USER MOD reduce.3.24.130724 H: found=0, std=0, add=627, rem=0, adj=14 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 443 CYS SG : rot -78:sc= 0.182 USER MOD Set 1.2: A 470 LYS NZ :NH3+ -142:sc= 0.489 (180deg=0.044) USER MOD Set 2.1: A 429 SER OG : rot -117:sc= 0.452 USER MOD Set 2.2: A 448 SER OG : rot 135:sc= 0.173 USER MOD Set 3.1: A 415 GLN : amide:sc= 1.02 K(o=1.9,f=0.3) USER MOD Set 3.2: A 419 GLN : amide:sc= 0.879 K(o=1.9,f=0.3) USER MOD Single : A 393 SER OG : rot 180:sc= 0 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 402 ASN : amide:sc= 0.618 K(o=0.62,f=-0.88) 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 410 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 420 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 422 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 426 ASN : amide:sc= 0.875 K(o=0.88,f=-0.37) USER MOD Single : A 431 LYS NZ :NH3+ 168:sc= 1.15 (180deg=0.956) USER MOD Single : A 441 SER OG : rot -136:sc= 0.302 USER MOD Single : A 442 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 449 TYR OH : rot 17:sc= 0.484 USER MOD Single : A 451 ASN : amide:sc= 0.543 K(o=0.54,f=-0.036) USER MOD Single : A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 456 GLN : amide:sc= -0.0614 X(o=-0.061,f=-0.37) USER MOD Single : A 460 GLN : amide:sc=-0.00813 X(o=-0.0081,f=-0.1) USER MOD Single : A 461 SER OG : rot 84:sc= 0.813 USER MOD Single : A 462 MET CE :methyl -170:sc= -0.265 (180deg=-0.701) USER MOD Single : A 463 ASN : amide:sc= 0.828 K(o=0.83,f=-5.9!) USER MOD Single : A 466 GLN : amide:sc= 0.894 K(o=0.89,f=-6.8!) USER MOD Single : A 469 MET CE :methyl 177:sc= 0 (180deg=-0.0176) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0.842 K(o=0.84,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 143:sc= 0.659 (180deg=0.0576) USER MOD ----------------------------------------------------------------- ATOM 172 N ALA A 390 -5.150 6.871 -9.937 1.00 0.00 N ATOM 173 CA ALA A 390 -4.933 5.980 -8.783 1.00 0.00 C ATOM 174 C ALA A 390 -3.446 5.750 -8.426 1.00 0.00 C ATOM 175 O ALA A 390 -3.093 5.787 -7.249 1.00 0.00 O ATOM 176 CB ALA A 390 -5.722 4.671 -8.970 1.00 0.00 C ATOM 0 HA ALA A 390 -5.326 6.494 -7.906 1.00 0.00 H new ATOM 0 HB1 ALA A 390 -5.555 4.020 -8.112 1.00 0.00 H new ATOM 0 HB2 ALA A 390 -6.785 4.896 -9.053 1.00 0.00 H new ATOM 0 HB3 ALA A 390 -5.385 4.170 -9.877 1.00 0.00 H new ATOM 182 N ALA A 391 -2.577 5.580 -9.423 1.00 0.00 N ATOM 183 CA ALA A 391 -1.117 5.559 -9.306 1.00 0.00 C ATOM 184 C ALA A 391 -0.536 6.977 -9.397 1.00 0.00 C ATOM 185 O ALA A 391 -1.047 7.830 -10.130 1.00 0.00 O ATOM 186 CB ALA A 391 -0.567 4.627 -10.392 1.00 0.00 C ATOM 0 H ALA A 391 -2.888 5.446 -10.385 1.00 0.00 H new ATOM 0 HA ALA A 391 -0.818 5.179 -8.329 1.00 0.00 H new ATOM 0 HB1 ALA A 391 0.521 4.594 -10.326 1.00 0.00 H new ATOM 0 HB2 ALA A 391 -0.970 3.624 -10.249 1.00 0.00 H new ATOM 0 HB3 ALA A 391 -0.860 4.999 -11.374 1.00 0.00 H new ATOM 192 N GLY A 392 0.514 7.231 -8.609 1.00 0.00 N ATOM 193 CA GLY A 392 1.065 8.576 -8.401 1.00 0.00 C ATOM 194 C GLY A 392 0.213 9.408 -7.436 1.00 0.00 C ATOM 195 O GLY A 392 0.248 10.636 -7.490 1.00 0.00 O ATOM 0 H GLY A 392 1.010 6.504 -8.093 1.00 0.00 H new ATOM 0 HA2 GLY A 392 2.079 8.495 -8.010 1.00 0.00 H new ATOM 0 HA3 GLY A 392 1.133 9.091 -9.359 1.00 0.00 H new ATOM 199 N SER A 393 -0.566 8.753 -6.571 1.00 0.00 N ATOM 200 CA SER A 393 -1.510 9.381 -5.641 1.00 0.00 C ATOM 201 C SER A 393 -1.407 8.783 -4.228 1.00 0.00 C ATOM 202 O SER A 393 -0.966 7.647 -4.029 1.00 0.00 O ATOM 203 CB SER A 393 -2.938 9.263 -6.190 1.00 0.00 C ATOM 204 OG SER A 393 -3.858 9.969 -5.368 1.00 0.00 O ATOM 0 H SER A 393 -0.557 7.736 -6.496 1.00 0.00 H new ATOM 0 HA SER A 393 -1.250 10.436 -5.555 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.975 9.657 -7.206 1.00 0.00 H new ATOM 0 HB3 SER A 393 -3.225 8.213 -6.245 1.00 0.00 H new ATOM 0 HG SER A 393 -4.761 9.881 -5.738 1.00 0.00 H new ATOM 210 N GLN A 394 -1.817 9.571 -3.233 1.00 0.00 N ATOM 211 CA GLN A 394 -1.657 9.279 -1.808 1.00 0.00 C ATOM 212 C GLN A 394 -2.943 9.532 -1.005 1.00 0.00 C ATOM 213 O GLN A 394 -2.894 9.735 0.209 1.00 0.00 O ATOM 214 CB GLN A 394 -0.437 10.034 -1.260 1.00 0.00 C ATOM 215 CG GLN A 394 -0.551 11.568 -1.346 1.00 0.00 C ATOM 216 CD GLN A 394 0.535 12.234 -0.502 1.00 0.00 C ATOM 217 OE1 GLN A 394 1.595 12.617 -0.983 1.00 0.00 O ATOM 218 NE2 GLN A 394 0.311 12.374 0.789 1.00 0.00 N ATOM 0 H GLN A 394 -2.286 10.461 -3.403 1.00 0.00 H new ATOM 0 HA GLN A 394 -1.468 8.212 -1.690 1.00 0.00 H new ATOM 0 HB2 GLN A 394 -0.286 9.750 -0.218 1.00 0.00 H new ATOM 0 HB3 GLN A 394 0.449 9.716 -1.809 1.00 0.00 H new ATOM 0 HG2 GLN A 394 -0.460 11.888 -2.384 1.00 0.00 H new ATOM 0 HG3 GLN A 394 -1.535 11.885 -1.000 1.00 0.00 H new ATOM 0 HE21 GLN A 394 -0.571 12.056 1.191 1.00 0.00 H new ATOM 0 HE22 GLN A 394 1.019 12.801 1.386 1.00 0.00 H new ATOM 227 N LYS A 395 -4.104 9.548 -1.673 1.00 0.00 N ATOM 228 CA LYS A 395 -5.410 9.731 -1.035 1.00 0.00 C ATOM 229 C LYS A 395 -5.737 8.548 -0.103 1.00 0.00 C ATOM 230 O LYS A 395 -6.181 7.488 -0.553 1.00 0.00 O ATOM 231 CB LYS A 395 -6.460 9.958 -2.140 1.00 0.00 C ATOM 232 CG LYS A 395 -7.861 10.248 -1.578 1.00 0.00 C ATOM 233 CD LYS A 395 -8.843 10.581 -2.712 1.00 0.00 C ATOM 234 CE LYS A 395 -10.289 10.738 -2.217 1.00 0.00 C ATOM 235 NZ LYS A 395 -10.480 11.952 -1.377 1.00 0.00 N ATOM 0 H LYS A 395 -4.161 9.433 -2.685 1.00 0.00 H new ATOM 0 HA LYS A 395 -5.408 10.609 -0.389 1.00 0.00 H new ATOM 0 HB2 LYS A 395 -6.146 10.791 -2.768 1.00 0.00 H new ATOM 0 HB3 LYS A 395 -6.505 9.076 -2.779 1.00 0.00 H new ATOM 0 HG2 LYS A 395 -8.221 9.383 -1.021 1.00 0.00 H new ATOM 0 HG3 LYS A 395 -7.812 11.081 -0.877 1.00 0.00 H new ATOM 0 HD2 LYS A 395 -8.528 11.503 -3.200 1.00 0.00 H new ATOM 0 HD3 LYS A 395 -8.804 9.793 -3.464 1.00 0.00 H new ATOM 0 HE2 LYS A 395 -10.959 10.786 -3.075 1.00 0.00 H new ATOM 0 HE3 LYS A 395 -10.570 9.856 -1.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 -11.472 12.009 -1.070 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 -9.862 11.897 -0.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 -10.240 12.799 -1.931 1.00 0.00 H new ATOM 249 N GLU A 396 -5.493 8.725 1.195 1.00 0.00 N ATOM 250 CA GLU A 396 -5.636 7.685 2.216 1.00 0.00 C ATOM 251 C GLU A 396 -7.109 7.257 2.354 1.00 0.00 C ATOM 252 O GLU A 396 -7.997 8.103 2.506 1.00 0.00 O ATOM 253 CB GLU A 396 -5.080 8.173 3.568 1.00 0.00 C ATOM 254 CG GLU A 396 -3.648 8.736 3.502 1.00 0.00 C ATOM 255 CD GLU A 396 -3.119 9.074 4.909 1.00 0.00 C ATOM 256 OE1 GLU A 396 -2.862 8.152 5.720 1.00 0.00 O ATOM 257 OE2 GLU A 396 -2.973 10.282 5.219 1.00 0.00 O ATOM 0 H GLU A 396 -5.182 9.618 1.577 1.00 0.00 H new ATOM 0 HA GLU A 396 -5.058 6.816 1.903 1.00 0.00 H new ATOM 0 HB2 GLU A 396 -5.742 8.944 3.962 1.00 0.00 H new ATOM 0 HB3 GLU A 396 -5.099 7.344 4.275 1.00 0.00 H new ATOM 0 HG2 GLU A 396 -2.989 8.008 3.028 1.00 0.00 H new ATOM 0 HG3 GLU A 396 -3.634 9.631 2.880 1.00 0.00 H new ATOM 264 N GLY A 397 -7.375 5.946 2.289 1.00 0.00 N ATOM 265 CA GLY A 397 -8.732 5.385 2.358 1.00 0.00 C ATOM 266 C GLY A 397 -9.385 5.541 3.745 1.00 0.00 C ATOM 267 O GLY A 397 -8.669 5.757 4.731 1.00 0.00 O ATOM 0 H GLY A 397 -6.648 5.238 2.186 1.00 0.00 H new ATOM 0 HA2 GLY A 397 -9.358 5.874 1.612 1.00 0.00 H new ATOM 0 HA3 GLY A 397 -8.694 4.327 2.099 1.00 0.00 H new ATOM 271 N PRO A 398 -10.725 5.413 3.844 1.00 0.00 N ATOM 272 CA PRO A 398 -11.469 5.546 5.099 1.00 0.00 C ATOM 273 C PRO A 398 -11.165 4.399 6.078 1.00 0.00 C ATOM 274 O PRO A 398 -10.413 3.476 5.765 1.00 0.00 O ATOM 275 CB PRO A 398 -12.947 5.609 4.683 1.00 0.00 C ATOM 276 CG PRO A 398 -12.992 4.795 3.392 1.00 0.00 C ATOM 277 CD PRO A 398 -11.640 5.106 2.749 1.00 0.00 C ATOM 0 HA PRO A 398 -11.181 6.441 5.651 1.00 0.00 H new ATOM 0 HB2 PRO A 398 -13.597 5.184 5.448 1.00 0.00 H new ATOM 0 HB3 PRO A 398 -13.274 6.636 4.521 1.00 0.00 H new ATOM 0 HG2 PRO A 398 -13.111 3.730 3.589 1.00 0.00 H new ATOM 0 HG3 PRO A 398 -13.823 5.095 2.753 1.00 0.00 H new ATOM 0 HD2 PRO A 398 -11.281 4.256 2.169 1.00 0.00 H new ATOM 0 HD3 PRO A 398 -11.721 5.949 2.062 1.00 0.00 H new ATOM 285 N GLU A 399 -11.745 4.467 7.283 1.00 0.00 N ATOM 286 CA GLU A 399 -11.514 3.507 8.371 1.00 0.00 C ATOM 287 C GLU A 399 -11.786 2.055 7.929 1.00 0.00 C ATOM 288 O GLU A 399 -12.887 1.713 7.487 1.00 0.00 O ATOM 289 CB GLU A 399 -12.374 3.900 9.585 1.00 0.00 C ATOM 290 CG GLU A 399 -12.062 3.054 10.827 1.00 0.00 C ATOM 291 CD GLU A 399 -12.881 3.531 12.036 1.00 0.00 C ATOM 292 OE1 GLU A 399 -14.012 3.031 12.243 1.00 0.00 O ATOM 293 OE2 GLU A 399 -12.398 4.406 12.794 1.00 0.00 O ATOM 0 H GLU A 399 -12.402 5.206 7.534 1.00 0.00 H new ATOM 0 HA GLU A 399 -10.462 3.546 8.652 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -12.210 4.953 9.816 1.00 0.00 H new ATOM 0 HB3 GLU A 399 -13.428 3.790 9.330 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -12.284 2.006 10.623 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -10.998 3.116 11.056 1.00 0.00 H new ATOM 300 N GLY A 400 -10.759 1.202 8.035 1.00 0.00 N ATOM 301 CA GLY A 400 -10.797 -0.212 7.630 1.00 0.00 C ATOM 302 C GLY A 400 -10.572 -0.457 6.132 1.00 0.00 C ATOM 303 O GLY A 400 -10.544 -1.613 5.719 1.00 0.00 O ATOM 0 H GLY A 400 -9.855 1.482 8.414 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -10.038 -0.757 8.191 