USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 637 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: S 471 THR OG1 : rot 180:sc= -1.22 USER MOD Set 1.2: S 472 GLN : amide:sc= -1.93 K(o=-3.2,f=-0.7) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.966 X(o=-0.97,f=-0.97) USER MOD Single : P 370 SER OG : rot 59:sc= 0.0804 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : P 378 CYS SG : rot 19:sc= -6.75 USER MOD Single : P 379 SER OG : rot 96:sc= 0.122 USER MOD Single : P 381 SER OG : rot -130:sc= 0.0102 USER MOD Single : P 382 THR OG1 : rot 160:sc= -5.77! USER MOD Single : P 383 LYS NZ :NH3+ -123:sc= 0 (180deg=-1.44!) USER MOD Single : P 385 LYS NZ :NH3+ -129:sc= -0.812! (180deg=-5.21!) USER MOD Single : S 460 SER OG : rot 180:sc= 0 USER MOD Single : S 461 GLN : amide:sc= -0.0794 K(o=-0.079,f=-0.99) USER MOD Single : S 467 SER OG : rot 111:sc= 0.0405 USER MOD Single : S 468 TYR OH : rot -99:sc= 0.976 USER MOD Single : S 479 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 488 SER OG : rot 180:sc= 0 USER MOD Single : S 489 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 491 ASN : amide:sc= -8.88! K(o=-8.9!,f=-3.9) USER MOD Single : S 499 SER OG : rot 180:sc= 0 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ -111:sc= 0.205 (180deg=-0.0966) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.746 -10.259 2.099 1.00 0.00 N ATOM 91 CA SER S 460 -4.862 -10.529 1.202 1.00 0.00 C ATOM 92 C SER S 460 -4.710 -9.709 -0.077 1.00 0.00 C ATOM 93 O SER S 460 -3.598 -9.329 -0.437 1.00 0.00 O ATOM 94 CB SER S 460 -6.181 -10.205 1.898 1.00 0.00 C ATOM 95 OG SER S 460 -7.123 -11.249 1.722 1.00 0.00 O ATOM 0 HA SER S 460 -4.863 -11.586 0.937 1.00 0.00 H new ATOM 0 HB2 SER S 460 -6.005 -10.046 2.962 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.586 -9.275 1.500 1.00 0.00 H new ATOM 0 HG SER S 460 -7.958 -11.017 2.179 1.00 0.00 H new ATOM 101 N GLN S 461 -5.814 -9.431 -0.766 1.00 0.00 N ATOM 102 CA GLN S 461 -5.741 -8.649 -1.999 1.00 0.00 C ATOM 103 C GLN S 461 -6.912 -7.687 -2.130 1.00 0.00 C ATOM 104 O GLN S 461 -7.919 -7.805 -1.432 1.00 0.00 O ATOM 105 CB GLN S 461 -5.693 -9.566 -3.225 1.00 0.00 C ATOM 106 CG GLN S 461 -5.029 -10.911 -2.965 1.00 0.00 C ATOM 107 CD GLN S 461 -4.515 -11.562 -4.233 1.00 0.00 C ATOM 108 OE1 GLN S 461 -4.013 -10.887 -5.131 1.00 0.00 O ATOM 109 NE2 GLN S 461 -4.636 -12.883 -4.312 1.00 0.00 N ATOM 0 H GLN S 461 -6.753 -9.728 -0.499 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.822 -8.065 -1.949 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.710 -9.736 -3.579 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.158 -9.057 -4.026 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -4.201 -10.775 -2.270 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -5.744 -11.578 -2.483 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -5.059 -13.403 -3.543 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -4.306 -13.377 -5.141 1.00 0.00 H new ATOM 118 N VAL S 462 -6.760 -6.731 -3.040 1.00 0.00 N ATOM 119 CA VAL S 462 -7.783 -5.729 -3.291 1.00 0.00 C ATOM 120 C VAL S 462 -7.584 -5.087 -4.660 1.00 0.00 C ATOM 121 O VAL S 462 -6.688 -4.263 -4.842 1.00 0.00 O ATOM 122 CB VAL S 462 -7.756 -4.626 -2.218 1.00 0.00 C ATOM 123 CG1 VAL S 462 -8.292 -5.150 -0.896 1.00 0.00 C ATOM 124 CG2 VAL S 462 -6.343 -4.087 -2.056 1.00 0.00 C ATOM 0 H VAL S 462 -5.927 -6.631 -3.621 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.747 -6.237 -3.260 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.402 -3.809 -2.541 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -8.264 -4.355 -0.151 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -9.320 -5.488 -1.028 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -7.677 -5.984 -0.559 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -6.336 -3.307 -1.294 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -5.678 -4.896 -1.754 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.001 -3.671 -3.004 1.00 0.00 H new ATOM 134 N GLU S 463 -8.415 -5.474 -5.626 1.00 0.00 N ATOM 135 CA GLU S 463 -8.320 -4.938 -6.979 1.00 0.00 C ATOM 136 C GLU S 463 -8.140 -3.423 -6.973 1.00 0.00 C ATOM 137 O GLU S 463 -8.718 -2.723 -6.142 1.00 0.00 O ATOM 138 CB GLU S 463 -9.567 -5.309 -7.780 1.00 0.00 C ATOM 139 CG GLU S 463 -9.307 -6.374 -8.828 1.00 0.00 C ATOM 140 CD GLU S 463 -10.504 -6.619 -9.724 1.00 0.00 C ATOM 141 OE1 GLU S 463 -11.629 -6.246 -9.329 1.00 0.00 O ATOM 142 OE2 GLU S 463 -10.317 -7.183 -10.824 1.00 0.00 O ATOM 0 H GLU S 463 -9.161 -6.157 -5.495 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.441 -5.379 -7.448 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -10.339 -5.662 -7.096 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.957 -4.416 -8.268 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -8.456 -6.075 -9.440 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -9.033 -7.305 -8.333 1.00 0.00 H new ATOM 149 N ALA S 464 -7.343 -2.924 -7.912 1.00 0.00 N ATOM 150 CA ALA S 464 -7.101 -1.494 -8.017 1.00 0.00 C ATOM 151 C ALA S 464 -8.119 -0.850 -8.948 1.00 0.00 C ATOM 152 O ALA S 464 -8.672 -1.511 -9.825 1.00 0.00 O ATOM 153 CB ALA S 464 -5.683 -1.227 -8.502 1.00 0.00 C ATOM 0 H ALA S 464 -6.856 -3.489 -8.608 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.212 -1.050 -7.028 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.520 -0.152 -8.575 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -4.971 -1.655 -7.797 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.542 -1.682 -9.482 1.00 0.00 H new ATOM 159 N LEU S 465 -8.381 0.432 -8.743 1.00 0.00 N ATOM 160 CA LEU S 465 -9.351 1.148 -9.561 1.00 0.00 C ATOM 161 C LEU S 465 -8.790 2.461 -10.099 1.00 0.00 C ATOM 162 O LEU S 465 -9.447 3.148 -10.880 1.00 0.00 O ATOM 163 CB LEU S 465 -10.609 1.420 -8.743 1.00 0.00 C ATOM 164 CG LEU S 465 -11.279 0.173 -8.166 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.573 -0.275 -6.897 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.752 0.434 -7.896 1.00 0.00 C ATOM 0 H LEU S 465 -7.937 0.998 -8.019 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.591 0.519 -10.418 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.354 2.091 -7.923 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.329 1.944 -9.372 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.202 -0.628 -8.901 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -11.065 -1.164 -6.502 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.532 -0.506 -7.122 