.125 -2.554 2.128 1.00 0.00 O ATOM 374 CB ILE A 405 1.756 -3.763 0.483 1.00 0.00 C ATOM 375 CG1 ILE A 405 0.255 -3.819 0.105 1.00 0.00 C ATOM 376 CG2 ILE A 405 2.447 -4.979 -0.168 1.00 0.00 C ATOM 377 CD1 ILE A 405 -0.540 -2.510 0.212 1.00 0.00 C ATOM 0 H ILE A 405 1.721 -1.725 2.263 1.00 0.00 H new ATOM 0 HA ILE A 405 1.682 -4.691 2.421 1.00 0.00 H new ATOM 0 HB ILE A 405 2.136 -2.809 0.117 1.00 0.00 H new ATOM 0 HG12 ILE A 405 0.177 -4.180 -0.921 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -0.227 -4.561 0.741 1.00 0.00 H new ATOM 0 HG21 ILE A 405 2.237 -4.988 -1.237 1.00 0.00 H new ATOM 0 HG22 ILE A 405 3.524 -4.913 -0.010 1.00 0.00 H new ATOM 0 HG23 ILE A 405 2.070 -5.897 0.283 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.575 -2.688 -0.081 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -0.510 -2.149 1.240 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.100 -1.762 -0.448 1.00 0.00 H new ATOM 389 N TYR A 406 4.236 -4.752 2.576 1.00 0.00 N ATOM 390 CA TYR A 406 5.678 -4.822 2.847 1.00 0.00 C ATOM 391 C TYR A 406 6.314 -6.079 2.214 1.00 0.00 C ATOM 392 O TYR A 406 5.636 -7.089 2.023 1.00 0.00 O ATOM 393 CB TYR A 406 5.905 -4.753 4.369 1.00 0.00 C ATOM 394 CG TYR A 406 7.301 -4.326 4.782 1.00 0.00 C ATOM 395 CD1 TYR A 406 8.352 -5.255 4.864 1.00 0.00 C ATOM 396 CD2 TYR A 406 7.552 -2.975 5.068 1.00 0.00 C ATOM 397 CE1 TYR A 406 9.657 -4.830 5.182 1.00 0.00 C ATOM 398 CE2 TYR A 406 8.844 -2.539 5.408 1.00 0.00 C ATOM 399 CZ TYR A 406 9.910 -3.465 5.449 1.00 0.00 C ATOM 400 OH TYR A 406 11.175 -3.053 5.745 1.00 0.00 O ATOM 0 H TYR A 406 3.776 -5.659 2.655 1.00 0.00 H new ATOM 0 HA TYR A 406 6.176 -3.971 2.383 1.00 0.00 H new ATOM 0 HB2 TYR A 406 5.185 -4.057 4.799 1.00 0.00 H new ATOM 0 HB3 TYR A 406 5.697 -5.733 4.799 1.00 0.00 H new ATOM 0 HD1 TYR A 406 8.158 -6.302 4.682 1.00 0.00 H new ATOM 0 HD2 TYR A 406 6.742 -2.262 5.026 1.00 0.00 H new ATOM 0 HE1 TYR A 406 10.464 -5.547 5.222 1.00 0.00 H new ATOM 0 HE2 TYR A 406 9.021 -1.499 5.637 1.00 0.00 H new ATOM 0 HH TYR A 406 11.176 -2.085 5.901 1.00 0.00 H new ATOM 410 N HIS A 407 7.605 -5.994 1.869 1.00 0.00 N ATOM 411 CA HIS A 407 8.451 -6.972 1.147 1.00 0.00 C ATOM 412 C HIS A 407 8.325 -6.893 -0.398 1.00 0.00 C ATOM 413 O HIS A 407 8.661 -7.848 -1.103 1.00 0.00 O ATOM 414 CB HIS A 407 8.325 -8.409 1.705 1.00 0.00 C ATOM 415 CG HIS A 407 8.704 -8.551 3.155 1.00 0.00 C ATOM 416 ND1 HIS A 407 9.986 -8.341 3.671 1.00 0.00 N ATOM 417 CD2 HIS A 407 7.874 -8.936 4.169 1.00 0.00 C ATOM 418 CE1 HIS A 407 9.892 -8.598 4.985 1.00 0.00 C ATOM 419 NE2 HIS A 407 8.638 -8.956 5.315 1.00 0.00 N ATOM 0 H HIS A 407 8.142 -5.160 2.108 1.00 0.00 H new ATOM 0 HA HIS A 407 9.477 -6.667 1.353 1.00 0.00 H new ATOM 0 HB2 HIS A 407 7.296 -8.746 1.577 1.00 0.00 H new ATOM 0 HB3 HIS A 407 8.954 -9.072 1.111 1.00 0.00 H new ATOM 0 HD2 HIS A 407 6.824 -9.177 4.088 1.00 0.00 H new ATOM 0 HE1 HIS A 407 10.713 -8.527 5.683 1.00 0.00 H new ATOM 0 HE2 HIS A 407 8.310 -9.200 6.250 1.00 0.00 H new ATOM 427 N LEU A 408 7.867 -5.756 -0.943 1.00 0.00 N ATOM 428 CA LEU A 408 7.802 -5.500 -2.394 1.00 0.00 C ATOM 429 C LEU A 408 9.201 -5.531 -3.057 1.00 0.00 C ATOM 430 O LEU A 408 10.204 -5.340 -2.360 1.00 0.00 O ATOM 431 CB LEU A 408 7.133 -4.134 -2.664 1.00 0.00 C ATOM 432 CG LEU A 408 5.654 -4.021 -2.241 1.00 0.00 C ATOM 433 CD1 LEU A 408 5.198 -2.560 -2.351 1.00 0.00 C ATOM 434 CD2 LEU A 408 4.759 -4.903 -3.126 1.00 0.00 C ATOM 0 H LEU A 408 7.526 -4.976 -0.382 1.00 0.00 H new ATOM 0 HA LEU A 408 7.206 -6.299 -2.835 1.00 0.00 H new ATOM 0 HB2 LEU A 408 7.701 -3.362 -2.144 1.00 0.00 H new ATOM 0 HB3 LEU A 408 7.205 -3.919 -3.730 1.00 0.00 H new ATOM 0 HG LEU A 408 5.565 -4.362 -1.210 1.00 0.00 H new ATOM 0 HD11 LEU A 408 4.153 -2.482 -2.052 1.00 0.00 H new ATOM 0 HD12 LEU A 408 5.810 -1.938 -1.698 1.00 0.00 H new ATOM 0 HD13 LEU A 408 5.307 -2.221 -3.381 1.00 0.00 H new ATOM 0 HD21 LEU A 408 3.722 -4.805 -2.807 1.00 0.00 H new ATOM 0 HD22 LEU A 408 4.850 -4.587 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 408 5.070 -5.944 -3.035 1.00 0.00 H new ATOM 446 N PRO A 409 9.289 -5.741 -4.386 1.00 0.00 N ATOM 447 CA PRO A 409 10.520 -5.579 -5.161 1.00 0.00 C ATOM 448 C PRO A 409 11.119 -4.164 -5.052 1.00 0.00 C ATOM 449 O PRO A 409 10.412 -3.191 -4.794 1.00 0.00 O ATOM 450 CB PRO A 409 10.149 -5.929 -6.606 1.00 0.00 C ATOM 451 CG PRO A 409 8.944 -6.852 -6.454 1.00 0.00 C ATOM 452 CD PRO A 409 8.230 -6.263 -5.241 1.00 0.00 C ATOM 0 HA PRO A 409 11.303 -6.232 -4.775 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.901 -5.038 -7.183 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.971 -6.425 -7.122 1.00 0.00 H new ATOM 0 HG2 PRO A 409 8.311 -6.843 -7.342 1.00 0.00 H new ATOM 0 HG3 PRO A 409 9.243 -7.887 -6.286 1.00 0.00 H new ATOM 0 HD2 PRO A 409 7.539 -5.474 -5.537 1.00 0.00 H new ATOM 0 HD3 PRO A 409 7.644 -7.022 -4.723 1.00 0.00 H new ATOM 460 N GLN A 410 12.432 -4.054 -5.271 1.00 0.00 N ATOM 461 CA GLN A 410 13.214 -2.820 -5.100 1.00 0.00 C ATOM 462 C GLN A 410 12.984 -1.787 -6.225 1.00 0.00 C ATOM 463 O GLN A 410 13.377 -0.627 -6.090 1.00 0.00 O ATOM 464 CB GLN A 410 14.716 -3.148 -4.986 1.00 0.00 C ATOM 465 CG GLN A 410 15.103 -4.043 -3.792 1.00 0.00 C ATOM 466 CD GLN A 410 14.889 -5.538 -4.050 1.00 0.00 C ATOM 467 OE1 GLN A 410 13.855 -6.115 -3.737 1.00 0.00 O ATOM 468 NE2 GLN A 410 15.842 -6.226 -4.644 1.00 0.00 N ATOM 0 H GLN A 410 13.000 -4.842 -5.581 1.00 0.00 H new ATOM 0 HA GLN A 410 12.862 -2.361 -4.176 1.00 0.00 H new ATOM 0 HB2 GLN A 410 15.035 -3.638 -5.906 1.00 0.00 H new ATOM 0 HB3 GLN A 410 15.271 -2.213 -4.914 1.00 0.00 H new ATOM 0 HG2 GLN A 410 16.151 -3.872 -3.545 1.00 0.00 H new ATOM 0 HG3 GLN A 410 14.518 -3.746 -2.922 1.00 0.00 H new ATOM 0 HE21 GLN A 410 16.711 -5.765 -4.913 1.00 0.00 H new ATOM 0 HE22 GLN A 410 15.711 -7.219 -4.835 1.00 0.00 H new ATOM 477 N GLU A 411 12.322 -2.189 -7.312 1.00 0.00 N ATOM 478 CA GLU A 411 11.996 -1.371 -8.487 1.00 0.00 C ATOM 479 C GLU A 411 10.479 -1.277 -8.770 1.00 0.00 C ATOM 480 O GLU A 411 10.077 -0.795 -9.833 1.00 0.00 O ATOM 481 CB GLU A 411 12.774 -1.896 -9.712 1.00 0.00 C ATOM 482 CG GLU A 411 12.405 -3.324 -10.146 1.00 0.00 C ATOM 483 CD GLU A 411 13.215 -4.389 -9.392 1.00 0.00 C ATOM 484 OE1 GLU A 411 12.782 -4.804 -8.292 1.00 0.00 O ATOM 485 OE2 GLU A 411 14.280 -4.817 -9.899 1.00 0.00 O ATOM 0 H GLU A 411 11.979 -3.145 -7.403 1.00 0.00 H new ATOM 0 HA GLU A 411 12.308 -0.349 -8.271 1.00 0.00 H new ATOM 0 HB2 GLU A 411 12.603 -1.221 -10.550 1.00 0.00 H new ATOM 0 HB3 GLU A 411 13.840 -1.863 -9.489 1.00 0.00 H new ATOM 0 HG2 GLU A 411 11.342 -3.490 -9.974 1.00 0.00 H new ATOM 0 HG3 GLU A 411 12.576 -3.432 -11.217 1.00 0.00 H new ATOM 492 N PHE A 412 9.626 -1.752 -7.851 1.00 0.00 N ATOM 493 CA PHE A 412 8.174 -1.840 -8.052 1.00 0.00 C ATOM 494 C PHE A 412 7.526 -0.451 -8.195 1.00 0.00 C ATOM 495 O PHE A 412 7.765 0.442 -7.377 1.00 0.00 O ATOM 496 CB PHE A 412 7.542 -2.639 -6.899 1.00 0.00 C ATOM 497 CG PHE A 412 6.424 -3.573 -7.316 1.00 0.00 C ATOM 498 CD1 PHE A 412 6.694 -4.618 -8.221 1.00 0.00 C ATOM 499 CD2 PHE A 412 5.136 -3.444 -6.758 1.00 0.00 C ATOM 500 CE1 PHE A 412 5.684 -5.533 -8.563 1.00 0.00 C ATOM 501 CE2 PHE A 412 4.128 -4.365 -7.097 1.00 0.00 C ATOM 502 CZ PHE A 412 4.402 -5.407 -8.000 1.00 0.00 C ATOM 0 H PHE A 412 9.929 -2.089 -6.937 1.00 0.00 H new ATOM 0 HA PHE A 412 7.988 -2.364 -8.990 1.00 0.00 H new ATOM 0 HB2 PHE A 412 8.321 -3.223 -6.409 1.00 0.00 H new ATOM 0 HB3 PHE A 412 7.155 -1.939 -6.159 1.00 0.00 H new ATOM 0 HD1 PHE A 412 7.679 -4.716 -8.653 1.00 0.00 H new ATOM 0 HD2 PHE A 412 4.923 -2.639 -6.071 1.00 0.00 H new ATOM 0 HE1 PHE A 412 5.892 -6.333 -9.258 1.00 0.00 H new ATOM 0 HE2 PHE A 412 3.143 -4.271 -6.663 1.00 