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -11.763 -0.630 7.911 1.00 0.00 H new ATOM 307 N ALA A 401 -10.408 0.598 5.324 1.00 0.00 N ATOM 308 CA ALA A 401 -10.259 0.539 3.863 1.00 0.00 C ATOM 309 C ALA A 401 -8.871 0.982 3.348 1.00 0.00 C ATOM 310 O ALA A 401 -8.622 0.959 2.142 1.00 0.00 O ATOM 311 CB ALA A 401 -11.384 1.373 3.244 1.00 0.00 C ATOM 0 H ALA A 401 -10.374 1.552 5.683 1.00 0.00 H new ATOM 0 HA ALA A 401 -10.333 -0.504 3.556 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -11.300 1.348 2.158 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -12.348 0.962 3.543 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -11.306 2.403 3.591 1.00 0.00 H new ATOM 317 N ASN A 402 -7.961 1.369 4.246 1.00 0.00 N ATOM 318 CA ASN A 402 -6.554 1.668 3.947 1.00 0.00 C ATOM 319 C ASN A 402 -5.643 0.481 4.314 1.00 0.00 C ATOM 320 O ASN A 402 -5.832 -0.170 5.344 1.00 0.00 O ATOM 321 CB ASN A 402 -6.136 2.982 4.639 1.00 0.00 C ATOM 322 CG ASN A 402 -6.430 3.030 6.140 1.00 0.00 C ATOM 323 OD1 ASN A 402 -5.878 2.282 6.932 1.00 0.00 O ATOM 324 ND2 ASN A 402 -7.302 3.918 6.579 1.00 0.00 N ATOM 0 H ASN A 402 -8.188 1.487 5.233 1.00 0.00 H new ATOM 0 HA ASN A 402 -6.439 1.815 2.873 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -5.068 3.135 4.486 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -6.649 3.812 4.154 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -7.512 3.977 7.575 1.00 0.00 H new ATOM 0 HD22 ASN A 402 -7.766 4.545 5.922 1.00 0.00 H new ATOM 331 N LEU A 403 -4.653 0.189 3.462 1.00 0.00 N ATOM 332 CA LEU A 403 -3.745 -0.959 3.583 1.00 0.00 C ATOM 333 C LEU A 403 -2.277 -0.549 3.574 1.00 0.00 C ATOM 334 O LEU A 403 -1.897 0.424 2.921 1.00 0.00 O ATOM 335 CB LEU A 403 -3.965 -1.954 2.423 1.00 0.00 C ATOM 336 CG LEU A 403 -5.332 -2.649 2.383 1.00 0.00 C ATOM 337 CD1 LEU A 403 -5.351 -3.636 1.212 1.00 0.00 C ATOM 338 CD2 LEU A 403 -5.608 -3.423 3.674 1.00 0.00 C ATOM 0 H LEU A 403 -4.455 0.764 2.643 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.976 -1.423 4.542 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -3.822 -1.422 1.482 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -3.192 -2.720 2.476 1.00 0.00 H new ATOM 0 HG LEU A 403 -6.099 -1.883 2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -6.319 -4.136 1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -5.184 -3.097 0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -4.564 -4.378 1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -6.585 -3.902 3.609 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.840 -4.183 3.814 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -5.596 -2.736 4.520 1.00 0.00 H new ATOM 350 N PHE A 404 -1.475 -1.383 4.231 1.00 0.00 N ATOM 351 CA PHE A 404 -0.019 -1.399 4.236 1.00 0.00 C ATOM 352 C PHE A 404 0.470 -2.760 3.726 1.00 0.00 C ATOM 353 O PHE A 404 -0.023 -3.808 4.144 1.00 0.00 O ATOM 354 CB PHE A 404 0.461 -1.146 5.667 1.00 0.00 C ATOM 355 CG PHE A 404 1.932 -1.426 5.913 1.00 0.00 C ATOM 356 CD1 PHE A 404 2.913 -0.523 5.465 1.00 0.00 C ATOM 357 CD2 PHE A 404 2.317 -2.573 6.633 1.00 0.00 C ATOM 358 CE1 PHE A 404 4.265 -0.734 5.789 1.00 0.00 C ATOM 359 CE2 PHE A 404 3.668 -2.784 6.957 1.00 0.00 C ATOM 360 CZ PHE A 404 4.638 -1.851 6.556 1.00 0.00 C ATOM 0 H PHE A 404 -1.859 -2.122 4.819 1.00 0.00 H new ATOM 0 HA PHE A 404 0.382 -0.624 3.583 1.00 0.00 H new ATOM 0 HB2 PHE A 404 0.258 -0.106 5.923 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -0.128 -1.763 6.345 1.00 0.00 H new ATOM 0 HD1 PHE A 404 2.628 0.333 4.872 1.00 0.00 H new ATOM 0 HD2 PHE A 404 1.572 -3.293 6.937 1.00 0.00 H new ATOM 0 HE1 PHE A 404 5.017 -0.038 5.448 1.00 0.00 H new ATOM 0 HE2 PHE A 404 3.960 -3.662 7.514 1.00 0.00 H new ATOM 0 HZ PHE A 404 5.671 -1.992 6.837 1.00 0.00 H new ATOM 370 N ILE A 405 1.443 -2.721 2.817 1.00 0.00 N ATOM 371 CA ILE A 405 2.098 -3.859 2.167 1.00 0.00 C ATOM 372 C ILE A 405 3.604 -3.760 2.450 1.00 0.00 C ATOM 373 O ILE A 405 4.175 -2.675 2.360 1.00 0.00 O ATOM 374 CB ILE A 405 1.825 -3.840 0.635 1.00 0.00 C ATOM 375 CG1 ILE A 405 0.333 -3.924 0.228 1.00 0.00 C ATOM 376 CG2 ILE A 405 2.547 -5.024 -0.038 1.00 0.00 C ATOM 377 CD1 ILE A 405 -0.478 -2.623 0.308 1.00 0.00 C ATOM 0 H ILE A 405 1.822 -1.832 2.491 1.00 0.00 H new ATOM 0 HA ILE A 405 1.704 -4.797 2.559 1.00 0.00 H new ATOM 0 HB ILE A 405 2.196 -2.870 0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 405 0.280 -4.296 -0.795 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -0.151 -4.666 0.862 1.00 0.00 H new ATOM 0 HG21 ILE A 405 2.353 -5.006 -1.110 1.00 0.00 H new ATOM 0 HG22 ILE A 405 3.620 -4.944 0.138 1.00 0.00 H new ATOM 0 HG23 ILE A 405 2.180 -5.960 0.382 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.505 -2.815 -0.002 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -0.472 -2.253 1.333 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.034 -1.876 -0.350 1.00 0.00 H new ATOM 389 N TYR A 406 4.260 -4.881 2.745 1.00 0.00 N ATOM 390 CA TYR A 406 5.706 -4.979 2.985 1.00 0.00 C ATOM 391 C TYR A 406 6.297 -6.241 2.320 1.00 0.00 C ATOM 392 O TYR A 406 5.590 -7.231 2.139 1.00 0.00 O ATOM 393 CB TYR A 406 5.962 -4.930 4.502 1.00 0.00 C ATOM 394 CG TYR A 406 7.388 -4.583 4.887 1.00 0.00 C ATOM 395 CD1 TYR A 406 8.376 -5.583 4.936 1.00 0.00 C ATOM 396 CD2 TYR A 406 7.736 -3.252 5.178 1.00 0.00 C ATOM 397 CE1 TYR A 406 9.716 -5.248 5.202 1.00 0.00 C ATOM 398 CE2 TYR A 406 9.067 -2.907 5.475 1.00 0.00 C ATOM 399 CZ TYR A 406 10.070 -3.904 5.457 1.00 0.00 C ATOM 400 OH TYR A 406 11.372 -3.569 5.676 1.00 0.00 O ATOM 0 H TYR A 406 3.786 -5.780 2.827 1.00 0.00 H new ATOM 0 HA TYR A 406 6.218 -4.134 2.525 1.00 0.00 H new ATOM 0 HB2 TYR A 406 5.290 -4.197 4.948 1.00 0.00 H new ATOM 0 HB3 TYR A 406 5.708 -5.899 4.932 1.00 0.00 H new ATOM 0 HD1 TYR A 406 8.104 -6.615 4.768 1.00 0.00 H new ATOM 0 HD2 TYR A 406 6.974 -2.487 5.173 1.00 0.00 H new ATOM 0 HE1 TYR A 406 10.474 -6.017 5.211 1.00 0.00 H new ATOM 0 HE2 TYR A 406 9.322 -1.885 5.716 1.00 0.00 H new ATOM 0 HH TYR A 406 11.439 -2.604 5.834 1.00 0.00 H new ATOM 410 N HIS A 407 7.580 -6.183 1.938 1.00 0.00 N ATOM 411 CA HIS A 407 8.378 -7.183 1.193 1.00 0.00 C ATOM 412 C HIS A 407 8.222 -7.085 -0.348 1.00 0.00 C ATOM 413 O HIS A 407 8.422 -8.070 -1.059 1.00 0.00 O ATOM 414 CB HIS A 407 8.208 -8.626 1.722 1.00 0.00 C ATOM 415 CG HIS A 407 8.547 -8.826 3.173 1.00 0.00 C ATOM 416 ND1 HIS A 407 9.817 -8.664 3.733 1.00 0.00 N ATOM 417 CD2 HIS A 407 7.694 -9.283 4.135 1.00 0.00 C ATOM 418 CE1 HIS A 407 9.692 -9.023 5.021 1.00 0.00 C ATOM 419 NE2 HIS A 407 8.429 -9.401 5.293 1.00 0.00 N ATOM 0 H HIS A 407 8.143 -5.362 2.160 1.00 0.00 H new ATOM 0 HA HIS A 407 9.414 -6.914 1.397 1.00 0.00 H new ATOM 0 HB2 HIS A 407 7.175 -8.934 1.562 1.00 0.00 H new ATOM 0 HB3 HIS A 407 8.834 -9.289 1.125 1.00 0.00 H new ATOM 0 HD2 HIS A 407 6.645 -9.509 4.012 1.00 0.00 H new ATOM 0 HE1 HIS A 407 10.496 -9.010 5.742 1.00 0.00 H new ATOM 0 HE2 HIS A 407 8.079 -9.719 6.197 1.00 0.00 H new ATOM 427 N LEU A 408 7.873 -5.908 -0.884 1.00 0.00 N ATOM 428 CA LEU A 408 7.803 -5.660 -2.337 1.00 0.00 C ATOM 429 C LEU A 408 9.204 -5.694 -2.998 1.00 0.00 C ATOM 430 O LEU A 408 10.209 -5.511 -2.301 1.00 0.00 O ATOM 431 CB LEU A 408 7.111 -4.304 -2.601 1.00 0.00 C ATOM 432 CG LEU A 408 5.610 -4.281 -2.245 1.00 0.00 C ATOM 433 CD1 LEU A 408 5.123 -2.831 -2.130 1.00 0.00 C ATOM 434 CD2 LEU A 408 4.772 -5.007 -3.310 1.00 0.00 C ATOM 0 H LEU A 408 7.629 -5.093 -0.321 1.00 0.00 H new ATOM 0 HA LEU A 408 7.217 -6.461 -2.788 1.00 0.00 H new ATOM 0 HB2 LEU A 408 7.621 -3.530 -2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 408 7.227 -4.048 -3.654 1.00 0.00 H new ATOM 0 HG LEU A 408 5.486 -4.796 -1.292 1.00 0.00 H new ATOM 0 HD11 LEU A 408 4.062 -2.822 -1.878 1.00 0.00 H new ATOM 0 HD12 LEU A 408 5.685 -2.319 -1.349 1.00 0.00 H new ATOM 0 HD13 LEU A 408 5.275 -2.320 -3.081 1.00 0.00 H new ATOM 0 HD21 LEU A 408 3.719 -4.973 -3.030 1.00 0.00 H new ATOM 0 HD22 LEU A 408 4.907 -4.518 -4.275 1.00 0.00 H new ATOM 0 HD23 LEU A 408 5.095 -6.046 -3.382 1.00 0.00 H new ATOM 446 N PRO A 409 9.296 -5.908 -4.327 1.00 0.00 N ATOM 447 CA PRO A 409 10.536 -5.745 -5.089 1.00 0.00 C ATOM 448 C PRO A 409 11.106 -4.324 -4.970 1.00 0.00 C ATOM 449 O PRO A 409 10.354 -3.355 -4.873 1.00 0.00 O ATOM 450 CB PRO A 409 10.177 -6.078 -6.545 1.00 0.00 C ATOM 451 CG PRO A 409 8.957 -6.989 -6.413 1.00 0.00 C ATOM 452 CD PRO A 409 8.240 -6.411 -5.196 1.00 0.00 C ATOM 0 HA PRO A 409 11.316 -6.402 -4.704 1.00 0.00 H new ATOM 0 HB2 PRO A 409 9.947 -5.179 -7.117 1.00 0.00 H new ATOM 0 HB3 PRO A 409 10.999 -6.579 -7.056 1.00 0.00 H new ATOM 0 HG2 PRO A 409 8.331 -6.959 -7.305 1.00 0.00 H new ATOM 0 HG3 PRO A 409 9.243 -8.029 -6.259 1.00 0.00 H new ATOM 0 HD2 PRO A 409 7.556 -5.613 -5.485 1.00 0.00 H new ATOM 0 HD3 PRO A 409 7.646 -7.173 -4.692 1.00 0.00 H new ATOM 460 N GLN A 410 12.437 -4.189 -5.034 1.00 0.00 N ATOM 461 CA GLN A 410 13.147 -2.901 -4.915 1.00 0.00 C ATOM 462 C GLN A 410 13.006 -1.980 -6.147 1.00 0.00 C ATOM 463 O GLN A 410 13.618 -0.914 -6.201 1.00 0.00 O ATOM 464 CB GLN A 410 14.622 -3.147 -4.544 1.00 0.00 C ATOM 465 CG GLN A 410 15.457 -3.788 -5.668 1.00 0.00 C ATOM 466 CD GLN A 410 16.925 -3.953 -5.264 1.00 0.00 C ATOM 467 OE1 GLN A 410 17.270 -4.691 -4.348 1.00 0.00 O ATOM 468 NE2 GLN A 410 17.850 -3.280 -5.922 1.00 0.00 N ATOM 0 