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.615 0.523 -6.156 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.212 -0.465 -7.486 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.852 1.251 -7.181 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.250 0.704 -8.827 1.00 0.00 H new ATOM 178 N PHE S 466 -7.581 2.816 -9.675 1.00 0.00 N ATOM 179 CA PHE S 466 -6.959 4.055 -10.120 1.00 0.00 C ATOM 180 C PHE S 466 -5.459 3.899 -10.316 1.00 0.00 C ATOM 181 O PHE S 466 -4.859 2.908 -9.899 1.00 0.00 O ATOM 182 CB PHE S 466 -7.196 5.162 -9.098 1.00 0.00 C ATOM 183 CG PHE S 466 -8.630 5.351 -8.719 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.545 5.816 -9.645 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.061 5.076 -7.431 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.864 6.003 -9.296 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.378 5.264 -7.075 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.281 5.730 -8.011 1.00 0.00 C ATOM 0 H PHE S 466 -7.017 2.266 -9.028 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.415 4.312 -11.076 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.621 4.940 -8.199 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.811 6.100 -9.499 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.222 6.035 -10.652 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.357 4.710 -6.699 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.571 6.363 -10.029 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.704 5.048 -6.068 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.314 5.880 -7.736 1.00 0.00 H new ATOM 198 N SER S 467 -4.860 4.916 -10.922 1.00 0.00 N ATOM 199 CA SER S 467 -3.424 4.943 -11.146 1.00 0.00 C ATOM 200 C SER S 467 -2.805 5.968 -10.210 1.00 0.00 C ATOM 201 O SER S 467 -2.847 7.171 -10.470 1.00 0.00 O ATOM 202 CB SER S 467 -3.106 5.286 -12.603 1.00 0.00 C ATOM 203 OG SER S 467 -3.767 4.402 -13.492 1.00 0.00 O ATOM 0 H SER S 467 -5.353 5.739 -11.269 1.00 0.00 H new ATOM 0 HA SER S 467 -3.006 3.957 -10.942 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.409 6.312 -12.813 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.030 5.232 -12.766 1.00 0.00 H new ATOM 0 HG SER S 467 -4.466 4.888 -13.977 1.00 0.00 H new ATOM 209 N TYR S 468 -2.269 5.485 -9.098 1.00 0.00 N ATOM 210 CA TYR S 468 -1.682 6.355 -8.091 1.00 0.00 C ATOM 211 C TYR S 468 -0.281 6.811 -8.476 1.00 0.00 C ATOM 212 O TYR S 468 0.631 5.998 -8.626 1.00 0.00 O ATOM 213 CB TYR S 468 -1.642 5.622 -6.747 1.00 0.00 C ATOM 214 CG TYR S 468 -0.934 6.380 -5.643 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.776 7.760 -5.702 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.420 5.710 -4.541 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.127 8.449 -4.698 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.230 6.390 -3.531 1.00 0.00 C ATOM 219 CZ TYR S 468 0.375 7.761 -3.614 1.00 0.00 C ATOM 220 OH TYR S 468 1.022 8.447 -2.610 1.00 0.00 O ATOM 0 H TYR S 468 -2.229 4.491 -8.871 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.304 7.247 -8.014 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.664 5.413 -6.430 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.148 4.660 -6.886 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.168 8.303 -6.549 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.531 4.638 -4.473 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.013 9.521 -4.761 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.623 5.853 -2.680 1.00 0.00 H new ATOM 0 HH TYR S 468 1.991 8.382 -2.741 1.00 0.00 H new ATOM 230 N GLU S 469 -0.113 8.124 -8.606 1.00 0.00 N ATOM 231 CA GLU S 469 1.182 8.698 -8.939 1.00 0.00 C ATOM 232 C GLU S 469 2.091 8.635 -7.720 1.00 0.00 C ATOM 233 O GLU S 469 1.881 9.346 -6.737 1.00 0.00 O ATOM 234 CB GLU S 469 1.030 10.144 -9.406 1.00 0.00 C ATOM 235 CG GLU S 469 2.020 10.540 -10.489 1.00 0.00 C ATOM 236 CD GLU S 469 1.564 11.749 -11.284 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.427 11.726 -11.800 1.00 0.00 O ATOM 238 OE2 GLU S 469 2.346 12.719 -11.390 1.00 0.00 O ATOM 0 H GLU S 469 -0.859 8.809 -8.485 1.00 0.00 H new ATOM 0 HA GLU S 469 1.623 8.123 -9.753 1.00 0.00 H new ATOM 0 HB2 GLU S 469 0.017 10.292 -9.780 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.154 10.808 -8.551 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.986 10.754 -10.032 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.167 9.699 -11.167 1.00 0.00 H new ATOM 245 N ALA S 470 3.084 7.765 -7.786 1.00 0.00 N ATOM 246 CA ALA S 470 4.014 7.582 -6.682 1.00 0.00 C ATOM 247 C ALA S 470 5.216 8.511 -6.802 1.00 0.00 C ATOM 248 O ALA S 470 6.055 8.350 -7.688 1.00 0.00 O ATOM 249 CB ALA S 470 4.457 6.128 -6.615 1.00 0.00 C ATOM 0 H ALA S 470 3.268 7.172 -8.595 1.00 0.00 H new ATOM 0 HA ALA S 470 3.500 7.839 -5.756 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.153 5.998 -5.786 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.587 5.489 -6.462 1.00 0.00 H new ATOM 0 HB3 ALA S 470 4.949 5.854 -7.548 1.00 0.00 H new ATOM 255 N THR S 471 5.292 9.483 -5.898 1.00 0.00 N ATOM 256 CA THR S 471 6.390 10.442 -5.892 1.00 0.00 C ATOM 257 C THR S 471 7.433 10.064 -4.845 1.00 0.00 C ATOM 258 O THR S 471 8.622 10.334 -5.014 1.00 0.00 O ATOM 259 CB THR S 471 5.862 11.851 -5.618 1.00 0.00 C ATOM 260 OG1 THR S 471 4.905 11.834 -4.574 1.00 0.00 O ATOM 261 CG2 THR S 471 5.214 12.493 -6.825 1.00 0.00 C ATOM 0 H THR S 471 4.604 9.627 -5.159 1.00 0.00 H new ATOM 0 HA THR S 471 6.863 10.424 -6.874 1.00 0.00 H new ATOM 0 HB THR S 471 6.738 12.438 -5.341 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.581 12.745 -4.413 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.862 13.490 -6.561 1.00 0.00 H new ATOM 0 HG22 THR S 471 5.942 12.567 -7.633 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.371 11.885 -7.152 1.00 0.00 H new ATOM 269 N GLN S 472 6.979 9.432 -3.766 1.00 0.00 N ATOM 270 CA GLN S 472 7.877 9.010 -2.696 1.00 0.00 C ATOM 271 C GLN S 472 8.227 7.528 -2.831 1.00 0.00 C ATOM 272 O GLN S 472 7.616 6.806 -3.618 1.00 0.00 O ATOM 273 CB GLN S 472 7.267 9.292 -1.317 1.00 0.00 C ATOM 274 CG GLN S 472 5.748 9.239 -1.282 1.00 0.00 C ATOM 275 CD GLN S 472 5.112 10.571 -1.629 1.00 0.00 C ATOM 276 OE1 GLN S 472 5.533 11.620 -1.140 1.00 0.00 O ATOM 277 NE2 GLN S 472 4.090 10.537 -2.477 1.00 0.00 N ATOM 0 H GLN S 472 5.998 9.202 -3.610 1.00 0.00 H new ATOM 0 HA GLN S 472 8.795 9.591 -2.787 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.661 8.568 -0.604 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.592 