0.00 H new ATOM 0 HZ PHE A 412 3.627 -6.112 -8.262 1.00 0.00 H new ATOM 512 N GLY A 413 6.700 -0.273 -9.232 1.00 0.00 N ATOM 513 CA GLY A 413 5.998 0.978 -9.527 1.00 0.00 C ATOM 514 C GLY A 413 4.616 1.060 -8.882 1.00 0.00 C ATOM 515 O GLY A 413 4.036 0.067 -8.443 1.00 0.00 O ATOM 0 H GLY A 413 6.497 -1.013 -9.904 1.00 0.00 H new ATOM 0 HA2 GLY A 413 6.603 1.816 -9.182 1.00 0.00 H new ATOM 0 HA3 GLY A 413 5.894 1.083 -10.607 1.00 0.00 H new ATOM 519 N ASP A 414 4.057 2.269 -8.875 1.00 0.00 N ATOM 520 CA ASP A 414 2.742 2.559 -8.290 1.00 0.00 C ATOM 521 C ASP A 414 1.591 1.876 -9.050 1.00 0.00 C ATOM 522 O ASP A 414 0.613 1.432 -8.448 1.00 0.00 O ATOM 523 CB ASP A 414 2.539 4.078 -8.282 1.00 0.00 C ATOM 524 CG ASP A 414 3.632 4.815 -7.498 1.00 0.00 C ATOM 525 OD1 ASP A 414 3.765 4.544 -6.284 1.00 0.00 O ATOM 526 OD2 ASP A 414 4.352 5.640 -8.106 1.00 0.00 O ATOM 0 H ASP A 414 4.509 3.089 -9.281 1.00 0.00 H new ATOM 0 HA ASP A 414 2.724 2.159 -7.276 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.524 4.444 -9.309 1.00 0.00 H new ATOM 0 HB3 ASP A 414 1.567 4.309 -7.847 1.00 0.00 H new ATOM 531 N GLN A 415 1.739 1.748 -10.372 1.00 0.00 N ATOM 532 CA GLN A 415 0.800 1.034 -11.238 1.00 0.00 C ATOM 533 C GLN A 415 0.942 -0.494 -11.109 1.00 0.00 C ATOM 534 O GLN A 415 -0.046 -1.208 -11.273 1.00 0.00 O ATOM 535 CB GLN A 415 1.001 1.511 -12.687 1.00 0.00 C ATOM 536 CG GLN A 415 -0.068 0.968 -13.650 1.00 0.00 C ATOM 537 CD GLN A 415 0.068 1.545 -15.063 1.00 0.00 C ATOM 538 OE1 GLN A 415 1.133 1.551 -15.670 1.00 0.00 O ATOM 539 NE2 GLN A 415 -0.998 2.055 -15.650 1.00 0.00 N ATOM 0 H GLN A 415 2.530 2.146 -10.878 1.00 0.00 H new ATOM 0 HA GLN A 415 -0.219 1.263 -10.924 1.00 0.00 H new ATOM 0 HB2 GLN A 415 0.984 2.601 -12.711 1.00 0.00 H new ATOM 0 HB3 GLN A 415 1.986 1.199 -13.033 1.00 0.00 H new ATOM 0 HG2 GLN A 415 0.007 -0.118 -13.696 1.00 0.00 H new ATOM 0 HG3 GLN A 415 -1.058 1.203 -13.259 1.00 0.00 H new ATOM 0 HE21 GLN A 415 -1.895 2.061 -15.164 1.00 0.00 H new ATOM 0 HE22 GLN A 415 -0.926 2.444 -16.590 1.00 0.00 H new ATOM 548 N ASP A 416 2.126 -1.011 -10.755 1.00 0.00 N ATOM 549 CA ASP A 416 2.321 -2.443 -10.497 1.00 0.00 C ATOM 550 C ASP A 416 1.582 -2.877 -9.220 1.00 0.00 C ATOM 551 O ASP A 416 0.942 -3.929 -9.205 1.00 0.00 O ATOM 552 CB ASP A 416 3.814 -2.800 -10.396 1.00 0.00 C ATOM 553 CG ASP A 416 4.602 -2.498 -11.678 1.00 0.00 C ATOM 554 OD1 ASP A 416 4.309 -3.117 -12.729 1.00 0.00 O ATOM 555 OD2 ASP A 416 5.539 -1.666 -11.619 1.00 0.00 O ATOM 0 H ASP A 416 2.971 -0.452 -10.640 1.00 0.00 H new ATOM 0 HA ASP A 416 1.901 -2.985 -11.344 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.257 -2.247 -9.568 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.911 -3.860 -10.160 1.00 0.00 H new ATOM 560 N LEU A 417 1.597 -2.030 -8.181 1.00 0.00 N ATOM 561 CA LEU A 417 0.828 -2.244 -6.954 1.00 0.00 C ATOM 562 C LEU A 417 -0.685 -2.133 -7.199 1.00 0.00 C ATOM 563 O LEU A 417 -1.453 -2.920 -6.648 1.00 0.00 O ATOM 564 CB LEU A 417 1.316 -1.249 -5.884 1.00 0.00 C ATOM 565 CG LEU A 417 0.821 -1.579 -4.459 1.00 0.00 C ATOM 566 CD1 LEU A 417 1.406 -2.903 -3.941 1.00 0.00 C ATOM 567 CD2 LEU A 417 1.210 -0.453 -3.493 1.00 0.00 C ATOM 0 H LEU A 417 2.148 -1.172 -8.172 1.00 0.00 H new ATOM 0 HA LEU A 417 0.995 -3.260 -6.598 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.406 -1.232 -5.886 1.00 0.00 H new ATOM 0 HB3 LEU A 417 0.981 -0.247 -6.153 1.00 0.00 H new ATOM 0 HG LEU A 417 -0.263 -1.677 -4.509 1.00 0.00 H new ATOM 0 HD11 LEU A 417 1.032 -3.097 -2.936 1.00 0.00 H new ATOM 0 HD12 LEU A 417 1.107 -3.716 -4.603 1.00 0.00 H new ATOM 0 HD13 LEU A 417 2.494 -2.836 -3.917 1.00 0.00 H new ATOM 0 HD21 LEU A 417 0.856 -0.695 -2.491 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.294 -0.344 -3.479 1.00 0.00 H new ATOM 0 HD23 LEU A 417 0.756 0.482 -3.822 1.00 0.00 H new ATOM 579 N LEU A 418 -1.121 -1.218 -8.071 1.00 0.00 N ATOM 580 CA LEU A 418 -2.526 -1.111 -8.480 1.00 0.00 C ATOM 581 C LEU A 418 -2.992 -2.361 -9.227 1.00 0.00 C ATOM 582 O LEU A 418 -4.006 -2.940 -8.854 1.00 0.00 O ATOM 583 CB LEU A 418 -2.711 0.156 -9.327 1.00 0.00 C ATOM 584 CG LEU A 418 -4.132 0.412 -9.863 1.00 0.00 C ATOM 585 CD1 LEU A 418 -5.150 0.634 -8.736 1.00 0.00 C ATOM 586 CD2 LEU A 418 -4.112 1.644 -10.779 1.00 0.00 C ATOM 0 H LEU A 418 -0.510 -0.531 -8.513 1.00 0.00 H new ATOM 0 HA LEU A 418 -3.149 -1.035 -7.589 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.410 1.016 -8.728 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -2.029 0.104 -10.175 1.00 0.00 H new ATOM 0 HG LEU A 418 -4.442 -0.475 -10.415 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -6.136 0.810 -9.166 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -5.185 -0.249 -8.098 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.853 1.499 -8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -5.116 1.830 -11.161 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.773 2.512 -10.214 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -3.433 1.466 -11.613 1.00 0.00 H new ATOM 598 N GLN A 419 -2.257 -2.801 -10.250 1.00 0.00 N ATOM 599 CA GLN A 419 -2.631 -3.976 -11.045 1.00 0.00 C ATOM 600 C GLN A 419 -2.566 -5.284 -10.233 1.00 0.00 C ATOM 601 O GLN A 419 -3.294 -6.230 -10.537 1.00 0.00 O ATOM 602 CB GLN A 419 -1.752 -4.052 -12.303 1.00 0.00 C ATOM 603 CG GLN A 419 -2.110 -2.947 -13.317 1.00 0.00 C ATOM 604 CD GLN A 419 -1.237 -2.952 -14.577 1.00 0.00 C ATOM 605 OE1 GLN A 419 -0.281 -3.706 -14.732 1.00 0.00 O ATOM 606 NE2 GLN A 419 -1.539 -2.111 -15.546 1.00 0.00 N ATOM 0 H GLN A 419 -1.390 -2.357 -10.551 1.00 0.00 H new ATOM 0 HA GLN A 419 -3.672 -3.859 -11.345 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -0.703 -3.960 -12.020 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -1.872 -5.029 -12.772 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -3.154 -3.061 -13.610 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -2.020 -1.977 -12.829 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -2.329 -1.474 -15.441 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -0.983 -2.097 -16.401 1.00 0.00 H new ATOM 615 N MET A 420 -1.759 -5.327 -9.166 1.00 0.00 N ATOM 616 CA MET A 420 -1.714 -6.425 -8.192 1.00 0.00 C ATOM 617 C MET A 420 -2.972 -6.483 -7.304 1.00 0.00 C ATOM 618 O MET A 420 -3.455 -7.578 -7.013 1.00 0.00 O ATOM 619 CB MET A 420 -0.429 -6.261 -7.361 1.00 0.00 C ATOM 620 CG MET A 420 -0.295 -7.252 -6.203 1.00 0.00 C ATOM 621 SD MET A 420 1.167 -6.961 -5.175 1.00 0.00 S ATOM 622 CE MET A 420 2.391 -7.874 -6.131 1.00 0.00 C ATOM 0 H MET A 420 -1.101 -4.578 -8.950 1.00 0.00 H new ATOM 0 HA MET A 420 -1.700 -7.378 -8.721 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.432 -6.372 -8.020 1.00 0.00 H new ATOM 0 HB3 MET A 420 -0.396 -5.247 -6.962 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.187 -7.193 -5.579 1.00 0.00 H new ATOM 0 HG3 MET A 420 -0.253 -8.265 -6.604 1.00 0.00 H new ATOM 0 HE1 MET A 420 3.387 -7.492 -5.906 1.00 0.00 H new ATOM 0 HE2 MET A 420 2.341 -8.931 -5.871 1.00 0.00 H new ATOM 0 HE3 MET A 420 2.187 -7.752 -7.195 1.00 0.00 H new ATOM 632 N PHE A 421 -3.512 -5.330 -6.888 1.00 0.00 N ATOM 633 CA PHE A 421 -4.634 -5.220 -5.941 1.00 0.00 C ATOM 634 C PHE A 421 -6.011 -4.957 -6.592 1.00 0.00 C ATOM 635 O PHE A 421 -7.043 -5.153 -5.947 1.00 0.00 O ATOM 636 CB PHE A 421 -4.264 -4.191 -4.857 1.00 0.00 C ATOM 637 CG PHE A 421 -3.385 -4.760 -3.751 1.00 0.00 C ATOM 638 CD1 PHE A 421 -2.002 -4.943 -3.943 1.00 0.00 C ATOM 639 CD2 PHE A 421 -3.960 -5.135 -2.521 1.00 0.00 C ATOM 640 CE1 PHE A 421 -1.212 -5.510 -2.927 1.00 0.00 C ATOM 641 CE2 PHE A 421 -3.174 -5.709 -1.507 1.00 0.00 C ATOM 642 CZ PHE A 421 -1.799 -5.907 -1.714 1.00 0.00 C ATOM 0 H PHE A 421 -3.173 -4.423 -7.208 