H GLN A 410 13.064 -4.982 -5.172 1.00 0.00 H new ATOM 0 HA GLN A 410 12.661 -2.350 -4.110 1.00 0.00 H new ATOM 0 HB2 GLN A 410 15.078 -2.197 -4.264 1.00 0.00 H new ATOM 0 HB3 GLN A 410 14.662 -3.791 -3.665 1.00 0.00 H new ATOM 0 HG2 GLN A 410 15.038 -4.762 -5.921 1.00 0.00 H new ATOM 0 HG3 GLN A 410 15.394 -3.171 -6.564 1.00 0.00 H new ATOM 0 HE21 GLN A 410 17.583 -2.661 -6.687 1.00 0.00 H new ATOM 0 HE22 GLN A 410 18.832 -3.379 -5.665 1.00 0.00 H new ATOM 477 N GLU A 411 12.180 -2.362 -7.125 1.00 0.00 N ATOM 478 CA GLU A 411 11.924 -1.635 -8.377 1.00 0.00 C ATOM 479 C GLU A 411 10.421 -1.543 -8.730 1.00 0.00 C ATOM 480 O GLU A 411 10.064 -1.121 -9.833 1.00 0.00 O ATOM 481 CB GLU A 411 12.755 -2.268 -9.509 1.00 0.00 C ATOM 482 CG GLU A 411 12.365 -3.721 -9.828 1.00 0.00 C ATOM 483 CD GLU A 411 13.227 -4.278 -10.971 1.00 0.00 C ATOM 484 OE1 GLU A 411 14.307 -4.853 -10.695 1.00 0.00 O ATOM 485 OE2 GLU A 411 12.830 -4.154 -12.154 1.00 0.00 O ATOM 0 H GLU A 411 11.645 -3.228 -7.065 1.00 0.00 H new ATOM 0 HA GLU A 411 12.240 -0.601 -8.241 1.00 0.00 H new ATOM 0 HB2 GLU A 411 12.642 -1.665 -10.410 1.00 0.00 H new ATOM 0 HB3 GLU A 411 13.809 -2.237 -9.234 1.00 0.00 H new ATOM 0 HG2 GLU A 411 12.488 -4.339 -8.939 1.00 0.00 H new ATOM 0 HG3 GLU A 411 11.312 -3.767 -10.105 1.00 0.00 H new ATOM 492 N PHE A 412 9.532 -1.941 -7.808 1.00 0.00 N ATOM 493 CA PHE A 412 8.079 -1.948 -8.005 1.00 0.00 C ATOM 494 C PHE A 412 7.509 -0.517 -8.003 1.00 0.00 C ATOM 495 O PHE A 412 7.886 0.297 -7.158 1.00 0.00 O ATOM 496 CB PHE A 412 7.440 -2.818 -6.906 1.00 0.00 C ATOM 497 CG PHE A 412 6.293 -3.696 -7.364 1.00 0.00 C ATOM 498 CD1 PHE A 412 6.539 -4.739 -8.277 1.00 0.00 C ATOM 499 CD2 PHE A 412 5.004 -3.528 -6.826 1.00 0.00 C ATOM 500 CE1 PHE A 412 5.501 -5.614 -8.645 1.00 0.00 C ATOM 501 CE2 PHE A 412 3.972 -4.413 -7.184 1.00 0.00 C ATOM 502 CZ PHE A 412 4.219 -5.457 -8.091 1.00 0.00 C ATOM 0 H PHE A 412 9.812 -2.274 -6.885 1.00 0.00 H new ATOM 0 HA PHE A 412 7.842 -2.372 -8.981 1.00 0.00 H new ATOM 0 HB2 PHE A 412 8.212 -3.453 -6.473 1.00 0.00 H new ATOM 0 HB3 PHE A 412 7.081 -2.165 -6.110 1.00 0.00 H new ATOM 0 HD1 PHE A 412 7.526 -4.868 -8.696 1.00 0.00 H new ATOM 0 HD2 PHE A 412 4.807 -2.719 -6.138 1.00 0.00 H new ATOM 0 HE1 PHE A 412 5.689 -6.407 -9.354 1.00 0.00 H new ATOM 0 HE2 PHE A 412 2.986 -4.290 -6.760 1.00 0.00 H new ATOM 0 HZ PHE A 412 3.425 -6.138 -8.362 1.00 0.00 H new ATOM 512 N GLY A 413 6.609 -0.206 -8.942 1.00 0.00 N ATOM 513 CA GLY A 413 5.979 1.113 -9.086 1.00 0.00 C ATOM 514 C GLY A 413 4.542 1.172 -8.566 1.00 0.00 C ATOM 515 O GLY A 413 3.889 0.152 -8.349 1.00 0.00 O ATOM 0 H GLY A 413 6.290 -0.879 -9.639 1.00 0.00 H new ATOM 0 HA2 GLY A 413 6.578 1.851 -8.554 1.00 0.00 H new ATOM 0 HA3 GLY A 413 5.986 1.396 -10.139 1.00 0.00 H new ATOM 519 N ASP A 414 4.024 2.396 -8.432 1.00 0.00 N ATOM 520 CA ASP A 414 2.649 2.686 -7.983 1.00 0.00 C ATOM 521 C ASP A 414 1.583 2.011 -8.872 1.00 0.00 C ATOM 522 O ASP A 414 0.537 1.575 -8.390 1.00 0.00 O ATOM 523 CB ASP A 414 2.431 4.213 -7.991 1.00 0.00 C ATOM 524 CG ASP A 414 3.321 5.011 -7.026 1.00 0.00 C ATOM 525 OD1 ASP A 414 3.879 4.424 -6.074 1.00 0.00 O ATOM 526 OD2 ASP A 414 3.435 6.246 -7.188 1.00 0.00 O ATOM 0 H ASP A 414 4.560 3.239 -8.637 1.00 0.00 H new ATOM 0 HA ASP A 414 2.535 2.282 -6.977 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.600 4.582 -9.003 1.00 0.00 H new ATOM 0 HB3 ASP A 414 1.388 4.415 -7.748 1.00 0.00 H new ATOM 531 N GLN A 415 1.878 1.896 -10.171 1.00 0.00 N ATOM 532 CA GLN A 415 1.025 1.276 -11.186 1.00 0.00 C ATOM 533 C GLN A 415 1.080 -0.264 -11.142 1.00 0.00 C ATOM 534 O GLN A 415 0.083 -0.923 -11.444 1.00 0.00 O ATOM 535 CB GLN A 415 1.476 1.835 -12.549 1.00 0.00 C ATOM 536 CG GLN A 415 0.657 1.352 -13.754 1.00 0.00 C ATOM 537 CD GLN A 415 -0.829 1.708 -13.677 1.00 0.00 C ATOM 538 OE1 GLN A 415 -1.230 2.797 -13.287 1.00 0.00 O ATOM 539 NE2 GLN A 415 -1.695 0.797 -14.057 1.00 0.00 N ATOM 0 H GLN A 415 2.754 2.247 -10.558 1.00 0.00 H new ATOM 0 HA GLN A 415 -0.021 1.520 -10.999 1.00 0.00 H new ATOM 0 HB2 GLN A 415 1.430 2.923 -12.511 1.00 0.00 H new ATOM 0 HB3 GLN A 415 2.520 1.565 -12.707 1.00 0.00 H new ATOM 0 HG2 GLN A 415 1.077 1.783 -14.663 1.00 0.00 H new ATOM 0 HG3 GLN A 415 0.757 0.270 -13.839 1.00 0.00 H new ATOM 0 HE21 GLN A 415 -1.368 -0.113 -14.383 1.00 0.00 H new ATOM 0 HE22 GLN A 415 -2.694 0.999 -14.026 1.00 0.00 H new ATOM 548 N ASP A 416 2.206 -0.850 -10.717 1.00 0.00 N ATOM 549 CA ASP A 416 2.345 -2.303 -10.556 1.00 0.00 C ATOM 550 C ASP A 416 1.550 -2.795 -9.338 1.00 0.00 C ATOM 551 O ASP A 416 0.859 -3.812 -9.416 1.00 0.00 O ATOM 552 CB ASP A 416 3.822 -2.701 -10.413 1.00 0.00 C ATOM 553 CG ASP A 416 4.681 -2.299 -11.621 1.00 0.00 C ATOM 554 OD1 ASP A 416 4.463 -2.850 -12.727 1.00 0.00 O ATOM 555 OD2 ASP A 416 5.594 -1.458 -11.445 1.00 0.00 O ATOM 0 H ASP A 416 3.049 -0.329 -10.474 1.00 0.00 H new ATOM 0 HA ASP A 416 1.943 -2.776 -11.452 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.231 -2.237 -9.515 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.888 -3.780 -10.272 1.00 0.00 H new ATOM 560 N LEU A 417 1.587 -2.032 -8.237 1.00 0.00 N ATOM 561 CA LEU A 417 0.797 -2.303 -7.036 1.00 0.00 C ATOM 562 C LEU A 417 -0.706 -2.182 -7.312 1.00 0.00 C ATOM 563 O LEU A 417 -1.474 -3.030 -6.860 1.00 0.00 O ATOM 564 CB LEU A 417 1.274 -1.363 -5.914 1.00 0.00 C ATOM 565 CG LEU A 417 0.733 -1.719 -4.514 1.00 0.00 C ATOM 566 CD1 LEU A 417 1.261 -3.076 -4.024 1.00 0.00 C ATOM 567 CD2 LEU A 417 1.145 -0.635 -3.511 1.00 0.00 C ATOM 0 H LEU A 417 2.174 -1.201 -8.158 1.00 0.00 H new ATOM 0 HA LEU A 417 0.951 -3.333 -6.715 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.363 -1.376 -5.884 1.00 0.00 H new ATOM 0 HB3 LEU A 417 0.974 -0.344 -6.158 1.00 0.00 H new ATOM 0 HG LEU A 417 -0.353 -1.780 -4.588 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.856 -3.288 -3.035 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.953 -3.858 -4.718 1.00 0.00 H new ATOM 0 HD13 LEU A 417 2.349 -3.046 -3.971 1.00 0.00 H new ATOM 0 HD21 LEU A 417 0.761 -0.889 -2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.232 -0.569 -3.472 1.00 0.00 H new ATOM 0 HD23 LEU A 417 0.734 0.325 -3.824 1.00 0.00 H new ATOM 579 N LEU A 418 -1.122 -1.193 -8.114 1.00 0.00 N ATOM 580 CA LEU A 418 -2.511 -1.036 -8.556 1.00 0.00 C ATOM 581 C LEU A 418 -3.005 -2.264 -9.322 1.00 0.00 C ATOM 582 O LEU A 418 -4.024 -2.839 -8.947 1.00 0.00 O ATOM 583 CB LEU A 418 -2.627 0.238 -9.409 1.00 0.00 C ATOM 584 CG LEU A 418 -4.021 0.510 -10.010 1.00 0.00 C ATOM 585 CD1 LEU A 418 -5.090 0.713 -8.930 1.00 0.00 C ATOM 586 CD2 LEU A 418 -3.952 1.756 -10.898 1.00 0.00 C ATOM 0 H LEU A 418 -0.497 -0.473 -8.477 1.00 0.00 H new ATOM 0 HA LEU A 418 -3.150 -0.941 -7.678 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.342 1.092 -8.795 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -1.905 0.176 -10.223 1.00 0.00 H new ATOM 0 HG LEU A 418 -4.307 -0.364 -10.594 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -6.054 0.901 -9.403 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -5.158 -0.182 -8.312 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -4.820 1.565 -8.306 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -4.935 1.953 -11.326 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.638 2.612 -10.300 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -3.234 1.591 -11.701 1.00 0.00 H new ATOM 598 N GLN A 419 -2.295 -2.688 -10.369 1.00 0.00 N ATOM 599 CA GLN A 419 -2.733 -3.816 -11.201 1.00 0.00 C ATOM 600 C GLN A 419 -2.652 -5.171 -10.474 1.00 0.00 C ATOM 601 O GLN A 419 -3.321 -6.120 -10.885 1.00 0.00 O ATOM 602 CB GLN A 419 -1.957 -3.821 -12.528 1.00 0.00 C ATOM 603 CG GLN A 419 -2.424 -2.671 -13.439 1.00 0.00 C ATOM 604 CD GLN A 419 -1.689 -2.643 -14.779 1.00 0.00 C ATOM 605 OE1 GLN A 419 -0.892 -1.757 -15.061 1.00 0.00 O ATOM 606 NE2 GLN A 419 -1.934 -3.586 -15.666 1.00 0.00 N ATOM 0 H GLN A 419 -1.413 -2.268 -10.663 1.00 0.00 H new ATOM 0 HA GLN A 419 -3.792 -3.674 -11.418 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -0.889 -3.724 -12.331 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -2.102 -4.775 -13.036 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -3.495 -2.767 -13.619 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -2.271 -1.722 -12.926 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -2.595 -4.332 -15.448 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -1.463 -3.570 -16.570 1.00 0.00 H new ATOM 615 N MET A 420 -1.907 -5.258 -9.365 1.00 0.00 N ATOM 616 CA MET A 420 -1.856 -6.440 -8.496 1.00 0.00 C ATOM 617 C MET A 420 -3.001 -6.482 -7.464 1.00 0.00 C ATOM 618 O MET A 420 -3.439 -7.571 -7.091 1.00 0.00 O ATOM 619 CB MET A 420 -0.470 -6.486 -7.839 1.00 0.00 C ATOM 620 CG MET A 420 -0.203 -7.822 -7.140 1.00 0.00 C ATOM 621 SD MET A 420 1.535 -8.117 -6.714 1.00 0.00 S ATOM 622 CE MET A 420 1.784 -6.877 -5.421 1.00 0.00 C ATOM 0 H MET A 420 -1.312 -4.495 -9.041 1.00 0.00 H new ATOM 0 HA MET A 420 -2.007 -7.334 -9.100 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.295 -6.316 -8.597 1.00 0.00 H new ATOM 0 HB3 MET A 420 -0.387 -5.676 -7.114 1.00 0.00 H new ATOM 0 HG2 MET A 420 -0.799 -7.866 -6.229 1.00 0.00 H new ATOM 0 HG3 MET A 420 -0.547 -8.630 -7.785 1.00 0.00 H new ATOM 0 HE1 MET A 420 2.810 -6.933 -5.056 1.00 0.00 H new ATOM 