10.277 -0.983 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.398 8.480 -1.981 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.421 8.932 -0.289 1.00 0.00 H new ATOM 0 HE21 GLN S 472 3.773 9.646 -2.859 1.00 0.00 H new ATOM 0 HE22 GLN S 472 3.622 11.402 -2.747 1.00 0.00 H new ATOM 286 N PRO S 473 9.237 7.064 -2.076 1.00 0.00 N ATOM 287 CA PRO S 473 9.697 5.670 -2.123 1.00 0.00 C ATOM 288 C PRO S 473 8.680 4.667 -1.574 1.00 0.00 C ATOM 289 O PRO S 473 8.124 3.864 -2.324 1.00 0.00 O ATOM 290 CB PRO S 473 10.965 5.671 -1.253 1.00 0.00 C ATOM 291 CG PRO S 473 11.325 7.107 -1.074 1.00 0.00 C ATOM 292 CD PRO S 473 10.033 7.865 -1.135 1.00 0.00 C ATOM 0 HA PRO S 473 9.862 5.353 -3.153 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.782 5.190 -0.292 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.773 5.121 -1.736 1.00 0.00 H new ATOM 0 HG2 PRO S 473 11.828 7.268 -0.120 1.00 0.00 H new ATOM 0 HG3 PRO S 473 12.010 7.438 -1.855 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.557 7.934 -0.157 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.177 8.885 -1.492 1.00 0.00 H new ATOM 300 N GLU S 474 8.461 4.699 -0.261 1.00 0.00 N ATOM 301 CA GLU S 474 7.534 3.769 0.388 1.00 0.00 C ATOM 302 C GLU S 474 6.199 3.673 -0.352 1.00 0.00 C ATOM 303 O GLU S 474 5.577 2.611 -0.385 1.00 0.00 O ATOM 304 CB GLU S 474 7.302 4.175 1.848 1.00 0.00 C ATOM 305 CG GLU S 474 6.364 5.359 2.019 1.00 0.00 C ATOM 306 CD GLU S 474 6.881 6.616 1.345 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.835 7.223 1.875 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.331 6.992 0.289 1.00 0.00 O ATOM 0 H GLU S 474 8.911 5.357 0.375 1.00 0.00 H new ATOM 0 HA GLU S 474 7.995 2.782 0.358 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.896 3.322 2.392 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.262 4.416 2.304 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.387 5.106 1.607 1.00 0.00 H new ATOM 0 HG3 GLU S 474 6.221 5.554 3.082 1.00 0.00 H new ATOM 315 N ASP S 475 5.761 4.781 -0.939 1.00 0.00 N ATOM 316 CA ASP S 475 4.502 4.810 -1.666 1.00 0.00 C ATOM 317 C ASP S 475 4.502 3.800 -2.807 1.00 0.00 C ATOM 318 O ASP S 475 5.256 3.934 -3.770 1.00 0.00 O ATOM 319 CB ASP S 475 4.254 6.211 -2.213 1.00 0.00 C ATOM 320 CG ASP S 475 3.489 7.089 -1.241 1.00 0.00 C ATOM 321 OD1 ASP S 475 3.148 6.602 -0.142 1.00 0.00 O ATOM 322 OD2 ASP S 475 3.230 8.262 -1.578 1.00 0.00 O ATOM 0 H ASP S 475 6.261 5.670 -0.924 1.00 0.00 H new ATOM 0 HA ASP S 475 3.703 4.541 -0.975 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.210 6.680 -2.446 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.698 6.139 -3.147 1.00 0.00 H new ATOM 327 N LEU S 476 3.640 2.797 -2.695 1.00 0.00 N ATOM 328 CA LEU S 476 3.528 1.771 -3.724 1.00 0.00 C ATOM 329 C LEU S 476 2.691 2.294 -4.883 1.00 0.00 C ATOM 330 O LEU S 476 1.505 2.580 -4.726 1.00 0.00 O ATOM 331 CB LEU S 476 2.898 0.490 -3.151 1.00 0.00 C ATOM 332 CG LEU S 476 2.354 -0.493 -4.192 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.463 -0.970 -5.115 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.678 -1.674 -3.521 1.00 0.00 C ATOM 0 H LEU S 476 3.009 2.672 -1.903 1.00 0.00 H new ATOM 0 HA LEU S 476 4.528 1.528 -4.083 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.645 -0.024 -2.546 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.085 0.772 -2.482 1.00 0.00 H new ATOM 0 HG LEU S 476 1.610 0.031 -4.791 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.053 -1.667 -5.846 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.898 -0.115 -5.633 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.234 -1.470 -4.529 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.300 -2.357 -4.282 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.398 -2.195 -2.890 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.849 -1.319 -2.908 1.00 0.00 H new ATOM 346 N GLU S 477 3.321 2.428 -6.043 1.00 0.00 N ATOM 347 CA GLU S 477 2.637 2.926 -7.229 1.00 0.00 C ATOM 348 C GLU S 477 1.907 1.803 -7.948 1.00 0.00 C ATOM 349 O GLU S 477 2.439 0.704 -8.099 1.00 0.00 O ATOM 350 CB GLU S 477 3.638 3.565 -8.187 1.00 0.00 C ATOM 351 CG GLU S 477 3.071 4.737 -8.966 1.00 0.00 C ATOM 352 CD GLU S 477 4.089 5.363 -9.901 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.303 5.169 -9.672 1.00 0.00 O ATOM 354 OE2 GLU S 477 3.674 6.043 -10.862 1.00 0.00 O ATOM 0 H GLU S 477 4.304 2.199 -6.188 1.00 0.00 H new ATOM 0 HA GLU S 477 1.910 3.671 -6.906 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.506 3.902 -7.620 1.00 0.00 H new ATOM 0 HB3 GLU S 477 3.990 2.809 -8.889 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.210 4.402 -9.544 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.711 5.493 -8.268 1.00 0.00 H new ATOM 361 N PHE S 478 0.695 2.086 -8.406 1.00 0.00 N ATOM 362 CA PHE S 478 -0.086 1.084 -9.128 1.00 0.00 C ATOM 363 C PHE S 478 -1.071 1.739 -10.089 1.00 0.00 C ATOM 364 O PHE S 478 -1.362 2.929 -9.979 1.00 0.00 O ATOM 365 CB PHE S 478 -0.827 0.163 -8.157 1.00 0.00 C ATOM 366 CG PHE S 478 -1.534 0.891 -7.054 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.816 1.539 -6.064 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.917 0.924 -7.005 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.464 2.209 -5.045 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.572 1.593 -5.989 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.845 2.237 -5.007 1.00 0.00 C ATOM 0 H PHE S 478 0.233 2.989 -8.294 1.00 0.00 H new ATOM 0 HA PHE S 478 0.612 0.483 -9.711 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.554 -0.428 -8.714 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.115 -0.537 -7.720 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.264 1.520 -6.089 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.490 0.421 -7.770 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.892 2.711 -4.279 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.652 1.612 -5.963 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.354 2.761 -4.212 1.00 0.00 H new ATOM 381 N GLN S 479 -1.574 0.952 -11.036 1.00 0.00 N ATOM 382 CA GLN S 479 -2.523 1.449 -12.025 1.00 0.00 C ATOM 383 C GLN S 479 -3.949 1.035 -11.674 1.00 0.00 C ATOM 384 O GLN S 479 -4.167 0.244 -10.756 1.00 0.00 O ATOM 385 CB GLN S 479 -2.159 0.930 -13.417 1.00 0.00 C ATOM 386 CG GLN S 479 -2.166 -0.587 -13.521 1.00 0.00 C ATOM 387 CD GLN S 479 -2.151 -1.073 -14.956 1.00 0.00 C ATOM 388 OE1 GLN S 479 -3.031 -1.824 -15.378 1.00 0.00 O ATOM 