1.00 0.00 H new ATOM 0 HA PHE A 421 -4.777 -6.197 -5.480 1.00 0.00 H new ATOM 0 HB2 PHE A 421 -3.748 -3.353 -5.325 1.00 0.00 H new ATOM 0 HB3 PHE A 421 -5.179 -3.796 -4.416 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -1.545 -4.646 -4.876 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -5.016 -4.980 -2.355 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -0.151 -5.641 -3.080 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.627 -5.997 -0.570 1.00 0.00 H new ATOM 0 HZ PHE A 421 -1.195 -6.363 -0.943 1.00 0.00 H new ATOM 652 N MET A 422 -6.049 -4.606 -7.882 1.00 0.00 N ATOM 653 CA MET A 422 -7.255 -4.487 -8.724 1.00 0.00 C ATOM 654 C MET A 422 -8.295 -5.625 -8.583 1.00 0.00 C ATOM 655 O MET A 422 -9.487 -5.301 -8.537 1.00 0.00 O ATOM 656 CB MET A 422 -6.825 -4.376 -10.203 1.00 0.00 C ATOM 657 CG MET A 422 -6.770 -2.932 -10.697 1.00 0.00 C ATOM 658 SD MET A 422 -6.133 -2.801 -12.389 1.00 0.00 S ATOM 659 CE MET A 422 -6.520 -1.067 -12.722 1.00 0.00 C ATOM 0 H MET A 422 -5.198 -4.385 -8.398 1.00 0.00 H new ATOM 0 HA MET A 422 -7.765 -3.592 -8.368 1.00 0.00 H new ATOM 0 HB2 MET A 422 -5.844 -4.835 -10.327 1.00 0.00 H new ATOM 0 HB3 MET A 422 -7.522 -4.941 -10.822 1.00 0.00 H new ATOM 0 HG2 MET A 422 -7.769 -2.498 -10.654 1.00 0.00 H new ATOM 0 HG3 MET A 422 -6.139 -2.346 -10.028 1.00 0.00 H new ATOM 0 HE1 MET A 422 -6.656 -0.924 -13.794 1.00 0.00 H new ATOM 0 HE2 MET A 422 -7.437 -0.792 -12.200 1.00 0.00 H new ATOM 0 HE3 MET A 422 -5.701 -0.438 -12.373 1.00 0.00 H new ATOM 669 N PRO A 423 -7.910 -6.921 -8.512 1.00 0.00 N ATOM 670 CA PRO A 423 -8.854 -8.041 -8.455 1.00 0.00 C ATOM 671 C PRO A 423 -9.779 -8.080 -7.228 1.00 0.00 C ATOM 672 O PRO A 423 -10.756 -8.829 -7.242 1.00 0.00 O ATOM 673 CB PRO A 423 -7.995 -9.309 -8.502 1.00 0.00 C ATOM 674 CG PRO A 423 -6.746 -8.865 -9.254 1.00 0.00 C ATOM 675 CD PRO A 423 -6.567 -7.436 -8.753 1.00 0.00 C ATOM 0 HA PRO A 423 -9.546 -7.939 -9.291 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -7.755 -9.668 -7.501 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -8.507 -10.121 -9.018 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -5.885 -9.491 -9.020 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -6.884 -8.904 -10.334 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -5.972 -7.415 -7.840 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -6.043 -6.827 -9.490 1.00 0.00 H new ATOM 683 N PHE A 424 -9.489 -7.302 -6.175 1.00 0.00 N ATOM 684 CA PHE A 424 -10.160 -7.402 -4.871 1.00 0.00 C ATOM 685 C PHE A 424 -11.165 -6.268 -4.591 1.00 0.00 C ATOM 686 O PHE A 424 -11.811 -6.280 -3.540 1.00 0.00 O ATOM 687 CB PHE A 424 -9.085 -7.516 -3.778 1.00 0.00 C ATOM 688 CG PHE A 424 -7.982 -8.512 -4.097 1.00 0.00 C ATOM 689 CD1 PHE A 424 -8.305 -9.861 -4.345 1.00 0.00 C ATOM 690 CD2 PHE A 424 -6.648 -8.080 -4.236 1.00 0.00 C ATOM 691 CE1 PHE A 424 -7.309 -10.761 -4.765 1.00 0.00 C ATOM 692 CE2 PHE A 424 -5.656 -8.980 -4.657 1.00 0.00 C ATOM 693 CZ PHE A 424 -5.985 -10.320 -4.924 1.00 0.00 C ATOM 0 H PHE A 424 -8.773 -6.576 -6.206 1.00 0.00 H new ATOM 0 HA PHE A 424 -10.779 -8.299 -4.878 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -8.639 -6.534 -3.618 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -9.562 -7.806 -2.842 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -9.320 -10.205 -4.212 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -6.388 -7.055 -4.018 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.562 -11.792 -4.965 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.637 -8.642 -4.776 1.00 0.00 H new ATOM 0 HZ PHE A 424 -5.221 -11.010 -5.251 1.00 0.00 H new ATOM 703 N GLY A 425 -11.332 -5.315 -5.522 1.00 0.00 N ATOM 704 CA GLY A 425 -12.336 -4.243 -5.452 1.00 0.00 C ATOM 705 C GLY A 425 -11.886 -2.893 -6.017 1.00 0.00 C ATOM 706 O GLY A 425 -10.834 -2.774 -6.646 1.00 0.00 O ATOM 0 H GLY A 425 -10.758 -5.268 -6.364 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -13.227 -4.566 -5.990 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -12.625 -4.105 -4.410 1.00 0.00 H new ATOM 710 N ASN A 426 -12.713 -1.869 -5.801 1.00 0.00 N ATOM 711 CA ASN A 426 -12.536 -0.519 -6.346 1.00 0.00 C ATOM 712 C ASN A 426 -11.485 0.308 -5.567 1.00 0.00 C ATOM 713 O ASN A 426 -11.670 0.582 -4.378 1.00 0.00 O ATOM 714 CB ASN A 426 -13.911 0.170 -6.354 1.00 0.00 C ATOM 715 CG ASN A 426 -13.824 1.610 -6.845 1.00 0.00 C ATOM 716 OD1 ASN A 426 -13.047 1.930 -7.734 1.00 0.00 O ATOM 717 ND2 ASN A 426 -14.583 2.512 -6.259 1.00 0.00 N ATOM 0 H ASN A 426 -13.550 -1.957 -5.225 1.00 0.00 H new ATOM 0 HA ASN A 426 -12.144 -0.591 -7.361 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -14.594 -0.390 -6.993 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -14.330 0.154 -5.348 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -14.527 3.489 -6.545 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -15.227 2.233 -5.519 1.00 0.00 H new ATOM 724 N VAL A 427 -10.408 0.730 -6.243 1.00 0.00 N ATOM 725 CA VAL A 427 -9.247 1.434 -5.659 1.00 0.00 C ATOM 726 C VAL A 427 -9.308 2.938 -5.966 1.00 0.00 C ATOM 727 O VAL A 427 -9.462 3.348 -7.117 1.00 0.00 O ATOM 728 CB VAL A 427 -7.907 0.829 -6.155 1.00 0.00 C ATOM 729 CG1 VAL A 427 -6.689 1.567 -5.576 1.00 0.00 C ATOM 730 CG2 VAL A 427 -7.785 -0.658 -5.773 1.00 0.00 C ATOM 0 H VAL A 427 -10.313 0.588 -7.249 1.00 0.00 H new ATOM 0 HA VAL A 427 -9.292 1.301 -4.578 1.00 0.00 H new ATOM 0 HB VAL A 427 -7.916 0.939 -7.239 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -5.774 1.109 -5.951 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.721 2.614 -5.878 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -6.708 1.502 -4.488 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -6.835 -1.050 -6.136 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -7.829 -0.760 -4.689 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -8.604 -1.218 -6.224 1.00 0.00 H new ATOM 740 N VAL A 428 -9.153 3.753 -4.921 1.00 0.00 N ATOM 741 CA VAL A 428 -9.133 5.228 -4.954 1.00 0.00 C ATOM 742 C VAL A 428 -7.706 5.759 -5.185 1.00 0.00 C ATOM 743 O VAL A 428 -7.522 6.729 -5.917 1.00 0.00 O ATOM 744 CB VAL A 428 -9.708 5.813 -3.637 1.00 0.00 C ATOM 745 CG1 VAL A 428 -9.755 7.350 -3.654 1.00 0.00 C ATOM 746 CG2 VAL A 428 -11.131 5.294 -3.359 1.00 0.00 C ATOM 0 H VAL A 428 -9.031 3.389 -3.976 1.00 0.00 H new ATOM 0 HA VAL A 428 -9.759 5.549 -5.787 1.00 0.00 H new ATOM 0 HB VAL A 428 -9.031 5.482 -2.849 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -10.165 7.712 -2.711 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -8.747 7.743 -3.787 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -10.387 7.686 -4.477 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -11.500 5.725 -2.429 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -11.790 5.581 -4.179 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -11.112 4.208 -3.273 1.00 0.00 H new ATOM 756 N SER A 429 -6.687 5.098 -4.625 1.00 0.00 N ATOM 757 CA SER A 429 -5.265 5.426 -4.818 1.00 0.00 C ATOM 758 C SER A 429 -4.345 4.242 -4.469 1.00 0.00 C ATOM 759 O SER A 429 -4.714 3.365 -3.682 1.00 0.00 O ATOM 760 CB SER A 429 -4.856 6.676 -4.018 1.00 0.00 C ATOM 761 OG SER A 429 -4.959 6.485 -2.617 1.00 0.00 O ATOM 0 H SER A 429 -6.829 4.298 -4.008 1.00 0.00 H new ATOM 0 HA SER A 429 -5.141 5.643 -5.879 1.00 0.00 H new ATOM 0 HB2 SER A 429 -3.830 6.944 -4.270 1.00 0.00 H new ATOM 0 HB3 SER A 429 -5.486 7.514 -4.314 1.00 0.00 H new ATOM 0 HG SER A 429 -5.677 7.049 -2.262 1.00 0.00 H new ATOM 767 N ALA A 430 -3.141 4.224 -5.049 1.00 0.00 N ATOM 768 CA ALA A 430 -2.107 3.214 -4.827 1.00 0.00 C ATOM 769 C ALA A 430 -0.718 3.852 -4.979 1.00 0.00 C ATOM 770 O ALA A 430 -0.470 4.608 -5.923 1.00 0.00 O ATOM 771 CB ALA A 430 -2.317 2.051 -5.807 1.00 0.00 C ATOM 0 H ALA A 430 -2.851 4.942 -5.712 1.00 0.00 H new ATOM 0 HA ALA A 430 -2.176 2.817 -3.814 1.00 0.00 H new ATOM 0 HB1 ALA A 430 -1.548 1.295 -5.645 1.00 0.00 H new ATOM 0 HB2 ALA A 430 -3.300 1.610 -5.643 1.00 0.00 H new ATOM 0 HB3 ALA A 430 -2.252 2.421 -6.830 1.00 0.00 H new ATOM 777 N LYS A 431 0.191 3.567 -4.045 1.00 0.00 N ATOM 778 CA LYS A 431 1.470 4.279 -3.933 1.00 0.00 C ATOM 779 C LYS A 431 2.552 3.422 -3.256 1.00 0.00 C ATOM 780 O LYS A 431 2.399 3.031 -2.102 1.00 0.00 O ATOM 781 CB LYS A 431 1.195 5.603 -3.191 1.00 0.00 C ATOM 782 CG LYS A 431 2.421 6.516 -3.044 1.00 0.00 C ATOM 783 CD LYS A 431 1.979 7.920 -2.604 1.00 0.00 C ATOM 784 CE LYS A 431 3.196 8.818 -2.356 1.00 0.00 C ATOM 785 NZ LYS A 431 2.814 10.228 -2.091 1.00 0.00 N ATOM 0 H LYS A 431 0.064 2.837 -3.344 1.00 0.00 H new ATOM 0 HA LYS A 431 1.875 4.494 -4.922 1.00 0.00 H new ATOM 0 HB2 LYS A 431 0.414 6.147 -3.722 1.00 0.00 H new ATOM 0 HB3 LYS A 431 0.806 5.375 -2.199 1.00 0.00 H new ATOM 0 HG2 LYS A 431 3.112 6.097 -2.312 1.00 0.00 H new ATOM 0 HG3 LYS A 431 2.957 6.574 -3.991 1.00 0.00 H new ATOM 0 HD2 LYS A 431 1.344 8.364 -3.371 1.00 0.00 H new ATOM 0 HD3 LYS A 431 1.381 7.850 -1.695 1.00 0.00 H new ATOM 0 HE2 LYS A 431 3.762 8.432 -1.508 1.00 0.00 H new ATOM 0 HE3 LYS A 431 3.855 8.780 -3.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 3.671 10.795 -1.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 2.297 10.607 -2.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 2.207 10.271 -1.248 1.00 0.00 H new ATOM 799 N VAL A 432 3.649 3.146 -3.956 1.00 0.00 N ATOM 800 CA VAL A 432 4.861 2.505 -3.417 1.00 0.00 C ATOM 801 C VAL A 432 5.779 3.616 -2.900 1.00 0.00 C ATOM 802 O VAL A 432 5.898 4.661 -3.539 1.00 0.00 O ATOM 803 CB VAL A 432 5.591 1.653 -4.487 1.00 0.00 C ATOM 804 CG1 VAL A 432 6.816 0.936 -3.892 1.00 0.00 C ATOM 805 CG2 VAL A 432 4.671 0.574 -5.082 1.00 0.00 C ATOM 0 H VAL A 432 3.729 3.367 -4.949 1.00 0.00 H new ATOM 0 HA VAL A 432 4.584 1.822 -2.614 1.00 0.00 H new ATOM 0 HB VAL A 432 5.899 2.351 -5.266 1.00 0.00 H new ATOM 0 HG11 VAL A 432 7.305 0.347 -4.668 1.00 0.00 H new ATOM 0 HG12 VAL A 432 7.516 1.675 -3.501 1.00 0.00 H new ATOM 0 HG13 VAL A 432 6.496 0.277 -3.085 1.00 0.00 H new ATOM 0 HG21 VAL A 432 5.220 -0.001 -5.828 1.00 0.00 H new ATOM 0 HG22 VAL A 432 4.330 -0.091 -4.289 1.00 0.00 H new ATOM 0 HG23 VAL A 432 3.810 1.049 -5.552 1.00 0.00 H new ATOM 815 N PHE A 433 6.410 3.412 -1.741 1.00 0.00 N ATOM 816 CA PHE A 433 7.308 4.397 -1.146 1.00 0.00 C ATOM 817 C PHE A 433 8.699 4.318 -1.799 1.00 0.00 C ATOM 818 O PHE A 433 9.424 3.332 -1.645 1.00 0.00 O ATOM 819 CB PHE A 433 7.335 4.208 0.374 1.00 0.00 C ATOM 820 CG PHE A 433 7.902 5.394 1.133 1.00 0.00 C ATOM 821 CD1 PHE A 433 9.294 5.553 1.255 1.00 0.00 C ATOM 822 CD2 PHE A 433 7.040 6.333 1.736 1.00 0.00 C ATOM 823 CE1 PHE A 433 9.824 6.628 1.989 1.00 0.00 C ATOM 824 CE2 PHE A 433 7.570 7.409 2.471 1.00 0.00 C ATOM 825 CZ PHE A 433 8.962 7.551 2.604 1.00 0.00 C ATOM 0 H PHE A 433 6.311 2.559 -1.191 1.00 0.00 H new ATOM 0 HA PHE A 433 6.944 5.407 -1.336 1.00 0.00 H new ATOM 0 HB2 PHE A 433 6.321 4.017 0.724 1.00 0.00 H new ATOM 0 HB3 PHE A 433 7.926 3.323 0.609 1.00 0.00 H new ATOM 0 HD1 PHE A 433 9.959 4.845 0.782 1.00 0.00 H new ATOM 0 HD2 PHE A 433 5.970 6.226 1.633 1.00 0.00 H new ATOM 0 HE1 PHE A 433 10.894 6.744 2.080 1.00 0.00 H new ATOM 0 HE2 PHE A 433 6.907 8.126 2.933 1.00 0.00 H new ATOM 0 HZ PHE A 433 9.369 8.370 3.179 1.00 0.00 H new ATOM 835 N ILE A 434 9.068 5.362 -2.545 1.00 0.00 N ATOM 836 CA ILE A 434 10.312 5.463 -3.325 1.00 0.00 C ATOM 837 C ILE A 434 11.230 6.521 -2.703 1.00 0.00 C ATOM 838 O ILE A 434 10.796 7.638 -2.422 1.00 0.00 O ATOM 839 CB ILE A 434 10.000 5.805 -4.804 1.00 0.00 C ATOM 840 CG1 ILE A 434 8.933 4.908 -5.475 1.00 0.00 C ATOM 841 CG2 ILE A 434 11.290 5.774 -5.641 1.00 0.00 C ATOM 842 CD1 ILE A 434 9.213 3.401 -5.457 1.00 0.00 C ATOM 0 H ILE A 434 8.487 6.196 -2.628 1.00 0.00 H new ATOM 0 HA ILE A 434 10.823 4.501 -3.304 1.00 0.00 H new ATOM 0 HB ILE A 434 9.572 6.807 -4.775 1.00 0.00 H new ATOM 0 HG12 ILE A 434 7.977 5.085 -4.983 1.00 0.00 H new ATOM 0 HG13 ILE A 434 8.822 5.224 -6.512 1.00 0.00 H new ATOM 0 HG21 ILE A 434 11.057 6.016 -6.678 1.00 0.00 H new ATOM 0 HG22 ILE A 434 11.996 6.505 -5.248 1.00 0.00 H new ATOM 0 HG23 ILE A 434 11.732 4.779 -5.591 1.00 0.00 H new ATOM 0 HD11 ILE A 434 8.399 2.874 -5.955 1.00 0.00 H new ATOM 0 HD12 ILE A 434 10.149 3.199 -5.978 1.00 0.00 H new ATOM 0 HD13 ILE A 434 9.291 3.058 -4.425 1.00 0.00 H new ATOM 952 N SER A 441 12.774 1.662 -4.475 1.00 0.00 N ATOM 953 CA SER A 441 11.692 1.324 -3.544 1.00 0.00 C ATOM 954 C SER A 441 12.250 0.913 -2.174 1.00 0.00 C ATOM 955 O SER A 441 13.197 0.126 -2.072 1.00 0.00 O ATOM 956 CB SER A 441 10.815 0.207 -4.122 1.00 0.00 C ATOM 957 OG SER A 441 9.841 -0.221 -3.183 1.00 0.00 O ATOM 0 HA SER A 441 11.077 2.213 -3.405 1.00 0.00 H new ATOM 0 HB2 SER A 441 10.320 0.561 -5.027 1.00 0.00 H new ATOM 0 HB3 SER A 441 11.441 -0.637 -4.411 1.00 0.00 H new ATOM 0 HG SER A 441 9.295 -0.932 -3.579 1.00 0.00 H new ATOM 963 N LYS A 442 11.618 1.400 -1.102 1.00 0.00 N ATOM 964 CA LYS A 442 11.875 0.947 0.269 1.00 0.00 C ATOM 965 C LYS A 442 11.140 -0.371 0.615 1.00 0.00 C ATOM 966 O LYS A 442 10.965 -0.699 1.790 1.00 0.00 O ATOM 967 CB LYS A 442 11.555 2.088 1.257 1.00 0.00 C ATOM 968 CG LYS A 442 12.350 3.393 1.063 1.00 0.00 C ATOM 969 CD LYS A 442 13.874 3.254 0.924 1.00 0.00 C ATOM 970 CE LYS A 442 14.514 2.312 1.955 1.00 0.00 C ATOM 971 NZ LYS A 442 15.981 2.179 1.734 1.00 0.00 N ATOM 0 H LYS A 442 10.906 2.128 -1.162 1.00 0.00 H new ATOM 0 HA LYS A 442 12.934 0.704 0.357 1.00 0.00 H new ATOM 0 HB2 LYS A 442 10.492 2.319 1.182 1.00 0.00 H new ATOM 0 HB3 LYS A 442 11.732 1.725 2.270 1.00 0.00 H new ATOM 0 HG2 LYS A 442 11.971 3.894 0.173 1.00 0.00 H new ATOM 0 HG3 LYS A 442 12.143 4.047 1.910 1.00 0.00 H new ATOM 0 HD2 LYS A 442 14.105 2.890 -0.077 1.00 0.00 H new ATOM 0 HD3 LYS A 442 14.328 4.240 1.018 1.00 0.00 H new ATOM 0 HE2 LYS A 442 14.329 2.691 2.960 1.00 0.00 H new ATOM 0 HE3 LYS A 442 14.045 1.330 1.893 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 16.383 1.537 2.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 16.155 1.795 0.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 16.431 3.113 1.817 1.00 0.00 H new ATOM 985 N CYS A 443 10.658 -1.100 -0.401 1.00 0.00 N ATOM 986 CA CYS A 443 10.000 -2.410 -0.298 1.00 0.00 C ATOM 987 C CYS A 443 8.638 -2.356 0.428 1.00 0.00 C ATOM 988 O CYS A 443 8.116 -3.404 0.813 1.00 0.00 O ATOM 989 CB CYS A 443 10.976 -3.443 0.302 1.00 0.00 C ATOM 990 SG CYS A 443 12.404 -3.655 -0.804 1.00 0.00 S ATOM 0 H CYS A 443 10.720 -0.775 -1.366 1.00 0.00 H new ATOM 0 HA CYS A 443 9.746 -2.738 -1.306 1.00 0.00 H new ATOM 0 HB2 CYS A 443 11.311 -3.112 1.285 1.00 0.00 H new ATOM 0 HB3 CYS A 443 10.469 -4.397 0.443 1.00 0.00 H new ATOM 0 HG CYS A 443 12.062 -4.395 -1.817 1.00 0.00 H new ATOM 996 N PHE A 444 8.044 -1.167 0.584 1.00 0.00 N ATOM 997 CA PHE A 444 6.740 -0.963 1.220 1.00 0.00 C ATOM 998 C PHE A 444 5.866 0.017 0.434 1.00 0.00 C ATOM 999 O PHE A 444 6.369 0.908 -0.252 1.00 0.00 O ATOM 1000 CB PHE A 444 6.907 -0.581 2.700 1.00 0.00 C ATOM 1001 CG PHE A 444 7.322 0.843 3.032 1.00 0.00 C ATOM 1002 CD1 PHE A 444 6.361 1.872 3.089 1.00 0.00 C ATOM 1003 CD2 PHE A 444 8.658 1.124 3.376 1.00 0.00 C ATOM 1004 CE1 PHE A 444 6.743 3.172 3.468 1.00 0.00 C ATOM 1005 CE2 PHE A 444 9.044 2.427 3.738 1.00 0.00 C ATOM 1006 CZ PHE A 444 8.082 3.451 3.791 1.00 0.00 C ATOM 0 H PHE A 444 8.470 -0.298 0.262 1.00 0.00 H new ATOM 0 HA PHE A 444 6.200 -1.910 1.201 1.00 0.00 H new ATOM 0 HB2 PHE A 444 5.960 -0.778 3.203 1.00 0.00 H new ATOM 