0 HE2 MET A 420 1.598 -5.884 -5.829 1.00 0.00 H new ATOM 0 HE3 MET A 420 1.095 -7.066 -4.598 1.00 0.00 H new ATOM 632 N PHE A 421 -3.519 -5.322 -7.038 1.00 0.00 N ATOM 633 CA PHE A 421 -4.614 -5.186 -6.061 1.00 0.00 C ATOM 634 C PHE A 421 -6.000 -4.901 -6.686 1.00 0.00 C ATOM 635 O PHE A 421 -7.021 -5.056 -6.013 1.00 0.00 O ATOM 636 CB PHE A 421 -4.210 -4.154 -4.994 1.00 0.00 C ATOM 637 CG PHE A 421 -3.338 -4.725 -3.883 1.00 0.00 C ATOM 638 CD1 PHE A 421 -1.994 -5.077 -4.122 1.00 0.00 C ATOM 639 CD2 PHE A 421 -3.879 -4.913 -2.596 1.00 0.00 C ATOM 640 CE1 PHE A 421 -1.212 -5.625 -3.089 1.00 0.00 C ATOM 641 CE2 PHE A 421 -3.098 -5.466 -1.565 1.00 0.00 C ATOM 642 CZ PHE A 421 -1.766 -5.831 -1.814 1.00 0.00 C ATOM 0 H PHE A 421 -3.178 -4.421 -7.374 1.00 0.00 H new ATOM 0 HA PHE A 421 -4.754 -6.157 -5.586 1.00 0.00 H new ATOM 0 HB2 PHE A 421 -3.676 -3.336 -5.477 1.00 0.00 H new ATOM 0 HB3 PHE A 421 -5.112 -3.730 -4.553 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -1.564 -4.926 -5.101 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -4.903 -4.630 -2.399 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -0.182 -5.889 -3.277 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.523 -5.610 -0.583 1.00 0.00 H new ATOM 0 HZ PHE A 421 -1.168 -6.269 -1.028 1.00 0.00 H new ATOM 652 N MET A 422 -6.060 -4.576 -7.981 1.00 0.00 N ATOM 653 CA MET A 422 -7.287 -4.453 -8.794 1.00 0.00 C ATOM 654 C MET A 422 -8.362 -5.545 -8.574 1.00 0.00 C ATOM 655 O MET A 422 -9.539 -5.177 -8.508 1.00 0.00 O ATOM 656 CB MET A 422 -6.900 -4.426 -10.286 1.00 0.00 C ATOM 657 CG MET A 422 -6.814 -3.012 -10.852 1.00 0.00 C ATOM 658 SD MET A 422 -6.358 -3.014 -12.604 1.00 0.00 S ATOM 659 CE MET A 422 -6.550 -1.254 -12.946 1.00 0.00 C ATOM 0 H MET A 422 -5.218 -4.381 -8.522 1.00 0.00 H new ATOM 0 HA MET A 422 -7.753 -3.525 -8.463 1.00 0.00 H new ATOM 0 HB2 MET A 422 -5.939 -4.923 -10.416 1.00 0.00 H new ATOM 0 HB3 MET A 422 -7.633 -4.996 -10.857 1.00 0.00 H new ATOM 0 HG2 MET A 422 -7.774 -2.512 -10.727 1.00 0.00 H new ATOM 0 HG3 MET A 422 -6.080 -2.438 -10.286 1.00 0.00 H new ATOM 0 HE1 MET A 422 -6.310 -1.058 -13.991 1.00 0.00 H new ATOM 0 HE2 MET A 422 -7.579 -0.955 -12.748 1.00 0.00 H new ATOM 0 HE3 MET A 422 -5.877 -0.683 -12.306 1.00 0.00 H new ATOM 669 N PRO A 423 -8.022 -6.853 -8.472 1.00 0.00 N ATOM 670 CA PRO A 423 -9.009 -7.933 -8.372 1.00 0.00 C ATOM 671 C PRO A 423 -9.917 -7.906 -7.132 1.00 0.00 C ATOM 672 O PRO A 423 -10.926 -8.611 -7.118 1.00 0.00 O ATOM 673 CB PRO A 423 -8.201 -9.235 -8.400 1.00 0.00 C ATOM 674 CG PRO A 423 -6.945 -8.860 -9.177 1.00 0.00 C ATOM 675 CD PRO A 423 -6.703 -7.428 -8.715 1.00 0.00 C ATOM 0 HA PRO A 423 -9.710 -7.823 -9.200 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -7.962 -9.580 -7.394 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -8.751 -10.038 -8.890 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -6.106 -9.513 -8.937 1.00 0.00 H new ATOM 0 HG3 PRO A 423 -7.098 -8.921 -10.254 1.00 0.00 H new ATOM 0 HD2 PRO A 423 -6.096 -7.408 -7.810 1.00 0.00 H new ATOM 0 HD3 PRO A 423 -6.164 -6.860 -9.473 1.00 0.00 H new ATOM 683 N PHE A 424 -9.580 -7.120 -6.100 1.00 0.00 N ATOM 684 CA PHE A 424 -10.237 -7.169 -4.786 1.00 0.00 C ATOM 685 C PHE A 424 -11.243 -6.026 -4.541 1.00 0.00 C ATOM 686 O PHE A 424 -11.893 -6.006 -3.494 1.00 0.00 O ATOM 687 CB PHE A 424 -9.152 -7.248 -3.697 1.00 0.00 C ATOM 688 CG PHE A 424 -8.036 -8.235 -4.007 1.00 0.00 C ATOM 689 CD1 PHE A 424 -8.344 -9.587 -4.262 1.00 0.00 C ATOM 690 CD2 PHE A 424 -6.704 -7.792 -4.133 1.00 0.00 C ATOM 691 CE1 PHE A 424 -7.337 -10.477 -4.673 1.00 0.00 C ATOM 692 CE2 PHE A 424 -5.699 -8.685 -4.541 1.00 0.00 C ATOM 693 CZ PHE A 424 -6.013 -10.025 -4.816 1.00 0.00 C ATOM 0 H PHE A 424 -8.836 -6.425 -6.155 1.00 0.00 H new ATOM 0 HA PHE A 424 -10.856 -8.065 -4.752 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -8.719 -6.258 -3.557 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -9.619 -7.528 -2.753 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -9.357 -9.940 -4.141 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -6.455 -6.764 -3.915 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.580 -11.509 -4.879 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.681 -8.339 -4.643 1.00 0.00 H new ATOM 0 HZ PHE A 424 -5.240 -10.707 -5.137 1.00 0.00 H new ATOM 703 N GLY A 425 -11.407 -5.102 -5.501 1.00 0.00 N ATOM 704 CA GLY A 425 -12.390 -4.007 -5.461 1.00 0.00 C ATOM 705 C GLY A 425 -11.898 -2.693 -6.072 1.00 0.00 C ATOM 706 O GLY A 425 -10.834 -2.626 -6.686 1.00 0.00 O ATOM 0 H GLY A 425 -10.843 -5.096 -6.351 1.00 0.00 H new ATOM 0 HA2 GLY A 425 -13.290 -4.324 -5.988 1.00 0.00 H new ATOM 0 HA3 GLY A 425 -12.674 -3.828 -4.424 1.00 0.00 H new ATOM 710 N ASN A 426 -12.690 -1.630 -5.908 1.00 0.00 N ATOM 711 CA ASN A 426 -12.396 -0.304 -6.457 1.00 0.00 C ATOM 712 C ASN A 426 -11.272 0.407 -5.673 1.00 0.00 C ATOM 713 O ASN A 426 -11.496 0.927 -4.577 1.00 0.00 O ATOM 714 CB ASN A 426 -13.689 0.528 -6.491 1.00 0.00 C ATOM 715 CG ASN A 426 -13.467 1.931 -7.053 1.00 0.00 C ATOM 716 OD1 ASN A 426 -12.636 2.147 -7.929 1.00 0.00 O ATOM 717 ND2 ASN A 426 -14.187 2.920 -6.559 1.00 0.00 N ATOM 0 H ASN A 426 -13.564 -1.667 -5.384 1.00 0.00 H new ATOM 0 HA ASN A 426 -12.025 -0.418 -7.476 1.00 0.00 H new ATOM 0 HB2 ASN A 426 -14.434 0.011 -7.096 1.00 0.00 H new ATOM 0 HB3 ASN A 426 -14.095 0.604 -5.482 1.00 0.00 H new ATOM 0 HD21 ASN A 426 -14.054 3.870 -6.905 1.00 0.00 H new ATOM 0 HD22 ASN A 426 -14.877 2.734 -5.831 1.00 0.00 H new ATOM 724 N VAL A 427 -10.069 0.441 -6.252 1.00 0.00 N ATOM 725 CA VAL A 427 -8.887 1.108 -5.681 1.00 0.00 C ATOM 726 C VAL A 427 -8.965 2.624 -5.927 1.00 0.00 C ATOM 727 O VAL A 427 -8.918 3.084 -7.067 1.00 0.00 O ATOM 728 CB VAL A 427 -7.570 0.517 -6.240 1.00 0.00 C ATOM 729 CG1 VAL A 427 -6.345 1.279 -5.710 1.00 0.00 C ATOM 730 CG2 VAL A 427 -7.415 -0.969 -5.870 1.00 0.00 C ATOM 0 H VAL A 427 -9.881 -0.003 -7.151 1.00 0.00 H new ATOM 0 HA VAL A 427 -8.884 0.929 -4.606 1.00 0.00 H new ATOM 0 HB VAL A 427 -7.624 0.618 -7.324 1.00 0.00 H new ATOM 0 HG11 VAL A 427 -5.437 0.839 -6.122 1.00 0.00 H new ATOM 0 HG12 VAL A 427 -6.409 2.325 -6.010 1.00 0.00 H new ATOM 0 HG13 VAL A 427 -6.319 1.214 -4.622 1.00 0.00 H new ATOM 0 HG21 VAL A 427 -6.479 -1.350 -6.279 1.00 0.00 H new ATOM 0 HG22 VAL A 427 -7.407 -1.075 -4.785 1.00 0.00 H new ATOM 0 HG23 VAL A 427 -8.249 -1.536 -6.283 1.00 0.00 H new ATOM 740 N VAL A 428 -9.058 3.388 -4.842 1.00 0.00 N ATOM 741 CA VAL A 428 -9.085 4.863 -4.813 1.00 0.00 C ATOM 742 C VAL A 428 -7.688 5.437 -5.087 1.00 0.00 C ATOM 743 O VAL A 428 -7.556 6.422 -5.812 1.00 0.00 O ATOM 744 CB VAL A 428 -9.620 5.367 -3.448 1.00 0.00 C ATOM 745 CG1 VAL A 428 -9.507 6.888 -3.258 1.00 0.00 C ATOM 746 CG2 VAL A 428 -11.092 4.960 -3.272 1.00 0.00 C ATOM 0 H VAL A 428 -9.120 2.983 -3.908 1.00 0.00 H new ATOM 0 HA VAL A 428 -9.757 5.209 -5.599 1.00 0.00 H new ATOM 0 HB VAL A 428 -8.988 4.898 -2.694 1.00 0.00 H new ATOM 0 HG11 VAL A 428 -9.902 7.163 -2.280 1.00 0.00 H new ATOM 0 HG12 VAL A 428 -8.461 7.186 -3.324 1.00 0.00 H new ATOM 0 HG13 VAL A 428 -10.079 7.395 -4.035 1.00 0.00 H new ATOM 0 HG21 VAL A 428 -11.456 5.320 -2.310 1.00 0.00 H new ATOM 0 HG22 VAL A 428 -11.689 5.397 -4.072 1.00 0.00 H new ATOM 0 HG23 VAL A 428 -11.176 3.874 -3.309 1.00 0.00 H new ATOM 756 N SER A 429 -6.641 4.791 -4.569 1.00 0.00 N ATOM 757 CA SER A 429 -5.240 5.121 -4.850 1.00 0.00 C ATOM 758 C SER A 429 -4.296 3.972 -4.457 1.00 0.00 C ATOM 759 O SER A 429 -4.642 3.136 -3.618 1.00 0.00 O ATOM 760 CB SER A 429 -4.808 6.428 -4.161 1.00 0.00 C ATOM 761 OG SER A 429 -4.758 6.287 -2.752 1.00 0.00 O ATOM 0 H SER A 429 -6.745 4.005 -3.927 1.00 0.00 H new ATOM 0 HA SER A 429 -5.167 5.269 -5.927 1.00 0.00 H new ATOM 0 HB2 SER A 429 -3.828 6.728 -4.532 1.00 0.00 H new ATOM 0 HB3 SER A 429 -5.505 7.224 -4.422 1.00 0.00 H new ATOM 0 HG SER A 429 -5.416 6.885 -2.340 1.00 0.00 H new ATOM 767 N ALA A 430 -3.095 3.941 -5.040 1.00 0.00 N ATOM 768 CA ALA A 430 -2.052 2.960 -4.750 1.00 0.00 C ATOM 769 C ALA A 430 -0.667 3.611 -4.856 1.00 0.00 C ATOM 770 O ALA A 430 -0.427 4.462 -5.718 1.00 0.00 O ATOM 771 CB ALA A 430 -2.194 1.770 -5.707 1.00 0.00 C ATOM 0 H ALA A 430 -2.815 4.620 -5.748 1.00 0.00 H new ATOM 0 HA ALA A 430 -2.162 2.594 -3.729 1.00 0.00 H new ATOM 0 HB1 ALA A 430 -1.417 1.036 -5.493 1.00 0.00 H new ATOM 0 HB2 ALA A 430 -3.173 1.311 -5.574 1.00 0.00 H new ATOM 0 HB3 ALA A 430 -2.093 2.116 -6.736 1.00 0.00 H new ATOM 777 N LYS A 431 0.243 3.209 -3.970 1.00 0.00 N ATOM 778 CA LYS A 431 1.546 3.853 -3.794 1.00 0.00 C ATOM 779 C LYS A 431 2.604 2.863 -3.285 1.00 0.00 C ATOM 780 O LYS A 431 2.410 2.243 -2.247 1.00 0.00 O ATOM 781 CB LYS A 431 1.376 5.013 -2.789 1.00 0.00 C ATOM 782 CG LYS A 431 2.630 5.890 -2.635 1.00 0.00 C ATOM 783 CD LYS A 431 2.703 6.986 -3.707 1.00 0.00 C ATOM 784 CE LYS A 431 4.117 7.577 -3.781 1.00 0.00 C ATOM 785 NZ LYS A 431 4.966 6.873 -4.776 1.00 0.00 N ATOM 0 H LYS A 431 0.095 2.416 -3.345 1.00 0.00 H new ATOM 0 HA LYS A 431 1.894 4.226 -4.758 1.00 0.00 H new ATOM 0 HB2 LYS A 431 0.543 5.639 -3.109 1.00 0.00 H new ATOM 0 HB3 LYS A 431 1.110 4.602 -1.815 1.00 0.00 H new ATOM 0 HG2 LYS A 431 2.631 6.350 -1.647 1.00 0.00 H new ATOM 0 HG3 LYS A 431 3.520 5.263 -2.696 1.00 0.00 H new ATOM 0 HD2 LYS A 431 2.425 6.573 -4.677 1.00 0.00 H new ATOM 0 HD3 LYS A 431 1.985 7.774 -3.478 1.00 0.00 H new ATOM 0 HE2 LYS A 431 4.055 8.634 -4.041 1.00 0.00 H new ATOM 0 HE3 LYS A 431 4.586 7.518 -2.