389 NE2 GLN S 479 -1.149 -0.646 -15.717 1.00 0.00 N ATOM 0 H GLN S 479 -1.339 -0.035 -11.139 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.471 2.538 -12.023 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.861 1.339 -14.143 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -1.170 1.300 -13.687 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -1.298 -0.987 -12.997 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -3.051 -0.978 -13.018 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -0.441 -0.024 -15.326 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -1.088 -0.940 -16.692 1.00 0.00 H new ATOM 398 N GLU S 480 -4.915 1.573 -12.411 1.00 0.00 N ATOM 399 CA GLU S 480 -6.319 1.257 -12.178 1.00 0.00 C ATOM 400 C GLU S 480 -6.637 -0.161 -12.639 1.00 0.00 C ATOM 401 O GLU S 480 -5.927 -0.731 -13.467 1.00 0.00 O ATOM 402 CB GLU S 480 -7.218 2.261 -12.904 1.00 0.00 C ATOM 403 CG GLU S 480 -7.197 2.120 -14.417 1.00 0.00 C ATOM 404 CD GLU S 480 -6.936 3.437 -15.124 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.905 4.193 -15.345 1.00 0.00 O ATOM 406 OE2 GLU S 480 -5.763 3.711 -15.455 1.00 0.00 O ATOM 0 H GLU S 480 -4.751 2.230 -13.174 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.510 1.323 -11.107 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -8.242 2.139 -12.551 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.907 3.271 -12.638 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.428 1.402 -14.700 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -8.151 1.715 -14.753 1.00 0.00 H new ATOM 413 N GLY S 481 -7.710 -0.728 -12.095 1.00 0.00 N ATOM 414 CA GLY S 481 -8.103 -2.078 -12.461 1.00 0.00 C ATOM 415 C GLY S 481 -6.953 -3.061 -12.360 1.00 0.00 C ATOM 416 O GLY S 481 -6.694 -3.818 -13.294 1.00 0.00 O ATOM 0 H GLY S 481 -8.314 -0.277 -11.408 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.916 -2.406 -11.813 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.489 -2.078 -13.480 1.00 0.00 H new ATOM 420 N ASP S 482 -6.255 -3.042 -11.228 1.00 0.00 N ATOM 421 CA ASP S 482 -5.121 -3.935 -11.026 1.00 0.00 C ATOM 422 C ASP S 482 -5.375 -4.928 -9.904 1.00 0.00 C ATOM 423 O ASP S 482 -6.440 -4.931 -9.287 1.00 0.00 O ATOM 424 CB ASP S 482 -3.851 -3.137 -10.736 1.00 0.00 C ATOM 425 CG ASP S 482 -2.619 -3.757 -11.367 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.407 -3.551 -12.581 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.868 -4.448 -10.648 1.00 0.00 O ATOM 0 H ASP S 482 -6.454 -2.422 -10.442 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.988 -4.498 -11.950 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.972 -2.119 -11.107 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.707 -3.068 -9.658 1.00 0.00 H new ATOM 432 N ILE S 483 -4.387 -5.777 -9.657 1.00 0.00 N ATOM 433 CA ILE S 483 -4.481 -6.792 -8.627 1.00 0.00 C ATOM 434 C ILE S 483 -3.291 -6.720 -7.675 1.00 0.00 C ATOM 435 O ILE S 483 -2.410 -7.580 -7.701 1.00 0.00 O ATOM 436 CB ILE S 483 -4.537 -8.197 -9.249 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.583 -8.248 -10.364 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.841 -9.227 -8.181 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.993 -7.986 -9.886 1.00 0.00 C ATOM 0 H ILE S 483 -3.503 -5.779 -10.165 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.398 -6.603 -8.069 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.565 -8.427 -9.685 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.325 -7.513 -11.126 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.546 -9.228 -10.840 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.878 -10.219 -8.632 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -4.061 -9.204 -7.420 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.803 -9.001 -7.721 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.679 -8.038 -10.731 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.271 -8.736 -9.145 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -7.046 -6.995 -9.436 1.00 0.00 H new ATOM 451 N ILE S 484 -3.268 -5.694 -6.833 1.00 0.00 N ATOM 452 CA ILE S 484 -2.184 -5.526 -5.874 1.00 0.00 C ATOM 453 C ILE S 484 -2.389 -6.433 -4.668 1.00 0.00 C ATOM 454 O ILE S 484 -3.515 -6.621 -4.204 1.00 0.00 O ATOM 455 CB ILE S 484 -2.064 -4.060 -5.402 1.00 0.00 C ATOM 456 CG1 ILE S 484 -1.770 -3.143 -6.591 1.00 0.00 C ATOM 457 CG2 ILE S 484 -0.976 -3.924 -4.344 1.00 0.00 C ATOM 458 CD1 ILE S 484 -2.991 -2.415 -7.105 1.00 0.00 C ATOM 0 H ILE S 484 -3.984 -4.969 -6.795 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.259 -5.801 -6.381 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.013 -3.762 -4.957 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.017 -2.412 -6.298 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -1.342 -3.735 -7.400 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -0.907 -2.884 -4.025 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.221 -4.551 -3.487 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.020 -4.239 -4.762 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.710 -1.783 -7.948 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -3.738 -3.140 -7.429 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -3.407 -1.796 -6.310 1.00 0.00 H new ATOM 470 N LEU S 485 -1.297 -6.993 -4.167 1.00 0.00 N ATOM 471 CA LEU S 485 -1.356 -7.886 -3.019 1.00 0.00 C ATOM 472 C LEU S 485 -1.292 -7.090 -1.719 1.00 0.00 C ATOM 473 O LEU S 485 -0.293 -6.432 -1.429 1.00 0.00 O ATOM 474 CB LEU S 485 -0.211 -8.908 -3.097 1.00 0.00 C ATOM 475 CG LEU S 485 0.191 -9.584 -1.778 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.120 -8.685 -0.977 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.037 -9.955 -0.960 1.00 0.00 C ATOM 0 H LEU S 485 -0.359 -6.844 -4.538 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.304 -8.424 -3.033 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.494 -9.685 -3.807 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.667 -8.407 -3.506 1.00 0.00 H new ATOM 0 HG LEU S 485 0.726 -10.503 -2.018 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.394 -9.182 -0.046 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.020 -8.482 -1.558 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.614 -7.746 -0.752 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.725 -10.432 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.608 -9.055 -0.732 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.660 -10.644 -1.530 1.00 0.00 H new ATOM 489 N VAL S 486 -2.364 -7.163 -0.937 1.00 0.00 N ATOM 490 CA VAL S 486 -2.425 -6.458 0.337 1.00 0.00 C ATOM 491 C VAL S 486 -1.660 -7.244 1.378 1.00 0.00 C ATOM 492 O VAL S 486 -2.109 -8.307 1.788 1.00 0.00 O ATOM 493 CB VAL S 486 -3.863 -6.291 0.872 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.985 -5.017 1.673 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.907 -6.328 -0.234 1.00 0.00 C ATOM 0 H VAL S 486 -3.200 -7.702 -1.163 1.00 0.00 H new ATOM 0 HA VAL S 486 -2.001 -5.470 0.159 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.060 -7.143 1.523 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -5.006 -4.916 2.042 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -3.295 -5.050 2.517 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.742 -4.164 1.039 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.900 -6.206 0.199 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.717 -5.520 -0.941 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.853 -7.285 -0.754 1.00 0.00 H new ATOM 505 N LEU S 487 -0.517 -6.744 1.806 1.00 0.00 N ATOM 506 CA LEU S 487 0.265 -7.461 2.798 1.00 0.00 C ATOM 507 C LEU S 487 -0.272 -7.265 4.210 1.00 0.00 C ATOM 508 O LEU S 487 0.018 -8.065 5.098 1.00 0.00 O ATOM 509 CB LEU S 487 1.729 -7.044 2.734 1.00 0.00 C ATOM 510 CG LEU S 487 2.612 -7.888 1.803 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.079 -7.693 2.146 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.246 -9.366 1.888 1.00 0.00 C ATOM 0 H LEU S 487 -0.114 -5.862 1.491 1.00 0.00 H new ATOM 0 HA LEU S 487 0.182 -8.521 2.559 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.780 -6.004 2.411 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.146 -7.086 3.740 1.00 0.00 H new ATOM 0 HG LEU S 487 2.438 -7.553 0.781 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.692 -8.297 1.478 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.343 -6.642 2.030 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.255 -7.999 3.177 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.887 -9.939 1.218 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.384 -9.717 2.911 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.205 -9.500 1.596 1.00 0.00 H new ATOM 524 N SER S 488 -1.059 -6.214 4.414 1.00 0.00 N ATOM 525 CA SER S 488 -1.637 -5.932 5.737 1.00 0.00 C ATOM 526 C SER S 488 -2.225 -4.528 5.806 1.00 0.00 C ATOM 527 O SER S 488 -1.913 -3.669 4.985 1.00 0.00 O ATOM 528 CB SER S 488 -0.572 -6.045 6.836 1.00 0.00 C ATOM 529 OG SER S 488 -1.145 -6.471 8.060 1.00 0.00 O ATOM 0 H SER S 488 -1.314 -5.543 3.689 1.00 0.00 H new ATOM 0 HA SER S 488 -2.425 -6.669 5.892 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.200 -6.750 6.527 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.085 -5.080 6.975 1.00 0.00 H new ATOM 0 HG SER S 488 -0.446 -6.537 8.743 1.00 0.00 H new ATOM 535 N LYS S 489 -3.039 -4.292 6.834 1.00 0.00 N ATOM 536 CA LYS S 489 -3.627 -2.981 7.055 1.00 0.00 C ATOM 537 C LYS S 489 -2.587 -2.094 7.727 1.00 0.00 C ATOM 538 O LYS S 489 -1.949 -2.510 8.695 1.00 0.00 O ATOM 539 CB LYS S 489 -4.878 -3.089 7.930 1.00 0.00 C ATOM 540 CG LYS S 489 -5.770 -1.859 7.871 1.00 0.00 C ATOM 541 CD LYS S 489 -7.149 -2.191 7.325 1.00 0.00 C ATOM 542 CE LYS S 489 -8.167 -2.357 8.442 1.00 0.00 C ATOM 543 NZ LYS S 489 -8.362 -3.787 8.808 1.00 0.00 N ATOM 0 H LYS S 489 -3.303 -4.995 7.524 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.926 -2.548 6.100 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.454 -3.961 7.620 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.575 -3.259 8.963 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.867 -1.431 8.869 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -5.303 -1.100 7.243 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.474 -1.399 6.650 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -7.098 -3.109 6.739 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.838 -1.800 9.319 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -9.120 -1.929 8.131 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.063 -3.857 9.573 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -8.701 -4.315 7.978 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -7.458 -4.190 9.129 1.00 0.00 H new ATOM 557 N VAL S 490 -2.379 -0.895 7.199 1.00 0.00 N ATOM 558 CA VAL S 490 -1.364 -0.007 7.760 1.00 0.00 C ATOM 559 C VAL S 490 -1.967 1.140 8.581 1.00 0.00 C ATOM 560 O VAL S 490 -1.320 1.651 9.493 1.00 0.00 O ATOM 561 CB VAL S 490 -0.432 0.530 6.649 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.504 1.608 7.179 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.378 -0.618 6.053 1.00 0.00 C ATOM 0 H VAL S 490 -2.887 -0.518 6.399 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.771 -0.603 8.454 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.054 0.979 5.874 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.145 1.963 6.372 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.083 2.440 7.569 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.121 1.194 7.977 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.033 -0.234 5.271 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.980 -1.083 6.834 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.299 -1.359 5.628 1.00 0.00 H new ATOM 573 N ASN S 491 -3.205 1.533 8.286 1.00 0.00 N ATOM 574 CA ASN S 491 -3.854 2.605 9.048 1.00 0.00 C ATOM 575 C ASN S 491 -5.262 2.899 8.518 1.00 0.00 C ATOM 576 O ASN S 491 -5.735 4.034 8.590 1.00 0.00 O ATOM 577 CB ASN S 491 -2.991 3.883 9.036 1.00 0.00 C ATOM 578 CG ASN S 491 -3.305 4.813 7.879 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.259 6.034 8.019 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.629 4.237 6.730 1.00 0.00 N ATOM 0 H ASN S 491 -3.773 1.135 7.538 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.953 2.263 10.078 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.137 4.420 9.973 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.939 3.601 8.991 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.853 4.811 5.917 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -3.655 3.220 6.659 1.00 0.00 H new ATOM 587 N GLU S 492 -5.927 1.874 7.988 1.00 0.00 N ATOM 588 CA GLU S 492 -7.278 2.029 7.446 1.00 0.00 C ATOM 589 C GLU S 492 -7.238 2.700 6.074 1.00 0.00 C ATOM 590 O GLU S 492 -7.729 2.147 5.090 1.00 0.00 O ATOM 591 CB GLU S 492 -8.159 2.841 8.401 1.00 0.00 C ATOM 592 CG GLU S 492 -9.619 2.420 8.387 1.00 0.00 C ATOM 593 CD GLU S 492 -10.564 3.583 8.621 1.00 0.00 C ATOM 594 