0 HB3 PHE A 444 7.646 -1.253 3.136 1.00 0.00 H new ATOM 0 HD1 PHE A 444 5.331 1.663 2.842 1.00 0.00 H new ATOM 0 HD2 PHE A 444 9.393 0.332 3.362 1.00 0.00 H new ATOM 0 HE1 PHE A 444 6.004 3.959 3.511 1.00 0.00 H new ATOM 0 HE2 PHE A 444 10.076 2.640 3.975 1.00 0.00 H new ATOM 0 HZ PHE A 444 8.372 4.451 4.080 1.00 0.00 H new ATOM 1016 N GLY A 445 4.548 -0.179 0.510 1.00 0.00 N ATOM 1017 CA GLY A 445 3.550 0.586 -0.236 1.00 0.00 C ATOM 1018 C GLY A 445 2.158 0.560 0.386 1.00 0.00 C ATOM 1019 O GLY A 445 1.928 -0.060 1.425 1.00 0.00 O ATOM 0 H GLY A 445 4.135 -0.894 1.109 1.00 0.00 H new ATOM 0 HA2 GLY A 445 3.883 1.621 -0.313 1.00 0.00 H new ATOM 0 HA3 GLY A 445 3.491 0.194 -1.251 1.00 0.00 H new ATOM 1023 N PHE A 446 1.226 1.236 -0.284 1.00 0.00 N ATOM 1024 CA PHE A 446 -0.114 1.545 0.203 1.00 0.00 C ATOM 1025 C PHE A 446 -1.166 1.367 -0.892 1.00 0.00 C ATOM 1026 O PHE A 446 -0.904 1.664 -2.057 1.00 0.00 O ATOM 1027 CB PHE A 446 -0.139 2.994 0.717 1.00 0.00 C ATOM 1028 CG PHE A 446 0.907 3.275 1.774 1.00 0.00 C ATOM 1029 CD1 PHE A 446 0.711 2.800 3.081 1.00 0.00 C ATOM 1030 CD2 PHE A 446 2.101 3.938 1.436 1.00 0.00 C ATOM 1031 CE1 PHE A 446 1.698 3.003 4.058 1.00 0.00 C ATOM 1032 CE2 PHE A 446 3.102 4.113 2.407 1.00 0.00 C ATOM 1033 CZ PHE A 446 2.901 3.646 3.716 1.00 0.00 C ATOM 0 H PHE A 446 1.394 1.599 -1.223 1.00 0.00 H new ATOM 0 HA PHE A 446 -0.355 0.853 1.010 1.00 0.00 H new ATOM 0 HB2 PHE A 446 0.012 3.672 -0.123 1.00 0.00 H new ATOM 0 HB3 PHE A 446 -1.126 3.209 1.127 1.00 0.00 H new ATOM 0 HD1 PHE A 446 -0.200 2.278 3.335 1.00 0.00 H new ATOM 0 HD2 PHE A 446 2.248 4.311 0.433 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.534 2.666 5.071 1.00 0.00 H new ATOM 0 HE2 PHE A 446 4.026 4.607 2.146 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.671 3.781 4.461 1.00 0.00 H new ATOM 1043 N VAL A 447 -2.367 0.935 -0.502 1.00 0.00 N ATOM 1044 CA VAL A 447 -3.541 0.816 -1.387 1.00 0.00 C ATOM 1045 C VAL A 447 -4.783 1.266 -0.621 1.00 0.00 C ATOM 1046 O VAL A 447 -5.027 0.804 0.491 1.00 0.00 O ATOM 1047 CB VAL A 447 -3.729 -0.623 -1.934 1.00 0.00 C ATOM 1048 CG1 VAL A 447 -5.003 -0.749 -2.792 1.00 0.00 C ATOM 1049 CG2 VAL A 447 -2.534 -1.063 -2.796 1.00 0.00 C ATOM 0 H VAL A 447 -2.561 0.650 0.458 1.00 0.00 H new ATOM 0 HA VAL A 447 -3.380 1.456 -2.255 1.00 0.00 H new ATOM 0 HB VAL A 447 -3.811 -1.265 -1.057 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -5.097 -1.772 -3.156 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -5.875 -0.497 -2.188 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -4.939 -0.067 -3.640 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -2.702 -2.076 -3.161 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -2.427 -0.385 -3.643 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -1.624 -1.040 -2.196 1.00 0.00 H new ATOM 1059 N SER A 448 -5.561 2.164 -1.216 1.00 0.00 N ATOM 1060 CA SER A 448 -6.777 2.736 -0.628 1.00 0.00 C ATOM 1061 C SER A 448 -8.013 2.336 -1.437 1.00 0.00 C ATOM 1062 O SER A 448 -8.209 2.801 -2.560 1.00 0.00 O ATOM 1063 CB SER A 448 -6.670 4.265 -0.594 1.00 0.00 C ATOM 1064 OG SER A 448 -5.622 4.687 0.262 1.00 0.00 O ATOM 0 H SER A 448 -5.361 2.527 -2.148 1.00 0.00 H new ATOM 0 HA SER A 448 -6.879 2.349 0.386 1.00 0.00 H new ATOM 0 HB2 SER A 448 -6.494 4.642 -1.601 1.00 0.00 H new ATOM 0 HB3 SER A 448 -7.614 4.691 -0.254 1.00 0.00 H new ATOM 0 HG SER A 448 -5.913 4.615 1.195 1.00 0.00 H new ATOM 1070 N TYR A 449 -8.874 1.501 -0.858 1.00 0.00 N ATOM 1071 CA TYR A 449 -10.179 1.147 -1.430 1.00 0.00 C ATOM 1072 C TYR A 449 -11.259 2.189 -1.090 1.00 0.00 C ATOM 1073 O TYR A 449 -11.067 3.059 -0.237 1.00 0.00 O ATOM 1074 CB TYR A 449 -10.577 -0.254 -0.943 1.00 0.00 C ATOM 1075 CG TYR A 449 -9.717 -1.358 -1.526 1.00 0.00 C ATOM 1076 CD1 TYR A 449 -10.061 -1.931 -2.766 1.00 0.00 C ATOM 1077 CD2 TYR A 449 -8.563 -1.793 -0.847 1.00 0.00 C ATOM 1078 CE1 TYR A 449 -9.257 -2.938 -3.331 1.00 0.00 C ATOM 1079 CE2 TYR A 449 -7.761 -2.803 -1.403 1.00 0.00 C ATOM 1080 CZ TYR A 449 -8.105 -3.374 -2.647 1.00 0.00 C ATOM 1081 OH TYR A 449 -7.309 -4.331 -3.188 1.00 0.00 O ATOM 0 H TYR A 449 -8.686 1.043 0.034 1.00 0.00 H new ATOM 0 HA TYR A 449 -10.094 1.140 -2.517 1.00 0.00 H new ATOM 0 HB2 TYR A 449 -10.509 -0.286 0.144 1.00 0.00 H new ATOM 0 HB3 TYR A 449 -11.619 -0.439 -1.203 1.00 0.00 H new ATOM 0 HD1 TYR A 449 -10.946 -1.596 -3.286 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -8.295 -1.350 0.101 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -9.521 -3.374 -4.283 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -6.880 -3.143 -0.878 1.00 0.00 H new ATOM 0 HH TYR A 449 -7.441 -4.356 -4.159 1.00 0.00 H new ATOM 1091 N ASP A 450 -12.421 2.084 -1.736 1.00 0.00 N ATOM 1092 CA ASP A 450 -13.602 2.903 -1.428 1.00 0.00 C ATOM 1093 C ASP A 450 -14.413 2.408 -0.209 1.00 0.00 C ATOM 1094 O ASP A 450 -15.330 3.098 0.234 1.00 0.00 O ATOM 1095 CB ASP A 450 -14.479 3.049 -2.684 1.00 0.00 C ATOM 1096 CG ASP A 450 -15.288 1.804 -3.091 1.00 0.00 C ATOM 1097 OD1 ASP A 450 -15.006 0.681 -2.616 1.00 0.00 O ATOM 1098 OD2 ASP A 450 -16.202 1.969 -3.932 1.00 0.00 O ATOM 0 H ASP A 450 -12.574 1.422 -2.497 1.00 0.00 H new ATOM 0 HA ASP A 450 -13.236 3.886 -1.130 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -15.174 3.873 -2.524 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -13.838 3.331 -3.520 1.00 0.00 H new ATOM 1103 N ASN A 451 -14.072 1.236 0.347 1.00 0.00 N ATOM 1104 CA ASN A 451 -14.768 0.587 1.464 1.00 0.00 C ATOM 1105 C ASN A 451 -13.883 -0.497 2.137 1.00 0.00 C ATOM 1106 O ASN A 451 -12.921 -0.970 1.517 1.00 0.00 O ATOM 1107 CB ASN A 451 -16.112 0.017 0.963 1.00 0.00 C ATOM 1108 CG ASN A 451 -15.958 -1.378 0.371 1.00 0.00 C ATOM 1109 OD1 ASN A 451 -15.979 -2.364 1.097 1.00 0.00 O ATOM 1110 ND2 ASN A 451 -15.736 -1.503 -0.919 1.00 0.00 N ATOM 0 H ASN A 451 -13.273 0.695 0.017 1.00 0.00 H new ATOM 0 HA ASN A 451 -14.974 1.328 2.237 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -16.822 -0.017 1.790 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -16.531 0.685 0.211 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -15.580 -2.427 -1.322 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -15.720 -0.676 -1.516 1.00 0.00 H new ATOM 1117 N PRO A 452 -14.198 -0.928 3.377 1.00 0.00 N ATOM 1118 CA PRO A 452 -13.336 -1.818 4.150 1.00 0.00 C ATOM 1119 C PRO A 452 -13.457 -3.305 3.780 1.00 0.00 C ATOM 1120 O PRO A 452 -12.538 -4.060 4.089 1.00 0.00 O ATOM 1121 CB PRO A 452 -13.709 -1.563 5.611 1.00 0.00 C ATOM 1122 CG PRO A 452 -15.185 -1.191 5.539 1.00 0.00 C ATOM 1123 CD PRO A 452 -15.316 -0.473 4.196 1.00 0.00 C ATOM 0 HA PRO A 452 -12.290 -1.599 3.938 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -13.547 -2.447 6.227 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -13.113 -0.760 6.044 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -15.823 -2.074 5.584 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -15.476 -0.545 6.368 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -16.268 -0.709 3.720 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -15.286 0.608 4.329 1.00 0.00 H new ATOM 1131 N VAL A 453 -14.525 -3.746 3.101 1.00 0.00 N ATOM 1132 CA VAL A 453 -14.709 -5.163 2.726 1.00 0.00 C ATOM 1133 C VAL A 453 -13.752 -5.541 1.587 1.00 0.00 C ATOM 1134 O VAL A 453 -13.176 -6.626 1.612 1.00 0.00 O ATOM 1135 CB VAL A 453 -16.173 -5.487 2.337 1.00 0.00 C ATOM 1136 CG1 VAL A 453 -16.373 -6.991 2.073 1.00 0.00 C ATOM 1137 CG2 VAL A 453 -17.158 -5.052 3.438 1.00 0.00 C ATOM 0 H VAL A 453 -15.284 -3.137 2.796 1.00 0.00 H new ATOM 0 HA VAL A 453 -14.475 -5.762 3.606 1.00 0.00 H new ATOM 0 HB VAL A 453 -16.375 -4.929 1.423 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -17.412 -7.178 1.803 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -15.724 -7.307 1.256 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -16.125 -7.554 2.972 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -18.176 -5.294 3.132 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -16.923 -5.576 4.364 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -17.073 -3.977 3.598 1.00 0.00 H new ATOM 1147 N SER A 454 -13.507 -4.634 0.635 1.00 0.00 N ATOM 1148 CA SER A 454 -12.519 -4.840 -0.437 1.00 0.00 C ATOM 1149 C SER A 454 -11.085 -4.922 0.115 1.00 0.00 C ATOM 1150 O SER A 454 -10.311 -5.795 -0.280 1.00 0.00 O ATOM 1151 CB SER A 454 -12.613 -3.702 -1.459 1.00 0.00 C ATOM 1152 OG SER A 454 -13.922 -3.598 -2.005 1.00 0.00 O ATOM 0 H SER A 454 -13.987 -3.735 0.583 1.00 0.00 H new ATOM 0 HA SER A 454 -12.748 -5.791 -0.918 1.00 0.00 H new ATOM 0 HB2 SER A 454 -12.341 -2.760 -0.982 1.00 0.00 H new ATOM 0 HB3 SER A 454 -11.895 -3.872 -2.262 1.00 0.00 H new ATOM 0 HG SER A 454 -13.949 -2.862 -2.652 1.00 0.00 H new ATOM 1158 N ALA A 455 -10.752 -4.070 1.093 1.00 0.00 N ATOM 1159 CA ALA A 455 -9.470 -4.096 1.795 1.00 0.00 C ATOM 1160 C ALA A 455 -9.272 -5.399 2.593 1.00 0.00 C ATOM 1161 O ALA A 455 -8.238 -6.052 2.463 1.00 0.00 O ATOM 1162 CB ALA A 455 -9.404 -2.844 2.679 1.00 0.00 C ATOM 0 H ALA A 455 -11.377 -3.334 1.421 1.00 0.00 H new ATOM 0 HA ALA A 455 -8.648 -4.082 1.079 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -8.458 -2.830 3.220 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -9.479 -1.954 2.055 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -10.229 -2.858 3.391 1.00 0.00 H new ATOM 1168 N GLN A 456 -10.276 -5.828 3.363 1.00 0.00 N ATOM 1169 CA GLN A 456 -10.258 -7.099 4.097 1.00 0.00 C ATOM 1170 C GLN A 456 -10.100 -8.316 3.173 1.00 0.00 C ATOM 1171 O GLN A 456 -9.302 -9.211 3.457 1.00 0.00 O ATOM 1172 CB GLN A 456 -11.555 -7.221 4.916 1.00 0.00 C ATOM 1173 CG GLN A 456 -11.533 -6.406 6.224 1.00 0.00 C ATOM 1174 CD GLN A 456 -10.556 -6.924 7.288 1.00 0.00 C ATOM 1175 OE1 GLN A 456 -9.905 -7.953 7.154 1.00 0.00 O ATOM 1176 NE2 GLN A 456 -10.410 -6.224 8.394 1.00 0.00 N ATOM 0 H GLN A 456 -11.136 -5.296 3.497 1.00 0.00 H new ATOM 0 HA GLN A 456 -9.389 -7.093 4.755 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -12.394 -6.890 4.305 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -11.728 -8.271 5.154 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -11.277 -5.373 5.988 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -12.538 -6.397 6.647 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.942 -5.364 8.527 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.765 -6.542 9.117 1.00 0.00 H new ATOM 1185 N ALA A 457 -10.825 -8.351 2.053 1.00 0.00 N ATOM 1186 CA ALA A 457 -10.688 -9.390 1.027 1.00 0.00 C ATOM 1187 C ALA A 457 -9.281 -9.419 0.402 1.00 0.00 C ATOM 1188 O ALA A 457 -8.752 -10.498 0.126 1.00 0.00 O ATOM 1189 CB ALA A 457 -11.771 -9.174 -0.038 1.00 0.00 C ATOM 0 H ALA A 457 -11.532 -7.651 1.829 1.00 0.00 H new ATOM 0 HA ALA A 457 -10.822 -10.364 1.497 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -11.682 -9.940 -0.808 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -12.755 -9.239 0.426 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -11.647 -8.190 -0.489 1.00 0.00 H new ATOM 1195 N ALA A 458 -8.641 -8.258 0.237 1.00 0.00 N ATOM 1196 CA ALA A 458 -7.280 -8.156 -0.278 1.00 0.00 C ATOM 1197 C ALA A 458 -6.224 -8.614 0.740 1.00 0.00 C ATOM 1198 O ALA A 458 -5.282 -9.296 0.347 1.00 0.00 O ATOM 1199 CB ALA A 458 -7.045 -6.721 -0.742 1.00 0.00 C ATOM 0 H ALA A 458 -9.061 -7.356 0.461 1.00 0.00 H new ATOM 0 HA ALA A 458 -7.171 -8.836 -1.123 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -6.031 -6.626 -1.131 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -7.759 -6.471 -1.526 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -7.176 -6.040 0.099 1.00 0.00 H new ATOM 1205 N ILE A 459 -6.395 -8.352 2.046 1.00 0.00 N ATOM 1206 CA ILE A 459 -5.524 -8.912 3.104 1.00 0.00 C ATOM 1207 C ILE A 459 -5.565 -10.441 3.050 1.00 0.00 C ATOM 1208 O ILE A 459 -4.522 -11.094 3.028 1.00 0.00 O ATOM 1209 CB ILE A 459 -5.935 -8.397 4.510 1.00 0.00 C ATOM 1210 CG1 ILE A 459 -5.709 -6.875 4.614 1.00 0.00 C ATOM 1211 CG2 ILE A 459 -5.146 -9.125 5.620 1.00 0.00 C ATOM 1212 CD1 ILE A 459 -6.295 -6.240 5.883 1.00 0.00 C ATOM 0 H ILE A 459 -7.137 -7.749 2.402 1.00 0.00 H new ATOM 0 HA ILE A 459 -4.503 -8.576 2.923 1.00 0.00 H new ATOM 0 HB ILE A 459 -6.995 -8.608 4.647 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -4.638 -6.674 4.581 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.150 -6.392 3.742 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -5.454 -8.745 6.594 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -5.348 -10.195 5.568 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -4.079 -8.950 5.483 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.094 -5.169 5.880 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.372 -6.407 5.909 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -5.836 -6.693 6.762 1.00 0.00 H new ATOM 1224 N GLN A 460 -6.773 -10.997 2.972 1.00 0.00 N ATOM 1225 CA GLN A 460 -7.021 -12.437 2.916 1.00 0.00 C ATOM 1226 C GLN A 460 -6.500 -13.095 1.624 1.00 0.00 C ATOM 1227 O GLN A 460 -6.264 -14.304 1.609 1.00 0.00 O ATOM 1228 CB GLN A 460 -8.533 -12.657 3.077 1.00 0.00 C ATOM 1229 CG GLN A 460 -8.994 -12.435 4.527 1.00 0.00 C ATOM 1230 CD GLN A 460 -10.518 -12.420 4.635 1.00 0.00 C ATOM 1231 OE1 GLN A 460 -11.165 -13.411 4.958 1.00 0.00 O ATOM 1232 NE2 GLN A 460 -11.147 -11.297 4.359 1.00 0.00 N ATOM 0 H GLN A 460 -7.629 -10.444 2.945 1.00 0.00 H new ATOM 0 HA GLN A 460 -6.468 -12.918 3.723 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.071 -11.977 2.417 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -8.787 -13.670 2.766 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.591 -13.224 5.163 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -8.593 -11.491 4.897 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.617 -10.468 4.090 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.165 -11.256 4.415 1.00 0.00 H new ATOM 1241 N SER A 461 -6.279 -12.327 0.554 1.00 0.00 N ATOM 1242 CA SER A 461 -5.776 -12.822 -0.731 1.00 0.00 C ATOM 1243 C SER A 461 -4.269 -12.587 -0.956 1.00 0.00 C ATOM 1244 O SER A 461 -3.645 -13.348 -1.701 1.00 0.00 O ATOM 1245 CB SER A 461 -6.563 -12.145 -1.858 1.00 0.00 C ATOM 1246 OG SER A 461 -7.953 -12.436 -1.788 1.00 0.00 O ATOM 0 H SER A 461 -6.448 -11.321 0.557 1.00 0.00 H new ATOM 0 HA SER A 461 -5.916 -13.903 -0.725 1.00 0.00 H new ATOM 0 HB2 SER A 461 -6.416 -11.066 -1.805 1.00 0.00 H new ATOM 0 HB3 SER A 461 -6.172 -12.474 -2.821 1.00 0.00 H new ATOM 0 HG SER A 461 -8.379 -11.843 -1.135 1.00 0.00 H new ATOM 1252 N MET A 462 -3.673 -11.568 -0.317 1.00 0.00 N ATOM 1253 CA MET A 462 -2.307 -11.094 -0.605 1.00 0.00 C ATOM 1254 C MET A 462 -1.317 -11.226 0.556 1.00 0.00 C ATOM 1255 O MET A 462 -0.111 -11.241 0.307 1.00 0.00 O ATOM 1256 CB MET A 462 -2.347 -9.633 -1.084 1.00 0.00 C ATOM 1257 CG MET A 462 -3.113 -9.462 -2.402 1.00 0.00 C ATOM 1258 SD MET A 462 -2.485 -10.422 -3.810 1.00 0.00 S ATOM 1259 CE MET A 462 -0.822 -9.723 -3.915 1.00 0.00 C ATOM 0 H MET A 462 -4.132 -11.041 0.426 1.00 0.00 H new ATOM 0 HA MET A 462 -1.934 -11.755 -1.387 1.00 0.00 H new ATOM 0 HB2 MET A 462 -2.812 -9.016 -0.316 1.00 0.00 H new ATOM 0 HB3 MET A 462 -1.328 -9.269 -1.211 1.00 0.00 H new ATOM 0 HG2 MET A 462 -4.154 -9.737 -2.234 1.00 0.00 H new ATOM 0 HG3 MET A 462 -3.102 -8.406 -2.672 1.00 0.00 H new ATOM 0 HE1 MET A 462 -0.403 -9.928 -4.900 1.00 0.00 H new ATOM 0 HE2 MET A 462 -0.870 -8.645 -3.758 1.00 0.00 H new ATOM 0 HE3 MET A 462 -0.189 -10.174 -3.151 1.00 0.00 H new ATOM 1269 N ASN A 463 -1.773 -11.370 1.804 1.00 0.00 N ATOM 1270 CA ASN A 463 -0.872 -11.661 2.920 1.00 0.00 C ATOM 1271 C ASN A 463 -0.328 -13.099 2.790 1.00 0.00 C ATOM 1272 O ASN A 463 -1.077 -14.071 2.927 1.00 0.00 O ATOM 1273 CB ASN A 463 -1.589 -11.414 4.257 1.00 0.00 C ATOM 1274 CG ASN A 463 -0.605 -11.419 5.420 1.00 0.00 C ATOM 1275 OD1 ASN A 463 0.333 -10.630 5.453 1.00 0.00 O ATOM 1276 ND2 ASN A 463 -0.772 -12.299 6.389 1.00 0.00 N ATOM 0 H ASN A 463 -2.756 -11.290 2.065 1.00 0.00 H new ATOM 0 HA ASN A 463 -0.015 -10.988 2.893 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -2.110 -10.457 4.222 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -2.346 -12.183 4.414 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -0.119 -12.326 7.172 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -1.554 -12.952 6.355 1.00 0.00 H new ATOM 1283 N GLY A 464 0.967 -13.228 2.482 1.00 0.00 N ATOM 1284 CA GLY A 464 1.642 -14.491 2.152 1.00 0.00 C ATOM 1285 C GLY A 464 1.850 -14.737 0.651 1.00 0.00 C ATOM 1286 O GLY A 464 2.332 -15.813 0.298 1.00 0.00 O ATOM 0 H GLY A 464 1.598 -12.427 2.454 1.00 0.00 H new ATOM 0 HA2 GLY A 464 2.613 -14.508 2.647 1.00 0.00 H new ATOM 0 HA3 GLY A 464 1.060 -15.316 2.564 1.00 0.00 H new ATOM 1290 N PHE A 465 1.535 -13.779 -0.233 1.00 0.00 N ATOM 1291 CA PHE A 465 1.813 -13.869 -1.675 1.00 0.00 C ATOM 1292 C PHE A 465 3.327 -13.927 -1.921 1.00 0.00 C ATOM 1293 O PHE A 465 4.051 -13.048 -1.451 1.00 0.00 O ATOM 1294 CB PHE A 465 1.198 -12.645 -2.375 1.00 0.00 C ATOM 1295 CG PHE A 465 1.323 -12.617 -3.892 1.00 0.00 C ATOM 1296 CD1 PHE A 465 2.453 -12.054 -4.529 1.00 0.00 C ATOM 1297 CD2 PHE A 465 0.269 -13.124 -4.675 1.00 0.00 C ATOM 1298 CE1 PHE A 465 2.514 -12.000 -5.934 1.00 0.00 C ATOM 1299 CE2 PHE A 465 0.335 -13.069 -6.079 1.00 0.00 C ATOM 1300 CZ PHE A 465 1.457 -12.505 -6.709 1.00 0.00 C ATOM 0 H PHE A 465 1.075 -12.909 0.036 1.00 0.00 H new ATOM 0 HA PHE A 465 1.371 -14.779 -2.080 1.00 0.00 H new ATOM 0 HB2 PHE A 465 0.141 -12.595 -2.115 1.00 0.00 H new ATOM 0 HB3 PHE A 465 1.668 -11.747 -1.974 1.00 0.00 H new ATOM 0 HD1 PHE A 465 3.269 -11.666 -3.938 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -0.596 -13.558 -4.195 1.00 0.00 H new ATOM 0 HE1 PHE A 465 3.377 -11.568 -6.418 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -0.477 -13.461 -6.673 1.00 0.00 H new ATOM 0 HZ PHE A 465 1.507 -12.460 -7.787 1.00 0.00 H new ATOM 1310 N GLN A 466 3.827 -14.933 -2.646 1.00 0.00 N ATOM 1311 CA GLN A 466 5.248 -14.985 -3.002 1.00 0.00 C ATOM 1312 C GLN A 466 5.505 -14.159 -4.265 1.00 0.00 C ATOM 1313 O GLN A 466 4.862 -14.364 -5.295 1.00 0.00 O ATOM 1314 CB GLN A 466 5.740 -16.432 -3.172 1.00 0.00 C ATOM 1315 CG GLN A 466 7.283 -16.477 -3.134 1.00 0.00 C ATOM 1316 CD GLN A 466 7.857 -17.895 -3.173 1.00 0.00 C ATOM 1317 OE1 GLN A 466 7.483 -18.770 -2.400 1.00 0.00 O ATOM 1318 NE2 GLN A 466 8.805 -18.170 -4.045 1.00 0.00 N ATOM 0 H GLN A 466 3.274 -15.716 -2.995 1.00 0.00 H new ATOM 0 HA GLN A 466 5.819 -14.551 -2.181 1.00 0.00 H new ATOM 0 HB2 GLN A 466 5.331 -17.059 -2.380 1.00 0.00 H new ATOM 0 HB3 GLN A 466 5.380 -16.838 -4.117 1.00 0.00 H new ATOM 0 HG2 GLN A 466 7.675 -15.912 -3.980 1.00 0.00 H new ATOM 0 HG3 GLN A 466 7.630 -15.978 -2.229 1.00 0.00 H new ATOM 0 HE21 GLN A 466 9.125 -17.451 -4.694 1.00 0.00 H new ATOM 0 HE22 GLN A 466 9.219 -19.102 -4.072 1.00 0.00 H new ATOM 1327 N ILE A 467 6.491 -13.263 -4.199 1.00 0.00 N ATOM 1328 CA ILE A 467 6.997 -12.505 -5.344 1.00 0.00 C ATOM 1329 C ILE A 467 8.521 -12.678 -5.399 1.00 0.00 C ATOM 1330 O ILE A 467 9.238 -12.359 -4.448 1.00 0.00 O ATOM 1331 CB ILE A 467 6.465 -11.051 -5.288 1.00 0.00 C ATOM 1332 CG1 ILE A 467 6.574 -10.421 -6.689 1.00 0.00 C ATOM 1333 CG2 ILE A 467 7.121 -10.183 -4.197 1.00 0.00 C ATOM 1334 CD1 ILE A 467 5.846 -9.081 -6.838 1.00 0.00 C ATOM 0 H ILE A 467 6.971 -13.039 -3.327 1.00 0.00 H new ATOM 0 HA ILE A 467 6.627 -12.880 -6.298 1.00 0.00 H new ATOM 0 HB ILE A 467 5.417 -11.093 -4.991 1.00 0.00 H new ATOM 0 HG12 ILE A 467 7.628 -10.277 -6.928 1.00 0.00 H new ATOM 0 HG13 ILE A 467 6.174 -11.122 -7.422 1.00 0.00 H new ATOM 0 HG21 ILE A 467 6.694 -9.181 -4.224 1.00 0.00 H new ATOM 0 HG22 ILE A 467 6.939 -10.629 -3.219 1.00 0.00 H new ATOM 0 HG23 ILE A 467 8.195 -10.125 -4.375 1.00 0.00 H new ATOM 0 HD11 ILE A 467 5.974 -8.708 -7.854 1.00 0.00 H new ATOM 0 HD12 ILE A 467 4.784 -9.219 -6.633 1.00 0.00 H new ATOM 0 HD13 ILE A 467 6.261 -8.361 -6.133 1.00 0.00 H new ATOM 1346 N GLY A 468 9.017 -13.304 -6.473 1.00 0.00 N ATOM 1347 CA GLY A 468 10.409 -13.759 -6.555 1.00 0.00 C ATOM 1348 C GLY A 468 10.668 -14.851 -5.513 1.00 0.00 C ATOM 1349 O GLY A 468 10.047 -15.917 -5.554 1.00 0.00 O ATOM 0 H GLY A 468 8.466 -13.509 -7.307 1.00 0.00 H new ATOM 0 HA2 GLY A 468 10.616 -14.142 -7.554 1.00 0.00 H new ATOM 0 HA3 GLY A 468 11.084 -12.920 -6.389 1.00 0.00 H new ATOM 1353 N MET A 469 11.566 -14.568 -4.565 1.00 0.00 N ATOM 1354 CA MET A 469 11.970 -15.471 -3.471 1.00 0.00 C ATOM 1355 C MET A 469 11.496 -14.999 -2.080 1.00 0.00 C ATOM 1356 O MET A 469 11.956 -15.523 -1.063 1.00 0.00 O ATOM 1357 CB MET A 469 13.499 -15.671 -3.517 1.00 0.00 C ATOM 1358 CG MET A 469 13.989 -16.291 -4.836 1.00 0.00 C ATOM 1359 SD MET A 469 13.343 -17.949 -5.187 1.00 0.00 S ATOM 1360 CE MET A 469 14.153 -18.231 -6.781 1.00 0.00 C ATOM 0 H MET A 469 12.052 -13.672 -4.533 1.00 0.00 H new ATOM 0 HA MET A 469 11.472 -16.428 -3.628 1.00 0.00 H new ATOM 0 HB2 MET A 469 13.989 -14.709 -3.371 1.00 0.00 H new ATOM 0 HB3 MET A 469 13.800 -16.311 -2.688 1.00 0.00 H new ATOM 0 HG2 MET A 469 13.713 -15.628 -5.656 1.00 0.00 H new ATOM 0 HG3 MET A 469 15.078 -16.338 -4.816 1.00 0.00 H new ATOM 0 HE1 MET A 469 13.874 -19.213 -7.162 1.00 0.00 H new ATOM 0 HE2 MET A 469 13.839 -17.464 -7.489 1.00 0.00 H new ATOM 0 HE3 MET A 469 15.234 -18.185 -6.653 1.00 0.00 H new ATOM 1370 N LYS A 470 10.583 -14.020 -2.011 1.00 0.00 N ATOM 1371 CA LYS A 470 10.103 -13.402 -0.759 1.00 0.00 C ATOM 1372 C LYS A 470 8.568 -13.292 -0.671 1.00 0.00 C ATOM 1373 O LYS A 470 7.869 -13.279 -1.686 1.00 0.00 O ATOM 1374 CB LYS A 470 10.833 -12.068 -0.520 1.00 0.00 C ATOM 1375 CG LYS A 470 10.711 -11.039 -1.654 1.00 0.00 C ATOM 1376 CD LYS A 470 11.455 -9.769 -1.233 1.00 0.00 C ATOM 1377 CE LYS A 470 11.497 -8.743 -2.372 1.00 0.00 C ATOM 1378 NZ LYS A 470 12.180 -7.492 -1.953 1.00 0.00 N ATOM 0 H LYS A 470 10.145 -13.624 -2.842 1.00 0.00 H new ATOM 0 HA LYS A 470 10.357 -14.073 0.062 1.00 0.00 H new ATOM 0 HB2 LYS A 470 10.447 -11.621 0.396 1.00 0.00 H new ATOM 0 HB3 LYS A 470 11.890 -12.276 -0.353 1.00 0.00 H new ATOM 0 HG2 LYS A 470 11.133 -11.438 -2.576 1.00 0.00 H new ATOM 0 HG3 LYS A 470 9.663 -10.816 -1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 470 10.966 -9.330 -0.363 1.00 0.00 H new ATOM 0 HD3 LYS A 470 12.471 -10.023 -0.932 1.00 0.00 H new ATOM 0 HE2 LYS A 470 12.015 -9.172 -3.230 1.00 0.00 H new ATOM 0 HE3 LYS A 470 10.481 -8.514 -2.694 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 11.474 -6.741 -1.813 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 12.692 -7.657 -1.063 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 12.853 -7.200 -2.690 1.00 0.00 H new ATOM 1392 N ARG A 471 8.039 -13.256 0.559 1.00 0.00 N ATOM 1393 CA ARG A 471 6.603 -13.314 0.880 1.00 0.00 C ATOM 1394 C ARG A 471 6.092 -11.937 1.323 1.00 0.00 C ATOM 1395 O ARG A 471 6.650 -11.339 2.244 1.00 0.00 O ATOM 1396 CB ARG A 471 6.373 -14.357 1.993 1.00 0.00 C ATOM 1397 CG ARG A 471 6.600 -15.810 1.534 1.00 0.00 C ATOM 1398 CD ARG A 471 5.390 -16.372 0.780 1.00 0.00 C ATOM 1399 NE ARG A 471 5.685 -17.688 0.188 1.00 0.00 N ATOM 1400 CZ ARG A 471 4.800 -18.602 -0.194 1.00 0.00 C ATOM 1401 NH1 ARG A 