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 5.834 7.422 -4.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 5.216 5.931 -4.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 4.443 6.773 -5.670 1.00 0.00 H new ATOM 799 N VAL A 432 3.735 2.739 -3.970 1.00 0.00 N ATOM 800 CA VAL A 432 4.942 2.068 -3.470 1.00 0.00 C ATOM 801 C VAL A 432 5.868 3.191 -3.007 1.00 0.00 C ATOM 802 O VAL A 432 5.995 4.203 -3.701 1.00 0.00 O ATOM 803 CB VAL A 432 5.633 1.201 -4.544 1.00 0.00 C ATOM 804 CG1 VAL A 432 6.844 0.477 -3.932 1.00 0.00 C ATOM 805 CG2 VAL A 432 4.675 0.146 -5.116 1.00 0.00 C ATOM 0 H VAL A 432 3.847 3.110 -4.914 1.00 0.00 H new ATOM 0 HA VAL A 432 4.688 1.377 -2.666 1.00 0.00 H new ATOM 0 HB VAL A 432 5.950 1.865 -5.348 1.00 0.00 H new ATOM 0 HG11 VAL A 432 7.327 -0.133 -4.695 1.00 0.00 H new ATOM 0 HG12 VAL A 432 7.554 1.212 -3.552 1.00 0.00 H new ATOM 0 HG13 VAL A 432 6.511 -0.162 -3.114 1.00 0.00 H new ATOM 0 HG21 VAL A 432 5.194 -0.447 -5.869 1.00 0.00 H new ATOM 0 HG22 VAL A 432 4.332 -0.507 -4.314 1.00 0.00 H new ATOM 0 HG23 VAL A 432 3.818 0.642 -5.572 1.00 0.00 H new ATOM 815 N PHE A 433 6.475 3.055 -1.826 1.00 0.00 N ATOM 816 CA PHE A 433 7.333 4.098 -1.280 1.00 0.00 C ATOM 817 C PHE A 433 8.697 4.081 -1.987 1.00 0.00 C ATOM 818 O PHE A 433 9.506 3.172 -1.792 1.00 0.00 O ATOM 819 CB PHE A 433 7.424 3.971 0.244 1.00 0.00 C ATOM 820 CG PHE A 433 7.925 5.239 0.914 1.00 0.00 C ATOM 821 CD1 PHE A 433 9.302 5.515 0.951 1.00 0.00 C ATOM 822 CD2 PHE A 433 7.015 6.155 1.480 1.00 0.00 C ATOM 823 CE1 PHE A 433 9.775 6.678 1.585 1.00 0.00 C ATOM 824 CE2 PHE A 433 7.488 7.323 2.109 1.00 0.00 C ATOM 825 CZ PHE A 433 8.868 7.574 2.178 1.00 0.00 C ATOM 0 H PHE A 433 6.385 2.230 -1.232 1.00 0.00 H new ATOM 0 HA PHE A 433 6.899 5.079 -1.474 1.00 0.00 H new ATOM 0 HB2 PHE A 433 6.441 3.720 0.642 1.00 0.00 H new ATOM 0 HB3 PHE A 433 8.090 3.146 0.496 1.00 0.00 H new ATOM 0 HD1 PHE A 433 10.000 4.831 0.491 1.00 0.00 H new ATOM 0 HD2 PHE A 433 5.954 5.961 1.431 1.00 0.00 H new ATOM 0 HE1 PHE A 433 10.835 6.883 1.616 1.00 0.00 H new ATOM 0 HE2 PHE A 433 6.789 8.026 2.538 1.00 0.00 H new ATOM 0 HZ PHE A 433 9.232 8.455 2.686 1.00 0.00 H new ATOM 835 N ILE A 434 8.942 5.081 -2.836 1.00 0.00 N ATOM 836 CA ILE A 434 10.174 5.222 -3.628 1.00 0.00 C ATOM 837 C ILE A 434 11.109 6.213 -2.935 1.00 0.00 C ATOM 838 O ILE A 434 10.710 7.335 -2.622 1.00 0.00 O ATOM 839 CB ILE A 434 9.866 5.669 -5.077 1.00 0.00 C ATOM 840 CG1 ILE A 434 8.745 4.865 -5.775 1.00 0.00 C ATOM 841 CG2 ILE A 434 11.149 5.618 -5.928 1.00 0.00 C ATOM 842 CD1 ILE A 434 8.924 3.341 -5.786 1.00 0.00 C ATOM 0 H ILE A 434 8.275 5.836 -2.999 1.00 0.00 H new ATOM 0 HA ILE A 434 10.664 4.251 -3.692 1.00 0.00 H new ATOM 0 HB ILE A 434 9.494 6.690 -4.995 1.00 0.00 H new ATOM 0 HG12 ILE A 434 7.799 5.097 -5.286 1.00 0.00 H new ATOM 0 HG13 ILE A 434 8.664 5.210 -6.806 1.00 0.00 H new ATOM 0 HG21 ILE A 434 10.923 5.934 -6.946 1.00 0.00 H new ATOM 0 HG22 ILE A 434 11.897 6.284 -5.499 1.00 0.00 H new ATOM 0 HG23 ILE A 434 11.536 4.599 -5.942 1.00 0.00 H new ATOM 0 HD11 ILE A 434 8.081 2.879 -6.300 1.00 0.00 H new ATOM 0 HD12 ILE A 434 9.849 3.087 -6.304 1.00 0.00 H new ATOM 0 HD13 ILE A 434 8.970 2.973 -4.761 1.00 0.00 H new ATOM 952 N SER A 441 12.622 1.357 -4.798 1.00 0.00 N ATOM 953 CA SER A 441 11.545 1.088 -3.840 1.00 0.00 C ATOM 954 C SER A 441 12.153 0.643 -2.501 1.00 0.00 C ATOM 955 O SER A 441 13.062 -0.192 -2.454 1.00 0.00 O ATOM 956 CB SER A 441 10.585 0.023 -4.386 1.00 0.00 C ATOM 957 OG SER A 441 9.822 -0.583 -3.351 1.00 0.00 O ATOM 0 HA SER A 441 10.970 2.000 -3.683 1.00 0.00 H new ATOM 0 HB2 SER A 441 9.913 0.479 -5.113 1.00 0.00 H new ATOM 0 HB3 SER A 441 11.154 -0.743 -4.913 1.00 0.00 H new ATOM 0 HG SER A 441 9.793 -1.553 -3.491 1.00 0.00 H new ATOM 963 N LYS A 442 11.626 1.171 -1.393 1.00 0.00 N ATOM 964 CA LYS A 442 12.017 0.789 -0.030 1.00 0.00 C ATOM 965 C LYS A 442 11.319 -0.505 0.454 1.00 0.00 C ATOM 966 O LYS A 442 11.343 -0.816 1.645 1.00 0.00 O ATOM 967 CB LYS A 442 11.816 1.993 0.911 1.00 0.00 C ATOM 968 CG LYS A 442 12.606 3.228 0.433 1.00 0.00 C ATOM 969 CD LYS A 442 12.734 4.331 1.496 1.00 0.00 C ATOM 970 CE LYS A 442 13.712 3.969 2.614 1.00 0.00 C ATOM 971 NZ LYS A 442 15.125 4.135 2.171 1.00 0.00 N ATOM 0 H LYS A 442 10.902 1.889 -1.417 1.00 0.00 H new ATOM 0 HA LYS A 442 13.076 0.532 -0.024 1.00 0.00 H new ATOM 0 HB2 LYS A 442 10.755 2.238 0.967 1.00 0.00 H new ATOM 0 HB3 LYS A 442 12.134 1.725 1.918 1.00 0.00 H new ATOM 0 HG2 LYS A 442 13.604 2.914 0.127 1.00 0.00 H new ATOM 0 HG3 LYS A 442 12.117 3.641 -0.449 1.00 0.00 H new ATOM 0 HD2 LYS A 442 13.063 5.254 1.017 1.00 0.00 H new ATOM 0 HD3 LYS A 442 11.753 4.528 1.928 1.00 0.00 H new ATOM 0 HE2 LYS A 442 13.524 4.600 3.483 1.00 0.00 H new ATOM 0 HE3 LYS A 442 13.545 2.938 2.927 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 15.765 3.882 2.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 15.309 3.514 1.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 15.289 5.125 1.896 1.00 0.00 H new ATOM 985 N CYS A 443 10.677 -1.244 -0.464 1.00 0.00 N ATOM 986 CA CYS A 443 10.046 -2.559 -0.271 1.00 0.00 C ATOM 987 C CYS A 443 8.730 -2.516 0.534 1.00 0.00 C ATOM 988 O CYS A 443 8.227 -3.571 0.929 1.00 0.00 O ATOM 989 CB CYS A 443 11.067 -3.577 0.279 1.00 0.00 C ATOM 990 SG CYS A 443 12.451 -3.753 -0.888 1.00 0.00 S ATOM 0 H CYS A 443 10.578 -0.917 -1.425 1.00 0.00 H new ATOM 0 HA CYS A 443 9.732 -2.905 -1.256 1.00 0.00 H new ATOM 0 HB2 CYS A 443 11.437 -3.246 1.249 1.00 0.00 H new ATOM 0 HB3 CYS A 443 10.585 -4.542 0.434 1.00 0.00 H new ATOM 0 HG CYS A 443 12.089 -4.512 -1.880 1.00 0.00 H new ATOM 996 N PHE A 444 8.147 -1.329 0.734 1.00 0.00 N ATOM 997 CA PHE A 444 6.851 -1.132 1.388 1.00 0.00 C ATOM 998 C PHE A 444 5.940 -0.203 0.574 1.00 0.00 C ATOM 999 O PHE A 444 6.416 0.669 -0.157 1.00 0.00 O ATOM 1000 CB PHE A 444 7.040 -0.681 2.843 1.00 0.00 C ATOM 1001 CG PHE A 444 7.514 0.741 3.084 1.00 0.00 C ATOM 1002 CD1 PHE A 444 6.583 1.794 3.175 1.00 0.00 C ATOM 1003 CD2 PHE A 444 8.881 1.002 3.301 1.00 0.00 C ATOM 1004 CE1 PHE A 444 7.019 3.098 3.475 1.00 0.00 C ATOM 1005 CE2 PHE A 444 9.316 2.306 3.595 1.00 0.00 C ATOM 1006 CZ PHE A 444 8.385 3.355 3.684 1.00 0.00 C ATOM 0 H PHE A 444 8.578 -0.454 0.436 1.00 0.00 H new ATOM 0 HA PHE A 444 6.332 -2.090 1.424 1.00 0.00 H new ATOM 0 HB2 PHE A 444 6.089 -0.810 3.361 1.00 0.00 H new ATOM 0 HB3 PHE A 444 7.754 -1.357 3.314 1.00 0.00 H new ATOM 0 HD1 PHE A 444 5.533 1.600 3.014 1.00 0.00 H new ATOM 0 HD2 PHE A 444 9.598 0.197 3.241 1.00 0.00 H new ATOM 0 HE1 PHE A 444 6.302 3.903 3.545 1.00 0.00 H new ATOM 0 HE2 PHE A 444 10.366 2.502 3.753 1.00 0.00 H new ATOM 0 HZ PHE A 444 8.718 4.357 3.913 1.00 0.00 H new ATOM 1016 N GLY A 445 4.629 -0.428 0.671 1.00 0.00 N ATOM 1017 CA GLY A 445 3.598 0.249 -0.116 1.00 0.00 C ATOM 1018 C GLY A 445 2.231 0.299 0.563 1.00 0.00 C ATOM 1019 O GLY A 445 2.055 -0.172 1.688 1.00 0.00 O ATOM 0 H GLY A 445 4.243 -1.111 1.323 1.00 0.00 H new ATOM 0 HA2 GLY A 445 3.926 1.267 -0.326 1.00 0.00 H new ATOM 0 HA3 GLY A 445 3.497 -0.257 -1.076 1.00 0.00 H new ATOM 1023 N PHE A 446 1.258 0.867 -0.149 1.00 0.00 N ATOM 1024 CA PHE A 446 -0.060 1.246 0.347 1.00 0.00 C ATOM 1025 C PHE A 446 -1.128 1.139 -0.741 1.00 0.00 C ATOM 1026 O PHE A 446 -0.853 1.397 -1.913 1.00 0.00 O ATOM 1027 CB PHE A 446 -0.022 2.701 0.844 1.00 0.00 C ATOM 1028 CG PHE A 446 1.105 3.000 1.803 1.00 0.00 C ATOM 1029 CD1 PHE A 446 0.966 2.661 3.158 1.00 0.00 C ATOM 1030 CD2 PHE A 446 2.314 3.543 1.329 1.00 0.00 C ATOM 1031 CE1 PHE A 446 2.031 2.879 4.043 1.00 0.00 C ATOM 1032 CE2 PHE A 446 3.392 3.727 2.210 1.00 0.00 C ATOM 1033 CZ PHE A 446 3.248 3.395 3.567 1.00 0.00 C ATOM 0 H PHE A 446 1.376 1.085 -1.138 1.00 0.00 H new ATOM 0 HA PHE A 446 -0.315 0.562 1.156 1.00 0.00 H new ATOM 0 HB2 PHE A 446 0.063 3.365 -0.017 1.00 0.00 H new ATOM 0 HB3 PHE A 446 -0.969 2.931 1.332 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.042 2.234 3.518 1.00 0.00 H new ATOM 0 HD2 PHE A 446 2.412 3.818 0.289 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.916 2.650 5.092 1.00 0.00 H new ATOM 0 HE2 PHE A 446 4.328 4.122 1.845 1.00 0.00 H new ATOM 0 HZ PHE A 446 4.075 3.537 4.247 1.00 0.00 H new ATOM 1043 N VAL A 447 -2.358 0.822 -0.339 1.00 0.00 N ATOM 1044 CA VAL A 447 -3.531 0.746 -1.229 1.00 0.00 C ATOM 1045 C VAL A 447 -4.763 1.246 -0.473 1.00 0.00 C ATOM 1046 O VAL A 447 -5.003 0.853 0.666 1.00 0.00 O ATOM 1047 CB VAL A 447 -3.760 -0.686 -1.781 1.00 0.00 C ATOM 1048 CG1 VAL A 447 -5.020 -0.776 -2.660 1.00 0.00 C ATOM 1049 CG2 VAL A 447 -2.575 -1.176 -2.631 1.00 0.00 C ATOM 0 H VAL A 447 -2.579 0.605 0.633 1.00 0.00 H new ATOM 0 HA VAL A 447 -3.347 1.381 -2.095 1.00 0.00 H new ATOM 0 HB VAL A 447 -3.874 -1.314 -0.897 1.00 0.00 H new ATOM 0 HG11 VAL A 447 -5.138 -1.797 -3.023 1.00 0.00 H new ATOM 0 HG12 VAL A 447 -5.894 -0.496 -2.072 1.00 0.00 H new ATOM 0 HG13 VAL A 447 -4.921 -0.099 -3.508 1.00 0.00 H new ATOM 0 HG21 VAL A 447 -2.780 -2.182 -2.996 1.00 0.00 H new ATOM 0 HG22 VAL A 447 -2.433 -0.505 -3.478 1.00 0.00 H new ATOM 0 HG23 VAL A 447 -1.671 -1.188 -2.022 1.00 0.00 H new ATOM 1059 N SER A 448 -5.536 2.117 -1.113 