OE1 GLU S 492 -10.267 4.423 9.496 1.00 0.00 O ATOM 595 OE2 GLU S 492 -11.601 3.654 7.927 1.00 0.00 O ATOM 0 H GLU S 492 -5.553 0.927 7.922 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.709 1.034 7.336 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.770 2.741 9.414 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -8.091 3.896 8.136 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.850 1.956 7.428 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.783 1.664 9.155 1.00 0.00 H new ATOM 602 N GLU S 493 -6.648 3.892 6.013 1.00 0.00 N ATOM 603 CA GLU S 493 -6.541 4.631 4.757 1.00 0.00 C ATOM 604 C GLU S 493 -5.280 4.233 3.989 1.00 0.00 C ATOM 605 O GLU S 493 -4.952 4.828 2.963 1.00 0.00 O ATOM 606 CB GLU S 493 -6.531 6.138 5.028 1.00 0.00 C ATOM 607 CG GLU S 493 -7.919 6.757 5.070 1.00 0.00 C ATOM 608 CD GLU S 493 -8.541 6.700 6.452 1.00 0.00 C ATOM 609 OE1 GLU S 493 -9.161 5.668 6.782 1.00 0.00 O ATOM 610 OE2 GLU S 493 -8.406 7.687 7.205 1.00 0.00 O ATOM 0 H GLU S 493 -6.237 4.366 6.817 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.408 4.381 4.146 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.030 6.325 5.978 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -5.944 6.634 4.255 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -7.860 7.796 4.745 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.566 6.238 4.363 1.00 0.00 H new ATOM 617 N TRP S 494 -4.584 3.215 4.491 1.00 0.00 N ATOM 618 CA TRP S 494 -3.367 2.719 3.861 1.00 0.00 C ATOM 619 C TRP S 494 -3.092 1.296 4.315 1.00 0.00 C ATOM 620 O TRP S 494 -3.661 0.823 5.299 1.00 0.00 O ATOM 621 CB TRP S 494 -2.158 3.601 4.196 1.00 0.00 C ATOM 622 CG TRP S 494 -2.201 4.961 3.570 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.817 6.071 4.065 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.591 5.360 2.336 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.631 7.135 3.219 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.886 6.723 2.149 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.827 4.698 1.372 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.442 7.436 1.041 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.387 5.407 0.271 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.696 6.764 0.113 1.00 0.00 C ATOM 0 H TRP S 494 -4.847 2.715 5.340 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.520 2.743 2.782 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.092 3.713 5.278 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.250 3.092 3.872 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.372 6.108 4.991 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.990 8.079 3.364 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.585 3.652 1.485 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.678 8.483 0.918 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.205 4.906 -0.481 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.338 7.290 -0.759 1.00 0.00 H new ATOM 641 N LEU S 495 -2.226 0.616 3.587 1.00 0.00 N ATOM 642 CA LEU S 495 -1.878 -0.754 3.898 1.00 0.00 C ATOM 643 C LEU S 495 -0.556 -1.145 3.256 1.00 0.00 C ATOM 644 O LEU S 495 0.020 -0.377 2.487 1.00 0.00 O ATOM 645 CB LEU S 495 -3.002 -1.689 3.460 1.00 0.00 C ATOM 646 CG LEU S 495 -3.843 -1.196 2.279 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.542 -1.991 1.020 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.321 -1.272 2.630 1.00 0.00 C ATOM 0 H LEU S 495 -1.748 0.996 2.770 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.752 -0.844 4.977 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.568 -2.654 3.197 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.663 -1.858 4.310 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.583 -0.157 2.078 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.154 -1.618 0.199 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.488 -1.883 0.765 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.768 -3.043 1.192 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.914 -0.920 1.786 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.589 -2.304 2.856 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.521 -0.646 3.500 1.00 0.00 H new ATOM 660 N GLU S 496 -0.071 -2.334 3.588 1.00 0.00 N ATOM 661 CA GLU S 496 1.193 -2.806 3.049 1.00 0.00 C ATOM 662 C GLU S 496 1.011 -3.326 1.633 1.00 0.00 C ATOM 663 O GLU S 496 0.109 -4.116 1.356 1.00 0.00 O ATOM 664 CB GLU S 496 1.788 -3.890 3.949 1.00 0.00 C ATOM 665 CG GLU S 496 3.199 -4.299 3.560 1.00 0.00 C ATOM 666 CD GLU S 496 3.769 -5.373 4.467 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.157 -5.645 5.522 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.825 -5.942 4.123 1.00 0.00 O ATOM 0 H GLU S 496 -0.532 -2.984 4.224 1.00 0.00 H new ATOM 0 HA GLU S 496 1.887 -1.966 3.017 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.793 -3.533 4.979 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.143 -4.768 3.920 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.197 -4.661 2.532 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.848 -3.423 3.589 1.00 0.00 H new ATOM 675 N GLY S 497 1.860 -2.847 0.734 1.00 0.00 N ATOM 676 CA GLY S 497 1.771 -3.237 -0.654 1.00 0.00 C ATOM 677 C GLY S 497 2.978 -4.007 -1.158 1.00 0.00 C ATOM 678 O GLY S 497 4.108 -3.529 -1.076 1.00 0.00 O ATOM 0 H GLY S 497 2.612 -2.191 0.946 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.879 -3.848 -0.792 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.642 -2.343 -1.264 1.00 0.00 H new ATOM 682 N GLU S 498 2.730 -5.196 -1.702 1.00 0.00 N ATOM 683 CA GLU S 498 3.793 -6.034 -2.251 1.00 0.00 C ATOM 684 C GLU S 498 3.352 -6.609 -3.595 1.00 0.00 C ATOM 685 O GLU S 498 2.674 -7.634 -3.645 1.00 0.00 O ATOM 686 CB GLU S 498 4.135 -7.168 -1.282 1.00 0.00 C ATOM 687 CG GLU S 498 5.570 -7.655 -1.398 1.00 0.00 C ATOM 688 CD GLU S 498 5.685 -9.162 -1.273 1.00 0.00 C ATOM 689 OE1 GLU S 498 5.748 -9.659 -0.129 1.00 0.00 O ATOM 690 OE2 GLU S 498 5.712 -9.844 -2.318 1.00 0.00 O ATOM 0 H GLU S 498 1.797 -5.602 -1.774 1.00 0.00 H new ATOM 0 HA GLU S 498 4.684 -5.423 -2.396 1.00 0.00 H new ATOM 0 HB2 GLU S 498 3.956 -6.829 -0.262 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.460 -8.005 -1.462 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.980 -7.341 -2.358 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.174 -7.182 -0.624 1.00 0.00 H new ATOM 697 N SER S 499 3.714 -5.931 -4.683 1.00 0.00 N ATOM 698 CA SER S 499 3.318 -6.374 -6.018 1.00 0.00 C ATOM 699 C SER S 499 