471 3.503 -18.442 -0.036 1.00 0.00 N ATOM 1402 NH2 ARG A 471 5.225 -19.697 -0.782 1.00 0.00 N ATOM 0 H ARG A 471 8.622 -13.183 1.393 1.00 0.00 H new ATOM 0 HA ARG A 471 6.048 -13.607 -0.011 1.00 0.00 H new ATOM 0 HB2 ARG A 471 7.041 -14.140 2.826 1.00 0.00 H new ATOM 0 HB3 ARG A 471 5.354 -14.258 2.367 1.00 0.00 H new ATOM 0 HG2 ARG A 471 7.479 -15.854 0.891 1.00 0.00 H new ATOM 0 HG3 ARG A 471 6.808 -16.436 2.402 1.00 0.00 H new ATOM 0 HD2 ARG A 471 4.544 -16.460 1.462 1.00 0.00 H new ATOM 0 HD3 ARG A 471 5.095 -15.677 -0.006 1.00 0.00 H new ATOM 0 HE ARG A 471 6.669 -17.921 0.058 1.00 0.00 H new ATOM 0 HH11 ARG A 471 3.143 -17.590 0.394 1.00 0.00 H new ATOM 0 HH12 ARG A 471 2.858 -19.170 -0.344 1.00 0.00 H new ATOM 0 HH21 ARG A 471 6.223 -19.837 -0.940 1.00 0.00 H new ATOM 0 HH22 ARG A 471 4.557 -20.408 -1.081 1.00 0.00 H new ATOM 1416 N LEU A 472 5.033 -11.438 0.680 1.00 0.00 N ATOM 1417 CA LEU A 472 4.413 -10.147 0.989 1.00 0.00 C ATOM 1418 C LEU A 472 3.653 -10.192 2.316 1.00 0.00 C ATOM 1419 O LEU A 472 2.815 -11.064 2.544 1.00 0.00 O ATOM 1420 CB LEU A 472 3.477 -9.702 -0.152 1.00 0.00 C ATOM 1421 CG LEU A 472 4.165 -9.419 -1.501 1.00 0.00 C ATOM 1422 CD1 LEU A 472 3.125 -8.903 -2.506 1.00 0.00 C ATOM 1423 CD2 LEU A 472 5.293 -8.386 -1.366 1.00 0.00 C ATOM 0 H LEU A 472 4.573 -11.931 -0.086 1.00 0.00 H new ATOM 0 HA LEU A 472 5.214 -9.415 1.088 1.00 0.00 H new ATOM 0 HB2 LEU A 472 2.724 -10.475 -0.303 1.00 0.00 H new ATOM 0 HB3 LEU A 472 2.950 -8.801 0.164 1.00 0.00 H new ATOM 0 HG LEU A 472 4.605 -10.353 -1.851 1.00 0.00 H new ATOM 0 HD11 LEU A 472 3.610 -8.702 -3.461 1.00 0.00 H new ATOM 0 HD12 LEU A 472 2.348 -9.655 -2.645 1.00 0.00 H new ATOM 0 HD13 LEU A 472 2.677 -7.985 -2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 472 5.750 -8.217 -2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 472 4.884 -7.448 -0.989 1.00 0.00 H new ATOM 0 HD23 LEU A 472 6.046 -8.758 -0.672 1.00 0.00 H new ATOM 1435 N LYS A 473 3.920 -9.209 3.169 1.00 0.00 N ATOM 1436 CA LYS A 473 3.164 -8.926 4.388 1.00 0.00 C ATOM 1437 C LYS A 473 2.115 -7.845 4.069 1.00 0.00 C ATOM 1438 O LYS A 473 2.458 -6.824 3.473 1.00 0.00 O ATOM 1439 CB LYS A 473 4.182 -8.501 5.462 1.00 0.00 C ATOM 1440 CG LYS A 473 3.544 -7.986 6.763 1.00 0.00 C ATOM 1441 CD LYS A 473 4.600 -7.558 7.793 1.00 0.00 C ATOM 1442 CE LYS A 473 5.353 -8.760 8.385 1.00 0.00 C ATOM 1443 NZ LYS A 473 6.391 -8.328 9.356 1.00 0.00 N ATOM 0 H LYS A 473 4.696 -8.563 3.027 1.00 0.00 H new ATOM 0 HA LYS A 473 2.617 -9.790 4.766 1.00 0.00 H new ATOM 0 HB2 LYS A 473 4.823 -9.351 5.696 1.00 0.00 H new ATOM 0 HB3 LYS A 473 4.823 -7.721 5.051 1.00 0.00 H new ATOM 0 HG2 LYS A 473 2.894 -7.140 6.538 1.00 0.00 H new ATOM 0 HG3 LYS A 473 2.915 -8.766 7.192 1.00 0.00 H new ATOM 0 HD2 LYS A 473 5.313 -6.882 7.321 1.00 0.00 H new ATOM 0 HD3 LYS A 473 4.117 -7.002 8.597 1.00 0.00 H new ATOM 0 HE2 LYS A 473 4.646 -9.426 8.879 1.00 0.00 H new ATOM 0 HE3 LYS A 473 5.820 -9.330 7.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 6.880 -9.163 9.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 7.079 -7.712 8.878 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 5.942 -7.805 10.135 1.00 0.00 H new ATOM 1457 N VAL A 474 0.849 -8.055 4.437 1.00 0.00 N ATOM 1458 CA VAL A 474 -0.269 -7.140 4.123 1.00 0.00 C ATOM 1459 C VAL A 474 -1.226 -7.050 5.311 1.00 0.00 C ATOM 1460 O VAL A 474 -1.569 -8.066 5.914 1.00 0.00 O ATOM 1461 CB VAL A 474 -1.040 -7.540 2.839 1.00 0.00 C ATOM 1462 CG1 VAL A 474 -2.020 -6.422 2.433 1.00 0.00 C ATOM 1463 CG2 VAL A 474 -0.114 -7.821 1.644 1.00 0.00 C ATOM 0 H VAL A 474 0.560 -8.875 4.970 1.00 0.00 H new ATOM 0 HA VAL A 474 0.170 -6.161 3.930 1.00 0.00 H new ATOM 0 HB VAL A 474 -1.572 -8.459 3.083 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -2.554 -6.717 1.530 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -2.734 -6.254 3.239 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -1.465 -5.503 2.243 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -0.713 -8.096 0.776 1.00 0.00 H new ATOM 0 HG22 VAL A 474 0.467 -6.927 1.416 1.00 0.00 H new ATOM 0 HG23 VAL A 474 0.562 -8.639 1.892 1.00 0.00 H new ATOM 1473 N GLN A 475 -1.643 -5.828 5.648 1.00 0.00 N ATOM 1474 CA GLN A 475 -2.455 -5.504 6.826 1.00 0.00 C ATOM 1475 C GLN A 475 -3.118 -4.125 6.667 1.00 0.00 C ATOM 1476 O GLN A 475 -2.785 -3.372 5.750 1.00 0.00 O ATOM 1477 CB GLN A 475 -1.584 -5.579 8.101 1.00 0.00 C ATOM 1478 CG GLN A 475 -0.383 -4.615 8.081 1.00 0.00 C ATOM 1479 CD GLN A 475 0.487 -4.724 9.336 1.00 0.00 C ATOM 1480 OE1 GLN A 475 0.046 -4.525 10.461 1.00 0.00 O ATOM 1481 NE2 GLN A 475 1.760 -5.038 9.201 1.00 0.00 N ATOM 0 H GLN A 475 -1.417 -5.006 5.088 1.00 0.00 H new ATOM 0 HA GLN A 475 -3.256 -6.237 6.921 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -2.204 -5.356 8.969 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -1.219 -6.599 8.223 1.00 0.00 H new ATOM 0 HG2 GLN A 475 0.228 -4.821 7.202 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -0.746 -3.592 7.984 1.00 0.00 H new ATOM 0 HE21 GLN A 475 2.148 -5.208 8.273 1.00 0.00 H new ATOM 0 HE22 GLN A 475 2.357 -5.111 10.025 1.00 0.00 H new ATOM 1490 N LEU A 476 -4.036 -3.775 7.576 1.00 0.00 N ATOM 1491 CA LEU A 476 -4.614 -2.429 7.657 1.00 0.00 C ATOM 1492 C LEU A 476 -3.526 -1.388 7.975 1.00 0.00 C ATOM 1493 O LEU A 476 -2.617 -1.632 8.775 1.00 0.00 O ATOM 1494 CB LEU A 476 -5.735 -2.395 8.715 1.00 0.00 C ATOM 1495 CG LEU A 476 -6.962 -3.288 8.424 1.00 0.00 C ATOM 1496 CD1 LEU A 476 -7.929 -3.221 9.614 1.00 0.00 C ATOM 1497 CD2 LEU A 476 -7.705 -2.864 7.148 1.00 0.00 C ATOM 0 H LEU A 476 -4.400 -4.420 8.278 1.00 0.00 H new ATOM 0 HA LEU A 476 -5.046 -2.176 6.689 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -5.312 -2.693 9.675 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -6.076 -1.365 8.823 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.600 -4.305 8.273 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -8.797 -3.850 9.414 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -7.425 -3.575 10.513 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -8.254 -2.191 9.762 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -8.559 -3.523 6.988 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -8.054 -1.837 7.255 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -7.030 -2.931 6.295 1.00 0.00 H new ATOM 1509 N LYS A 477 -3.612 -0.216 7.345 1.00 0.00 N ATOM 1510 CA LYS A 477 -2.610 0.849 7.474 1.00 0.00 C ATOM 1511 C LYS A 477 -2.553 1.451 8.897 1.00 0.00 C ATOM 1512 O LYS A 477 -3.582 1.609 9.562 1.00 0.00 O ATOM 1513 CB LYS A 477 -2.894 1.930 6.413 1.00 0.00 C ATOM 1514 CG LYS A 477 -1.619 2.698 6.033 1.00 0.00 C ATOM 1515 CD LYS A 477 -1.917 3.962 5.219 1.00 0.00 C ATOM 1516 CE LYS A 477 -2.435 5.127 6.078 1.00 0.00 C ATOM 1517 NZ LYS A 477 -1.336 5.821 6.795 1.00 0.00 N ATOM 0 H LYS A 477 -4.385 0.025 6.725 1.00 0.00 H new ATOM 0 HA LYS A 477 -1.625 0.415 7.303 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -3.318 1.465 5.523 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -3.640 2.628 6.794 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -1.080 2.972 6.940 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -0.963 2.045 5.457 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -1.010 4.276 4.702 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -2.656 3.727 4.453 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -2.960 5.840 5.443 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -3.159 4.751 6.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -1.729 6.599 7.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -0.850 5.147 7.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.658 6.203 6.105 1.00 0.00 H new