1.00 0.00 N ATOM 1060 CA SER A 448 -6.787 2.679 -0.592 1.00 0.00 C ATOM 1061 C SER A 448 -7.988 2.145 -1.377 1.00 0.00 C ATOM 1062 O SER A 448 -8.042 2.299 -2.597 1.00 0.00 O ATOM 1063 CB SER A 448 -6.782 4.205 -0.745 1.00 0.00 C ATOM 1064 OG SER A 448 -5.723 4.822 -0.040 1.00 0.00 O ATOM 0 H SER A 448 -5.304 2.467 -2.043 1.00 0.00 H new ATOM 0 HA SER A 448 -6.865 2.394 0.457 1.00 0.00 H new ATOM 0 HB2 SER A 448 -6.706 4.460 -1.802 1.00 0.00 H new ATOM 0 HB3 SER A 448 -7.731 4.605 -0.389 1.00 0.00 H new ATOM 0 HG SER A 448 -5.302 5.500 -0.609 1.00 0.00 H new ATOM 1070 N TYR A 449 -8.989 1.587 -0.698 1.00 0.00 N ATOM 1071 CA TYR A 449 -10.287 1.226 -1.283 1.00 0.00 C ATOM 1072 C TYR A 449 -11.391 2.213 -0.870 1.00 0.00 C ATOM 1073 O TYR A 449 -11.243 2.963 0.095 1.00 0.00 O ATOM 1074 CB TYR A 449 -10.649 -0.208 -0.877 1.00 0.00 C ATOM 1075 CG TYR A 449 -9.768 -1.257 -1.522 1.00 0.00 C ATOM 1076 CD1 TYR A 449 -10.107 -1.779 -2.786 1.00 0.00 C ATOM 1077 CD2 TYR A 449 -8.602 -1.696 -0.870 1.00 0.00 C ATOM 1078 CE1 TYR A 449 -9.286 -2.745 -3.399 1.00 0.00 C ATOM 1079 CE2 TYR A 449 -7.784 -2.666 -1.474 1.00 0.00 C ATOM 1080 CZ TYR A 449 -8.121 -3.190 -2.739 1.00 0.00 C ATOM 1081 OH TYR A 449 -7.297 -4.100 -3.318 1.00 0.00 O ATOM 0 H TYR A 449 -8.923 1.367 0.296 1.00 0.00 H new ATOM 0 HA TYR A 449 -10.205 1.281 -2.369 1.00 0.00 H new ATOM 0 HB2 TYR A 449 -10.577 -0.300 0.207 1.00 0.00 H new ATOM 0 HB3 TYR A 449 -11.688 -0.402 -1.145 1.00 0.00 H new ATOM 0 HD1 TYR A 449 -11.000 -1.437 -3.287 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -8.335 -1.288 0.094 1.00 0.00 H new ATOM 0 HE1 TYR A 449 -9.547 -3.143 -4.369 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -6.895 -3.011 -0.968 1.00 0.00 H new ATOM 0 HH TYR A 449 -7.489 -4.152 -4.278 1.00 0.00 H new ATOM 1091 N ASP A 450 -12.517 2.203 -1.587 1.00 0.00 N ATOM 1092 CA ASP A 450 -13.694 3.024 -1.261 1.00 0.00 C ATOM 1093 C ASP A 450 -14.587 2.422 -0.153 1.00 0.00 C ATOM 1094 O ASP A 450 -15.466 3.110 0.368 1.00 0.00 O ATOM 1095 CB ASP A 450 -14.486 3.338 -2.546 1.00 0.00 C ATOM 1096 CG ASP A 450 -15.169 2.146 -3.243 1.00 0.00 C ATOM 1097 OD1 ASP A 450 -15.027 0.981 -2.802 1.00 0.00 O ATOM 1098 OD2 ASP A 450 -15.855 2.396 -4.261 1.00 0.00 O ATOM 0 H ASP A 450 -12.642 1.622 -2.416 1.00 0.00 H new ATOM 0 HA ASP A 450 -13.327 3.959 -0.836 1.00 0.00 H new ATOM 0 HB2 ASP A 450 -15.251 4.075 -2.303 1.00 0.00 H new ATOM 0 HB3 ASP A 450 -13.807 3.806 -3.259 1.00 0.00 H new ATOM 1103 N ASN A 451 -14.336 1.166 0.238 1.00 0.00 N ATOM 1104 CA ASN A 451 -15.063 0.409 1.261 1.00 0.00 C ATOM 1105 C ASN A 451 -14.129 -0.621 1.946 1.00 0.00 C ATOM 1106 O ASN A 451 -13.134 -1.043 1.345 1.00 0.00 O ATOM 1107 CB ASN A 451 -16.263 -0.316 0.626 1.00 0.00 C ATOM 1108 CG ASN A 451 -17.374 0.608 0.135 1.00 0.00 C ATOM 1109 OD1 ASN A 451 -18.247 1.009 0.896 1.00 0.00 O ATOM 1110 ND2 ASN A 451 -17.401 0.941 -1.142 1.00 0.00 N ATOM 0 H ASN A 451 -13.578 0.622 -0.175 1.00 0.00 H new ATOM 0 HA ASN A 451 -15.423 1.108 2.016 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -15.907 -0.914 -0.213 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -16.681 -1.009 1.356 1.00 0.00 H new ATOM 0 HD21 ASN A 451 -18.150 1.534 -1.499 1.00 0.00 H new ATOM 0 HD22 ASN A 451 -16.673 0.605 -1.772 1.00 0.00 H new ATOM 1117 N PRO A 452 -14.438 -1.058 3.186 1.00 0.00 N ATOM 1118 CA PRO A 452 -13.522 -1.845 4.005 1.00 0.00 C ATOM 1119 C PRO A 452 -13.533 -3.343 3.670 1.00 0.00 C ATOM 1120 O PRO A 452 -12.507 -3.997 3.832 1.00 0.00 O ATOM 1121 CB PRO A 452 -13.935 -1.556 5.448 1.00 0.00 C ATOM 1122 CG PRO A 452 -15.433 -1.272 5.356 1.00 0.00 C ATOM 1123 CD PRO A 452 -15.625 -0.695 3.951 1.00 0.00 C ATOM 0 HA PRO A 452 -12.486 -1.562 3.817 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -13.729 -2.405 6.099 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -13.392 -0.703 5.855 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -16.019 -2.180 5.496 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -15.751 -0.566 6.123 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -16.524 -1.099 3.486 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -15.745 0.388 3.990 1.00 0.00 H new ATOM 1131 N VAL A 453 -14.642 -3.887 3.146 1.00 0.00 N ATOM 1132 CA VAL A 453 -14.731 -5.297 2.711 1.00 0.00 C ATOM 1133 C VAL A 453 -13.740 -5.585 1.570 1.00 0.00 C ATOM 1134 O VAL A 453 -13.135 -6.653 1.539 1.00 0.00 O ATOM 1135 CB VAL A 453 -16.173 -5.678 2.289 1.00 0.00 C ATOM 1136 CG1 VAL A 453 -16.289 -7.137 1.812 1.00 0.00 C ATOM 1137 CG2 VAL A 453 -17.159 -5.472 3.455 1.00 0.00 C ATOM 0 H VAL A 453 -15.507 -3.363 3.010 1.00 0.00 H new ATOM 0 HA VAL A 453 -14.462 -5.916 3.567 1.00 0.00 H new ATOM 0 HB VAL A 453 -16.422 -5.020 1.456 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -17.321 -7.347 1.530 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -15.639 -7.291 0.951 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -15.990 -7.808 2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -18.164 -5.746 3.134 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -16.863 -6.098 4.297 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -17.148 -4.426 3.760 1.00 0.00 H new ATOM 1147 N SER A 454 -13.508 -4.618 0.677 1.00 0.00 N ATOM 1148 CA SER A 454 -12.540 -4.725 -0.425 1.00 0.00 C ATOM 1149 C SER A 454 -11.090 -4.810 0.083 1.00 0.00 C ATOM 1150 O SER A 454 -10.301 -5.630 -0.390 1.00 0.00 O ATOM 1151 CB SER A 454 -12.691 -3.506 -1.347 1.00 0.00 C ATOM 1152 OG SER A 454 -14.048 -3.306 -1.734 1.00 0.00 O ATOM 0 H SER A 454 -13.995 -3.722 0.698 1.00 0.00 H new ATOM 0 HA SER A 454 -12.751 -5.646 -0.969 1.00 0.00 H new ATOM 0 HB2 SER A 454 -12.322 -2.616 -0.837 1.00 0.00 H new ATOM 0 HB3 SER A 454 -12.075 -3.643 -2.236 1.00 0.00 H new ATOM 0 HG SER A 454 -14.109 -2.522 -2.319 1.00 0.00 H new ATOM 1158 N ALA A 455 -10.751 -4.014 1.105 1.00 0.00 N ATOM 1159 CA ALA A 455 -9.441 -4.032 1.752 1.00 0.00 C ATOM 1160 C ALA A 455 -9.211 -5.326 2.552 1.00 0.00 C ATOM 1161 O ALA A 455 -8.161 -5.951 2.420 1.00 0.00 O ATOM 1162 CB ALA A 455 -9.341 -2.780 2.628 1.00 0.00 C ATOM 0 H ALA A 455 -11.392 -3.331 1.509 1.00 0.00 H new ATOM 0 HA ALA A 455 -8.652 -4.019 1.000 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -8.372 -2.762 3.127 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -9.445 -1.891 2.006 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -10.134 -2.795 3.375 1.00 0.00 H new ATOM 1168 N GLN A 456 -10.204 -5.774 3.325 1.00 0.00 N ATOM 1169 CA GLN A 456 -10.179 -7.065 4.020 1.00 0.00 C ATOM 1170 C GLN A 456 -9.977 -8.240 3.051 1.00 0.00 C ATOM 1171 O GLN A 456 -9.109 -9.082 3.277 1.00 0.00 O ATOM 1172 CB GLN A 456 -11.490 -7.235 4.804 1.00 0.00 C ATOM 1173 CG GLN A 456 -11.560 -6.381 6.085 1.00 0.00 C ATOM 1174 CD GLN A 456 -10.524 -6.749 7.153 1.00 0.00 C ATOM 1175 OE1 GLN A 456 -9.948 -7.831 7.179 1.00 0.00 O ATOM 1176 NE2 GLN A 456 -10.231 -5.856 8.076 1.00 0.00 N ATOM 0 H GLN A 456 -11.060 -5.243 3.488 1.00 0.00 H new ATOM 0 HA GLN A 456 -9.330 -7.071 4.704 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -12.327 -6.973 4.157 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -11.610 -8.285 5.071 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -11.428 -5.333 5.815 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -12.557 -6.476 6.516 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.697 -4.949 8.074 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.538 -6.072 8.792 1.00 0.00 H new ATOM 1185 N ALA A 457 -10.721 -8.270 1.941 1.00 0.00 N ATOM 1186 CA ALA A 457 -10.556 -9.268 0.881 1.00 0.00 C ATOM 1187 C ALA A 457 -9.147 -9.251 0.260 1.00 0.00 C ATOM 1188 O ALA A 457 -8.608 -10.313 -0.057 1.00 0.00 O ATOM 1189 CB ALA A 457 -11.643 -9.048 -0.179 1.00 0.00 C ATOM 0 H ALA A 457 -11.462 -7.595 1.752 1.00 0.00 H new ATOM 0 HA ALA A 457 -10.667 -10.259 1.321 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -11.531 -9.785 -0.974 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -12.626 -9.156 0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -11.546 -8.046 -0.597 1.00 0.00 H new ATOM 1195 N ALA A 458 -8.512 -8.079 0.145 1.00 0.00 N ATOM 1196 CA ALA A 458 -7.133 -7.964 -0.317 1.00 0.00 C ATOM 1197 C ALA A 458 -6.120 -8.469 0.725 1.00 0.00 C ATOM 1198 O ALA A 458 -5.179 -9.158 0.344 1.00 0.00 O ATOM 1199 CB ALA A 458 -6.870 -6.514 -0.726 1.00 0.00 C ATOM 0 H ALA A 458 -8.945 -7.184 0.372 1.00 0.00 H new ATOM 0 HA ALA A 458 -6.996 -8.610 -1.184 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -5.842 -6.415 -1.074 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -7.553 -6.233 -1.528 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -7.028 -5.860 0.131 1.00 0.00 H new ATOM 1205 N ILE A 459 -6.327 -8.239 2.030 1.00 0.00 N ATOM 1206 CA ILE A 459 -5.499 -8.840 3.101 1.00 0.00 C ATOM 1207 C ILE A 459 -5.578 -10.368 3.024 1.00 0.00 C ATOM 1208 O ILE A 459 -4.551 -11.047 3.021 1.00 0.00 O ATOM 1209 CB ILE A 459 -5.928 -8.334 4.505 1.00 0.00 C ATOM 1210 CG1 ILE A 459 -5.692 -6.815 4.635 1.00 0.00 C ATOM 1211 CG2 ILE A 459 -5.168 -9.086 5.617 1.00 0.00 C ATOM 1212 CD1 ILE A 459 -6.319 -6.183 5.886 1.00 0.00 C ATOM 0 H ILE A 459 -7.070 -7.633 2.378 1.00 0.00 H new ATOM 0 HA ILE A 459 -4.465 -8.530 2.949 1.00 0.00 H new ATOM 0 HB ILE A 459 -6.994 -8.532 4.619 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -4.619 -6.625 4.646 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.094 -6.320 3.751 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -5.486 -8.714 6.591 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -5.384 -10.152 5.548 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -4.097 -8.924 5.499 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.106 -5.114 5.900 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.398 -6.338 5.870 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -5.899 -6.648 6.778 1.00 0.00 H new ATOM 1224 N GLN A 460 -6.797 -10.895 2.908 1.00 0.00 N ATOM 1225 CA GLN A 460 -7.080 -12.327 2.826 1.00 0.00 C ATOM 1226 C GLN A 460 -6.509 -12.987 1.557 1.00 0.00 C ATOM 1227 O GLN A 460 -6.248 -14.189 1.563 1.00 0.00 O ATOM 1228 CB GLN A 460 -8.605 -12.517 2.898 1.00 0.00 C ATOM 1229 CG GLN A 460 -9.195 -12.281 4.299 1.00 0.00 C ATOM 1230 CD GLN A 460 -8.815 -13.381 5.294 1.00 0.00 C ATOM 1231 OE1 GLN A 460 -7.777 -13.342 5.942 1.00 0.00 O ATOM 1232 NE2 GLN A 460 -9.627 -14.408 5.448 1.00 0.00 N ATOM 0 H GLN A 460 -7.639 -10.320 2.867 1.00 0.00 H new ATOM 0 HA GLN A 460 -6.585 -12.822 3.662 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.080 -11.834 2.194 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -8.851 -13.529 2.576 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.848 -11.319 4.677 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.281 -12.222 4.226 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.496 -14.456 4.916 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -9.387 -15.155 6.100 1.00 0.00 H new ATOM 1241 N SER A 461 -6.274 -12.226 0.484 1.00 0.00 N ATOM 1242 CA SER A 461 -5.744 -12.736 -0.786 1.00 0.00 C ATOM 1243 C SER A 461 -4.235 -12.498 -0.984 1.00 0.00 C ATOM 1244 O SER A 461 -3.590 -13.274 -1.693 1.00 0.00 O ATOM 1245 CB SER A 461 -6.510 -12.078 -1.938 1.00 0.00 C ATOM 1246 OG SER A 461 -7.900 -12.372 -1.888 1.00 0.00 O ATOM 0 H SER A 461 -6.449 -11.221 0.472 1.00 0.00 H new ATOM 0 HA SER A 461 -5.881 -13.817 -0.768 1.00 0.00 H new ATOM 0 HB2 SER A 461 -6.366 -10.998 -1.900 1.00 0.00 H new ATOM 0 HB3 SER A 461 -6.101 -12.421 -2.888 1.00 0.00 H new ATOM 0 HG SER A 461 -8.345 -11.745 -1.280 1.00 0.00 H new ATOM 1252 N MET A 462 -3.659 -11.454 -0.365 1.00 0.00 N ATOM 1253 CA MET A 462 -2.288 -10.987 -0.632 1.00 0.00 C ATOM 1254 C MET A 462 -1.303 -11.199 0.520 1.00 0.00 C ATOM 1255 O MET A 462 -0.095 -11.190 0.280 1.00 0.00 O ATOM 1256 CB MET A 462 -2.295 -9.508 -1.057 1.00 0.00 C ATOM 1257 CG MET A 462 -3.081 -9.274 -2.355 1.00 0.00 C ATOM 1258 SD MET A 462 -2.490 -10.190 -3.807 1.00 0.00 S ATOM 1259 CE MET A 462 -0.864 -9.426 -3.996 1.00 0.00 C ATOM 0 H MET A 462 -4.140 -10.902 0.346 1.00 0.00 H new ATOM 0 HA MET A 462 -1.926 -11.613 -1.447 1.00 0.00 H new ATOM 0 HB2 MET A 462 -2.730 -8.906 -0.259 1.00 0.00 H new ATOM 0 HB3 MET A 462 -1.269 -9.167 -1.191 1.00 0.00 H new ATOM 0 HG2 MET A 462 -4.124 -9.540 -2.180 1.00 0.00 H new ATOM 0 HG3 MET A 462 -3.058 -8.209 -2.586 1.00 0.00 H new ATOM 0 HE1 MET A 462 -0.424 -9.736 -4.944 1.00 0.00 H new ATOM 0 HE2 MET A 462 -0.968 -8.341 -3.982 1.00 0.00 H new ATOM 0 HE3 MET A 462 -0.217 -9.739 -3.176 1.00 0.00 H new ATOM 1269 N ASN A 463 -1.765 -11.437 1.751 1.00 0.00 N ATOM 1270 CA ASN A 463 -0.867 -11.799 2.850 1.00 0.00 C ATOM 1271 C ASN A 463 -0.319 -13.228 2.638 1.00 0.00 C ATOM 1272 O ASN A 463 -1.063 -14.210 2.700 1.00 0.00 O ATOM 1273 CB ASN A 463 -1.585 -11.617 4.195 1.00 0.00 C ATOM 1274 CG ASN A 463 -0.594 -11.645 5.350 1.00 0.00 C ATOM 1275 OD1 ASN A 463 0.251 -10.764 5.473 1.00 0.00 O ATOM 1276 ND2 ASN A 463 -0.648 -12.644 6.210 1.00 0.00 N ATOM 0 H ASN A 463 -2.750 -11.386 2.010 1.00 0.00 H new ATOM 0 HA ASN A 463 -0.004 -11.134 2.864 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -2.126 -10.670 4.198 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -2.325 -12.407 4.326 1.00 0.00 H new ATOM 0 HD21 ASN A 463 0.015 -12.687 6.983 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -1.353 -13.373 6.101 1.00 0.00 H new ATOM 1283 N GLY A 464 0.981 -13.332 2.342 1.00 0.00 N ATOM 1284 CA GLY A 464 1.687 -14.554 1.929 1.00 0.00 C ATOM 1285 C GLY A 464 1.854 -14.712 0.410 1.00 0.00 C ATOM 1286 O GLY A 464 2.377 -15.739 -0.023 1.00 0.00 O ATOM 0 H GLY A 464 1.603 -12.525 2.386 1.00 0.00 H new ATOM 0 HA2 GLY A 464 2.673 -14.563 2.393 1.00 0.00 H new ATOM 0 HA3 GLY A 464 1.146 -15.418 2.314 1.00 0.00 H new ATOM 1290 N PHE A 465 1.454 -13.726 -0.405 1.00 0.00 N ATOM 1291 CA PHE A 465 1.651 -13.738 -1.863 1.00 0.00 C ATOM 1292 C PHE A 465 3.147 -13.709 -2.204 1.00 0.00 C ATOM 1293 O PHE A 465 3.854 -12.794 -1.780 1.00 0.00 O ATOM 1294 CB PHE A 465 0.924 -12.537 -2.483 1.00 0.00 C ATOM 1295 CG PHE A 465 1.000 -12.447 -3.998 1.00 0.00 C ATOM 1296 CD1 PHE A 465 2.064 -11.769 -4.629 1.00 0.00 C ATOM 1297 CD2 PHE A 465 -0.016 -13.025 -4.781 1.00 0.00 C ATOM 1298 CE1 PHE A 465 2.105 -11.672 -6.032 1.00 0.00 C ATOM 1299 CE2 PHE A 465 0.025 -12.926 -6.182 1.00 0.00 C ATOM 1300 CZ PHE A 465 1.086 -12.249 -6.809 1.00 0.00 C ATOM 0 H PHE A 465 0.979 -12.888 -0.068 1.00 0.00 H new ATOM 0 HA PHE A 465 1.234 -14.656 -2.277 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -0.125 -12.576 -2.189 1.00 0.00 H new ATOM 0 HB3 PHE A 465 1.339 -11.623 -2.059 1.00 0.00 H new ATOM 0 HD1 PHE A 465 2.848 -11.324 -4.034 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -0.831 -13.547 -4.303 1.00 0.00 H new ATOM 0 HE1 PHE A 465 2.921 -11.153 -6.513 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -0.759 -13.370 -6.778 1.00 0.00 H new ATOM 0 HZ PHE A 465 1.118 -12.173 -7.886 1.00 0.00 H new ATOM 1310 N GLN A 466 3.639 -14.699 -2.954 1.00 0.00 N ATOM 1311 CA GLN A 466 5.057 -14.801 -3.300 1.00 0.00 C ATOM 1312 C GLN A 466 5.370 -14.004 -4.574 1.00 0.00 C ATOM 1313 O GLN A 466 4.698 -14.151 -5.596 1.00 0.00 O ATOM 1314 CB GLN A 466 5.466 -16.280 -3.408 1.00 0.00 C ATOM 1315 CG GLN A 466 6.998 -16.437 -3.453 1.00 0.00 C ATOM 1316 CD GLN A 466 7.456 -17.889 -3.295 1.00 0.00 C ATOM 1317 OE1 GLN A 466 7.072 -18.591 -2.366 1.00 0.00 O ATOM 1318 NE2 GLN A 466 8.305 -18.390 -4.168 1.00 0.00 N ATOM 0 H GLN A 466 3.066 -15.450 -3.337 1.00 0.00 H new ATOM 0 HA GLN A 466 5.655 -14.355 -2.505 1.00 0.00 H new ATOM 0 HB2 GLN A 466 5.067 -16.833 -2.557 1.00 0.00 H new ATOM 0 HB3 GLN A 466 5.027 -16.716 -4.306 1.00 0.00 H new ATOM 0 HG2 GLN A 466 7.370 -16.046 -4.400 1.00 0.00 H new ATOM 0 HG3 GLN A 466 7.443 -15.833 -2.662 1.00 0.00 H new ATOM 0 HE21 GLN A 466 8.633 -17.818 -4.946 1.00 0.00 H new ATOM 0 HE22 GLN A 466 8.634 -19.350 -4.066 1.00 0.00 H new ATOM 1327 N ILE A 467 6.411 -13.167 -4.515 1.00 0.00 N ATOM 1328 CA ILE A 467 6.815 -12.247 -5.583 1.00 0.00 C ATOM 1329 C ILE A 467 8.350 -12.175 -5.667 1.00 0.00 C ATOM 1330 O ILE A 467 9.032 -11.934 -4.667 1.00 0.00 O ATOM 1331 CB ILE A 467 6.111 -10.881 -5.366 1.00 0.00 C ATOM 1332 CG1 ILE A 467 6.147 -10.054 -6.666 1.00 0.00 C ATOM 1333 CG2 ILE A 467 6.646 -10.093 -4.154 1.00 0.00 C ATOM 1334 CD1 ILE A 467 5.343 -8.751 -6.596 1.00 0.00 C ATOM 0 H ILE A 467 7.015 -13.110 -3.695 1.00 0.00 H new ATOM 0 HA ILE A 467 6.493 -12.607 -6.560 1.00 0.00 H new ATOM 0 HB ILE A 467 5.071 -11.093 -5.117 1.00 0.00 H new ATOM 0 HG12 ILE A 467 7.184 -9.817 -6.906 1.00 0.00 H new ATOM 0 HG13 ILE A 467 5.762 -10.664 -7.484 1.00 0.00 H new ATOM 0 HG21 ILE A 467 6.106 -9.150 -4.066 1.00 0.00 H new ATOM 0 HG22 ILE A 467 6.502 -10.679 -3.246 1.00 0.00 H new ATOM 0 HG23 ILE A 467 7.708 -9.892 -4.291 1.00 0.00 H new ATOM 0 HD11 ILE A 467 5.417 -8.226 -7.548 1.00 0.00 H new ATOM 0 HD12 ILE A 467 4.298 -8.979 -6.388 1.00 0.00 H new ATOM 0 HD13 ILE A 467 5.741 -8.120 -5.802 1.00 0.00 H new ATOM 1346 N GLY A 468 8.908 -12.468 -6.848 1.00 0.00 N ATOM 1347 CA GLY A 468 10.356 -12.551 -7.101 1.00 0.00 C ATOM 1348 C GLY A 468 11.004 -13.778 -6.450 1.00 0.00 C ATOM 1349 O GLY A 468 11.382 -14.730 -7.135 1.00 0.00 O ATOM 0 H GLY A 468 8.350 -12.660 -7.680 1.00 0.00 H new ATOM 0 HA2 GLY A 468 10.531 -12.581 -8.176 1.00 0.00 H new ATOM 0 HA3 GLY A 468 10.838 -11.649 -6.725 1.00 0.00 H new ATOM 1353 N MET A 469 11.122 -13.738 -5.120 1.00 0.00 N ATOM 1354 CA MET A 469 11.778 -14.730 -4.246 1.00 0.00 C ATOM 1355 C MET A 469 11.360 -14.631 -2.759 1.00 0.00 C ATOM 1356 O MET A 469 11.935 -15.306 -1.902 1.00 0.00 O ATOM 1357 CB MET A 469 13.300 -14.710 -4.448 1.00 0.00 C ATOM 1358 CG MET A 469 13.937 -13.322 -4.440 1.00 0.00 C ATOM 1359 SD MET A 469 13.798 -12.317 -2.935 1.00 0.00 S ATOM 1360 CE MET A 469 14.819 -13.294 -1.802 1.00 0.00 C ATOM 0 H MET A 469 10.737 -12.961 -4.583 1.00 0.00 H new ATOM 0 HA MET A 469 11.416 -15.710 -4.556 1.00 0.00 H new ATOM 0 HB2 MET A 469 13.763 -15.309 -3.664 1.00 0.00 H new ATOM 0 HB3 MET A 469 13.531 -15.193 -5.397 1.00 0.00 H new ATOM 0 HG2 MET A 469 14.997 -13.442 -4.662 1.00 0.00 H new ATOM 0 HG3 MET A 469 13.502 -12.752 -5.261 1.00 0.00 H new ATOM 0 HE1 MET A 469 14.884 -12.785 -0.840 1.00 0.00 H new ATOM 0 HE2 MET A 469 14.369 -14.277 -1.663 1.00 0.00 H new ATOM 0 HE3 MET A 469 15.819 -13.408 -2.220 1.00 0.00 H new ATOM 1370 N LYS A 470 10.344 -13.818 -2.441 1.00 0.00 N ATOM 1371 CA LYS A 470 9.917 -13.461 -1.075 1.00 0.00 C ATOM 1372 C LYS A 470 8.390 -13.276 -0.978 1.00 0.00 C ATOM 1373 O LYS A 470 7.723 -13.137 -2.005 1.00 0.00 O ATOM 1374 CB LYS A 470 10.715 -12.234 -0.602 1.00 0.00 C ATOM 1375 CG LYS A 470 10.598 -11.004 -1.517 1.00 0.00 C ATOM 1376 CD LYS A 470 11.489 -9.893 -0.961 1.00 0.00 C ATOM 1377 CE LYS A 470 11.436 -8.659 -1.871 1.00 0.00 C ATOM 1378 NZ LYS A 470 12.192 -7.512 -1.301 1.00 0.00 N ATOM 0 H LYS A 470 9.771 -13.370 -3.156 1.00 0.00 H new ATOM 0 HA LYS A 470 10.140 -14.285 -0.397 1.00 0.00 H new ATOM 0 HB2 LYS A 470 10.377 -11.960 0.398 1.00 0.00 H new ATOM 0 HB3 LYS A 470 11.766 -12.510 -0.519 1.00 0.00 H new ATOM 0 HG2 LYS A 470 10.901 -11.258 -2.533 1.00 0.00 H new ATOM 0 HG3 LYS A 470 9.562 -10.668 -1.568 1.00 0.00 H new ATOM 0 HD2 LYS A 470 11.163 -9.626 0.044 1.00 0.00 H new ATOM 0 HD3 LYS A 470 12.516 -10.249 -0.879 1.00 0.00 H new ATOM 0 HE2 LYS A 470 11.845 -8.912 -2.849 1.00 0.00 H new ATOM 0 HE3 LYS A 470 10.397 -8.367 -2.026 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 11.682 -6.627 -1.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 12.286 -7.635 -0.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 13.137 -7.470 -1.733 1.00 0.00 H new ATOM 1392 N ARG A 471 7.817 -13.313 0.233 1.00 0.00 N ATOM 1393 CA ARG A 471 6.356 -13.301 0.452 1.00 0.00 C ATOM 1394 C ARG A 471 5.878 -12.009 1.119 1.00 0.00 C ATOM 1395 O ARG A 471 6.452 -11.569 2.117 1.00 0.00 O ATOM 1396 CB ARG A 471 5.908 -14.540 1.247 1.00 0.00 C ATOM 1397 CG ARG A 471 6.141 -15.821 0.434 1.00 0.00 C ATOM 1398 CD ARG A 471 5.455 -17.050 1.036 1.00 0.00 C ATOM 1399 NE ARG A 471 5.734 -18.233 0.205 1.00 0.00 N ATOM 1400 CZ ARG A 471 5.269 -19.462 0.362 1.00 0.00 C ATOM 1401 NH1 ARG A 471 4.490 -19.803 1.368 1.00 0.00 N ATOM 1402 NH2 ARG A 471 5.601 -20.369 -0.529 1.00 0.00 N ATOM 0 H ARG A 471 8.355 -13.352 1.098 1.00 0.00 H new ATOM 0 HA ARG A 471 5.885 -13.339 -0.530 1.00 0.00 H new ATOM 0 HB2 ARG A 471 6.459 -14.594 2.186 1.00 0.00 H new ATOM 0 HB3 ARG A 471 4.852 -14.452 1.502 1.00 0.00 H new ATOM 0 HG2 ARG A 471 5.776 -15.670 -0.582 1.00 0.00 H new ATOM 0 HG3 ARG A 471 7.212 -16.009 0.363 1.00 0.00 H new ATOM 0 HD2 ARG A 471 5.812 -17.216 2.053 1.00 0.00 H new ATOM 0 HD3 ARG A 471 4.380 -16.884 1.099 1.00 0.00 H new ATOM 0 HE ARG A 471 6.361 -18.088 -0.587 1.00 0.00 H new ATOM 0 HH11 ARG A 471 4.223 -19.107 2.065 1.00 0.00 H new ATOM 0 HH12 ARG A 471 4.154 -20.763 1.450 1.00 0.00 H new ATOM 0 HH21 ARG A 471 6.201 -20.117 -1.314 1.00 0.00 H new ATOM 0 HH22 ARG A 471 5.258 -21.325 -0.435 1.00 0.00 H new ATOM 1416 N LEU A 472 4.824 -11.409 0.561 1.00 0.00 N ATOM 1417 CA LEU A 472 4.249 -10.139 1.008 1.00 0.00 C ATOM 1418 C LEU A 472 3.555 -10.257 2.367 1.00 0.00 C ATOM 1419 O LEU A 472 2.766 -11.168 2.605 1.00 0.00 O ATOM 1420 CB LEU A 472 3.269 -9.593 -0.052 1.00 0.00 C ATOM 1421 CG LEU A 472 3.907 -9.215 -1.403 1.00 0.00 C ATOM 1422 CD1 LEU A 472 2.834 -8.660 -2.350 1.00 0.00 C ATOM 1423 CD2 LEU A 472 5.019 -8.173 -1.237 1.00 0.00 C ATOM 0 H LEU A 472 4.332 -11.806 -0.239 1.00 0.00 H new ATOM 0 HA LEU A 472 5.074 -9.438 1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 472 2.497 -10.342 -0.230 1.00 0.00 H new ATOM 0 HB3 LEU A 472 2.771 -8.713 0.356 1.00 0.00 H new ATOM 0 HG LEU A 472 4.348 -10.120 -1.821 1.00 0.00 H new ATOM 0 HD11 LEU A 472 3.292 -8.395 -3.303 1.00 0.00 H new ATOM 0 HD12 LEU A 472 2.067 -9.417 -2.514 1.00 0.00 H new ATOM 0 HD13 LEU A 472 2.380 -7.774 -1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 472 5.442 -7.934 -2.213 1.00 0.00 H new ATOM 0 HD22 LEU A 472 4.607 -7.269 -0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 472 5.800 -8.574 -0.591 1.00 0.00 H new ATOM 1435 N LYS A 473 3.817 -9.287 3.238 1.00 0.00 N ATOM 1436 CA LYS A 473 3.107 -9.069 4.500 1.00 0.00 C ATOM 1437 C LYS A 473 2.093 -7.930 4.285 1.00 0.00 C ATOM 1438 O LYS A 473 2.475 -6.871 3.787 1.00 0.00 O ATOM 1439 CB LYS A 473 4.165 -8.762 5.574 1.00 0.00 C ATOM 1440 CG LYS A 473 3.555 -8.439 6.949 1.00 0.00 C ATOM 1441 CD LYS A 473 4.615 -8.330 8.056 1.00 0.00 C ATOM 1442 CE LYS A 473 5.616 -7.188 7.813 1.00 0.00 C ATOM 1443 NZ LYS A 473 6.602 -7.079 8.920 1.00 0.00 N ATOM 0 H LYS A 473 4.558 -8.604 3.081 1.00 0.00 H new ATOM 0 HA LYS A 473 2.541 -9.939 4.834 1.00 0.00 H new ATOM 0 HB2 LYS A 473 4.833 -9.618 5.672 1.00 0.00 H new ATOM 0 HB3 LYS A 473 4.773 -7.919 5.246 1.00 0.00 H new ATOM 0 HG2 LYS A 473 3.003 -7.501 6.886 1.00 0.00 H new ATOM 0 HG3 LYS A 473 2.836 -9.214 7.215 1.00 0.00 H new ATOM 0 HD2 LYS A 473 4.119 -8.174 9.014 1.00 0.00 H new ATOM 0 HD3 LYS A 473 5.157 -9.273 8.128 1.00 0.00 H new ATOM 0 HE2 LYS A 473 6.141 -7.358 6.873 1.00 0.00 H new ATOM 0 HE3 LYS A 473 5.077 -6.246 7.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 7.261 -6.299 8.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 6.102 -6.892 9.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 7.134 -7.969 9.000 1.00 0.00 H new ATOM 1457 N VAL A 474 0.813 -8.136 4.608 1.00 0.00 N ATOM 1458 CA VAL A 474 -0.282 -7.203 4.271 1.00 0.00 C ATOM 1459 C VAL A 474 -1.278 -7.094 5.427 1.00 0.00 C ATOM 1460 O VAL A 474 -1.641 -8.102 6.030 1.00 0.00 O ATOM 1461 CB VAL A 474 -1.013 -7.585 2.956 1.00 0.00 C ATOM 1462 CG1 VAL A 474 -1.982 -6.468 2.524 1.00 0.00 C ATOM 1463 CG2 VAL A 474 -0.042 -7.848 1.792 1.00 0.00 C ATOM 0 H VAL A 474 0.498 -8.962 5.116 1.00 0.00 H new ATOM 0 HA VAL A 474 0.178 -6.229 4.106 1.00 0.00 H new ATOM 0 HB VAL A 474 -1.556 -8.504 3.174 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -2.483 -6.758 1.600 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -2.725 -6.309 3.305 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -1.424 -5.546 2.360 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -0.608 -8.111 0.898 1.00 0.00 H new ATOM 0 HG22 VAL A 474 0.546 -6.951 1.598 1.00 0.00 H new ATOM 0 HG23 VAL A 474 0.625 -8.669 2.053 1.00 0.00 H new ATOM 1473 N GLN A 475 -1.710 -5.867 5.733 1.00 0.00 N ATOM 1474 CA GLN A 475 -2.597 -5.531 6.853 1.00 0.00 C ATOM 1475 C GLN A 475 -3.216 -4.131 6.674 1.00 0.00 C ATOM 1476 O GLN A 475 -2.875 -3.412 5.735 1.00 0.00 O ATOM 1477 CB GLN A 475 -1.818 -5.620 8.184 1.00 0.00 C ATOM 1478 CG GLN A 475 -0.592 -4.687 8.234 1.00 0.00 C ATOM 1479 CD GLN A 475 -0.141 -4.422 9.669 1.00 0.00 C ATOM 1480 OE1 GLN A 475 0.596 -5.192 10.273 1.00 0.00 O ATOM 1481 NE2 GLN A 475 -0.579 -3.334 10.271 1.00 0.00 N ATOM 0 H GLN A 475 -1.442 -5.048 5.187 1.00 0.00 H new ATOM 0 HA GLN A 475 -3.415 -6.251 6.873 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -2.488 -5.373 9.007 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -1.490 -6.648 8.338 1.00 0.00 H new ATOM 0 HG2 GLN A 475 0.228 -5.133 7.672 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -0.834 -3.742 7.748 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -1.193 -2.688 9.774 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -0.304 -3.138 11.233 1.00 0.00 H new ATOM 1490 N LEU A 476 -4.087 -3.715 7.604 1.00 0.00 N ATOM 1491 CA LEU A 476 -4.576 -2.334 7.690 1.00 0.00 C ATOM 1492 C LEU A 476 -3.426 -1.374 8.059 1.00 0.00 C ATOM 1493 O LEU A 476 -2.503 -1.738 8.794 1.00 0.00 O ATOM 1494 CB LEU A 476 -5.726 -2.236 8.714 1.00 0.00 C ATOM 1495 CG LEU A 476 -6.982 -3.087 8.415 1.00 0.00 C ATOM 1496 CD1 LEU A 476 -7.979 -2.928 9.571 1.00 0.00 C ATOM 1497 CD2 LEU A 476 -7.674 -2.694 7.100 1.00 0.00 C ATOM 0 H LEU A 476 -4.473 -4.330 8.320 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.961 -2.039 6.714 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -5.340 -2.527 9.691 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -6.030 -1.192 8.789 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.655 -4.122 8.311 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -8.868 -3.525 9.369 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -7.518 -3.267 10.499 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -8.260 -1.879 9.668 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -8.548 -3.327 6.946 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -7.985 -1.651 7.150 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.980 -2.826 6.270 1.00 0.00 H new ATOM 1509 N LYS A 477 -3.471 -0.139 7.554 1.00 0.00 N ATOM 1510 CA LYS A 477 -2.402 0.855 7.742 1.00 0.00 C ATOM 1511 C LYS A 477 -2.405 1.500 9.150 1.00 0.00 C ATOM 1512 O LYS A 477 -3.460 1.700 9.761 1.00 0.00 O ATOM 1513 CB LYS A 477 -2.526 1.917 6.635 1.00 0.00 C ATOM 1514 CG LYS A 477 -1.225 2.707 6.418 1.00 0.00 C ATOM 1515 CD LYS A 477 -1.412 3.830 5.398 1.00 0.00 C ATOM 1516 CE LYS A 477 -2.253 5.000 5.921 1.00 0.00 C ATOM 1517 NZ LYS A 477 -1.492 5.871 6.847 1.00 0.00 N ATOM 0 H LYS A 477 -4.254 0.206 6.999 1.00 0.00 H new ATOM 0 HA LYS A 477 -1.442 0.343 7.668 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -2.810 1.431 5.702 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -3.328 2.610 6.891 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -0.892 3.128 7.367 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -0.441 2.031 6.076 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.433 4.203 5.097 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -1.886 3.423 4.505 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -2.610 5.593 5.079 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -3.133 4.611 6.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -1.767 6.863 6.696 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -1.701 5.600 7.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.473 5.763 6.667 1.00 0.00 H new