4.499 -6.911 -6.826 1.00 0.00 C ATOM 700 O SER S 499 5.214 -6.154 -7.481 1.00 0.00 O ATOM 701 CB SER S 499 2.650 -5.224 -6.778 1.00 0.00 C ATOM 702 OG SER S 499 2.594 -5.496 -8.169 1.00 0.00 O ATOM 0 H SER S 499 4.276 -5.080 -4.667 1.00 0.00 H new ATOM 0 HA SER S 499 2.610 -7.193 -5.888 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.642 -5.067 -6.394 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.203 -4.301 -6.607 1.00 0.00 H new ATOM 0 HG SER S 499 2.162 -4.748 -8.632 1.00 0.00 H new ATOM 708 N LYS S 500 4.673 -8.230 -6.794 1.00 0.00 N ATOM 709 CA LYS S 500 5.741 -8.899 -7.540 1.00 0.00 C ATOM 710 C LYS S 500 7.100 -8.229 -7.342 1.00 0.00 C ATOM 711 O LYS S 500 7.377 -7.175 -7.915 1.00 0.00 O ATOM 712 CB LYS S 500 5.396 -8.932 -9.029 1.00 0.00 C ATOM 713 CG LYS S 500 4.477 -10.079 -9.415 1.00 0.00 C ATOM 714 CD LYS S 500 3.016 -9.662 -9.365 1.00 0.00 C ATOM 715 CE LYS S 500 2.453 -9.772 -7.957 1.00 0.00 C ATOM 716 NZ LYS S 500 1.050 -10.270 -7.956 1.00 0.00 N ATOM 0 H LYS S 500 4.083 -8.864 -6.255 1.00 0.00 H new ATOM 0 HA LYS S 500 5.817 -9.914 -7.151 1.00 0.00 H new ATOM 0 HB2 LYS S 500 4.923 -7.990 -9.305 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.318 -9.006 -9.606 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.724 -10.423 -10.419 1.00 0.00 H new ATOM 0 HG3 LYS S 500 4.640 -10.920 -8.741 1.00 0.00 H new ATOM 0 HD2 LYS S 500 2.917 -8.636 -9.718 1.00 0.00 H new ATOM 0 HD3 LYS S 500 2.434 -10.289 -10.041 1.00 0.00 H new ATOM 0 HE2 LYS S 500 3.077 -10.444 -7.368 1.00 0.00 H new ATOM 0 HE3 LYS S 500 2.492 -8.796 -7.473 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.704 -10.330 -6.977 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 0.449 -9.615 -8.496 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.016 -11.213 -8.394 1.00 0.00 H new ATOM 730 N GLY S 501 7.951 -8.866 -6.542 1.00 0.00 N ATOM 731 CA GLY S 501 9.288 -8.349 -6.289 1.00 0.00 C ATOM 732 C GLY S 501 9.325 -6.850 -6.046 1.00 0.00 C ATOM 733 O GLY S 501 10.332 -6.200 -6.325 1.00 0.00 O ATOM 0 H GLY S 501 7.737 -9.739 -6.060 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.708 -8.860 -5.422 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.927 -8.587 -7.139 1.00 0.00 H new ATOM 737 N LYS S 502 8.239 -6.303 -5.516 1.00 0.00 N ATOM 738 CA LYS S 502 8.172 -4.877 -5.230 1.00 0.00 C ATOM 739 C LYS S 502 7.402 -4.630 -3.947 1.00 0.00 C ATOM 740 O LYS S 502 6.238 -5.011 -3.824 1.00 0.00 O ATOM 741 CB LYS S 502 7.527 -4.119 -6.389 1.00 0.00 C ATOM 742 CG LYS S 502 8.531 -3.637 -7.419 1.00 0.00 C ATOM 743 CD LYS S 502 7.993 -3.776 -8.834 1.00 0.00 C ATOM 744 CE LYS S 502 6.871 -2.786 -9.104 1.00 0.00 C ATOM 745 NZ LYS S 502 5.531 -3.428 -9.012 1.00 0.00 N ATOM 0 H LYS S 502 7.395 -6.824 -5.276 1.00 0.00 H new ATOM 0 HA LYS S 502 9.190 -4.508 -5.104 1.00 0.00 H new ATOM 0 HB2 LYS S 502 6.798 -4.766 -6.877 1.00 0.00 H new ATOM 0 HB3 LYS S 502 6.980 -3.262 -5.995 1.00 0.00 H new ATOM 0 HG2 LYS S 502 8.780 -2.594 -7.225 1.00 0.00 H new ATOM 0 HG3 LYS S 502 9.454 -4.208 -7.323 1.00 0.00 H new ATOM 0 HD2 LYS S 502 8.800 -3.616 -9.549 1.00 0.00 H new ATOM 0 HD3 LYS S 502 7.628 -4.792 -8.987 1.00 0.00 H new ATOM 0 HE2 LYS S 502 6.931 -1.966 -8.389 1.00 0.00 H new ATOM 0 HE3 LYS S 502 6.999 -2.354 -10.096 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 5.102 -3.473 -9.958 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 5.633 -4.391 -8.632 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 4.921 -2.869 -8.382 1.00 0.00 H new ATOM 759 N VAL S 503 8.064 -3.999 -2.988 1.00 0.00 N ATOM 760 CA VAL S 503 7.444 -3.712 -1.703 1.00 0.00 C ATOM 761 C VAL S 503 7.156 -2.225 -1.540 1.00 0.00 C ATOM 762 O VAL S 503 7.915 -1.374 -1.999 1.00 0.00 O ATOM 763 CB VAL S 503 8.321 -4.196 -0.535 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.569 -4.076 0.784 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.775 -5.628 -0.768 1.00 0.00 C ATOM 0 H VAL S 503 9.028 -3.677 -3.075 1.00 0.00 H new ATOM 0 HA VAL S 503 6.499 -4.256 -1.683 1.00 0.00 H new ATOM 0 HB VAL S 503 9.206 -3.562 -0.481 1.00 0.00 H new ATOM 0 HG11 VAL S 503 8.205 -4.423 1.598 1.00 0.00 H new ATOM 0 HG12 VAL S 503 7.297 -3.034 0.954 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.666 -4.685 0.745 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.394 -5.954 0.068 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.903 -6.277 -0.849 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.353 -5.681 -1.690 1.00 0.00 H new ATOM 775 N GLY S 504 6.043 -1.935 -0.882 1.00 0.00 N ATOM 776 CA GLY S 504 5.633 -0.566 -0.650 1.00 0.00 C ATOM 777 C GLY S 504 4.310 -0.517 0.079 1.00 0.00 C ATOM 778 O GLY S 504 3.962 -1.461 0.783 1.00 0.00 O ATOM 0 H GLY S 504 5.408 -2.636 -0.500 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.394 -0.048 -0.066 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.549 -0.041 -1.601 1.00 0.00 H new ATOM 782 N ILE S 505 3.565 0.569 -0.090 1.00 0.00 N ATOM 783 CA ILE S 505 2.269 0.703 0.564 1.00 0.00 C ATOM 784 C ILE S 505 1.320 1.559 -0.261 1.00 0.00 C ATOM 785 O ILE S 505 1.750 2.402 -1.044 1.00 0.00 O ATOM 786 CB ILE S 505 2.398 1.304 1.974 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.421 2.444 1.987 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.786 0.220 2.964 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.097 3.534 2.985 1.00 0.00 C ATOM 0 H ILE S 505 3.833 1.364 -0.670 1.00 0.00 H new ATOM 0 HA ILE S 505 1.861 -0.304 0.651 1.00 0.00 H new ATOM 0 HB ILE S 505 1.434 1.718 2.268 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.406 2.035 2.214 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.479 2.881 0.990 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.876 0.653 3.960 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.020 -0.556 2.973 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.741 -0.216 2.670 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.863 4.308 2.940 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.127 3.969 2.746 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.068 3.111 3.989 1.00 0.00 H new ATOM 801 N PHE S 506 0.024 1.336 -0.081 1.00 0.00 N ATOM 802 CA PHE S 506 -0.974 2.097 -0.827 1.00 0.00 C ATOM 803 C PHE S 506 -2.248 2.304 -0.016 1.00 0.00 C ATOM 804 O PHE S 506 -2.500 1.597 0.959 1.00 0.00 O ATOM 805 CB PHE S 506 -1.299 1.399 -2.152 1.00 0.00 C ATOM 806 CG PHE S 506 -1.797 -0.012 -2.006 1.00 0.00 C ATOM 807 CD1 PHE S 506 -1.003 -0.991 -1.431 1.00 0.00 C ATOM 808 CD2 PHE S 506 -3.061 -0.360 -2.455 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.460 -2.289 -1.308 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.522 -1.657 -2.336 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.722 -2.623 -1.762 1.00 0.00 C ATOM 0 H PHE S 506 -0.358 0.645 0.565 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.549 3.079 -1.035 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -2.051 1.984 -2.681 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.404 1.393 -2.774 1.00 0.00 H new ATOM 0 HD1 PHE S 506 -0.016 -0.737 -1.075 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.693 0.392 -2.903 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.831 -3.043 -0.857 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.508 -1.914 -2.692 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.081 -3.637 -1.668 1.00 0.00 H new ATOM 821 N PRO S 507 -3.070 3.293 -0.414 1.00 0.00 N ATOM 822 CA PRO S 507 -4.320 3.609 0.267 1.00 0.00 C ATOM 823 C PRO S 507 -5.487 2.770 -0.245 1.00 0.00 C ATOM 824 O PRO S 507 -5.794 2.774 -1.437 1.00 0.00 O ATOM 825 CB PRO S 507 -4.509 5.081 -0.071 1.00 0.00 C ATOM 826 CG PRO S 507 -3.934 5.226 -1.441 1.00 0.00 C ATOM 827 CD PRO S 507 -2.844 4.189 -1.566 1.00 0.00 C ATOM 0 HA PRO S 507 -4.287 3.400 1.336 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.562 5.361 -0.051 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -3.995 5.722 0.645 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.701 5.075 -2.201 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.533 6.229 -1.588 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.913 3.650 -2.511 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.854 4.644 -1.530 1.00 0.00 H new ATOM 835 N LYS S 508 -6.120 2.041 0.667 1.00 0.00 N ATOM 836 CA LYS S 508 -7.244 1.177 0.331 1.00 0.00 C ATOM 837 C LYS S 508 -8.300 1.905 -0.503 1.00 0.00 C ATOM 838 O LYS S 508 -9.038 1.277 -1.262 1.00 0.00 O ATOM 839 CB LYS S 508 -7.873 0.636 1.614 1.00 0.00 C ATOM 840 CG LYS S 508 -8.498 -0.736 1.450 1.00 0.00 C ATOM 841 CD LYS S 508 -9.984 -0.719 1.771 1.00 0.00 C ATOM 842 CE LYS S 508 -10.466 -2.081 2.245 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.138 -2.320 3.677 1.00 0.00 N ATOM 0 H LYS S 508 -5.870 2.032 1.656 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.863 0.354 -0.274 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.110 0.588 2.391 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.635 1.335 1.958 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -8.351 -1.083 0.427 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -7.993 -1.447 2.104 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.183 0.027 2.541 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.545 -0.421 0.886 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -11.544 -2.154 2.103 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -10.010 -2.860 1.634 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -10.484 -3.259 3.960 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -9.107 -2.276 3.809 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -10.594 -1.592 4.264 1.00 0.00 H new ATOM 857 N VAL S 509 -8.372 3.225 -0.366 1.00 0.00 N ATOM 858 CA VAL S 509 -9.345 4.010 -1.123 1.00 0.00 C ATOM 859 C VAL S 509 -9.173 3.780 -2.626 1.00 0.00 C ATOM 860 O VAL S 509 -10.108 3.976 -3.403 1.00 0.00 O ATOM 861 CB VAL S 509 -9.232 5.519 -0.809 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.778 5.957 -0.786 1.00 0.00 C ATOM 863 CG2 VAL S 509 -10.029 6.346 -1.810 1.00 0.00 C ATOM 0 H VAL S 509 -7.775 3.771 0.255 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.336 3.674 -0.819 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.655 5.689 0.181 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.722 7.023 -0.563 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.242 5.398 -0.020 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.325 5.766 -1.759 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.933 7.404 -1.566 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.646 6.169 -2.815 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -11.079 6.058 -1.766 1.00 0.00 H new ATOM 873 N PHE S 510 -7.977 3.359 -3.027 1.00 0.00 N ATOM 874 CA PHE S 510 -7.688 3.096 -4.434 1.00 0.00 C ATOM 875 C PHE S 510 -7.905 1.628 -4.772 1.00 0.00 C ATOM 876 O PHE S 510 -7.483 1.162 -5.830 1.00 0.00 O ATOM 877 CB PHE S 510 -6.246 3.481 -4.761 1.00 0.00 C ATOM 878 CG PHE S 510 -6.041 4.958 -4.883 1.00 0.00 C ATOM 879 CD1 PHE S 510 -6.351 5.795 -3.830 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.546 5.507 -6.053 1.00 0.00 C ATOM 881 CE1 PHE S 510 -6.178 7.156 -3.939 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.368 6.870 -6.169 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.688 7.695 -5.108 1.00 0.00 C ATOM 0 H PHE S 510 -7.192 3.192 -2.398 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.371 3.699 -5.032 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.588 3.093 -3.983 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.952 3.002 -5.695 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.734 5.377 -2.910 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.297 4.862 -6.883 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -6.426 7.801 -3.109 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -4.980 7.290 -7.085 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.554 8.763 -5.195 1.00 0.00 H new ATOM 893 N VAL S 511 -8.552 0.898 -3.870 1.00 0.00 N ATOM 894 CA VAL S 511 -8.801 -0.518 -4.077 1.00 0.00 C ATOM 895 C VAL S 511 -9.996 -0.993 -3.250 1.00 0.00 C ATOM 896 O VAL S 511 -9.841 -1.573 -2.177 1.00 0.00 O ATOM 897 CB VAL S 511 -7.562 -1.354 -3.702 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.329 -0.870 -4.447 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.324 -1.287 -2.213 1.00 0.00 C ATOM 0 H VAL S 511 -8.912 1.266 -2.990 1.00 0.00 H new ATOM 0 HA VAL S 511 -9.022 -0.657 -5.135 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.750 -2.388 -3.991 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.470 -1.478 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.495 -0.956 -5.521 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.136 0.172 -4.193 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.446 -1.881 -1.958 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.160 -0.251 -1.917 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.194 -1.681 -1.687 1.00 0.00 H new ATOM 909 N GLU S 512 -11.189 -0.750 -3.761 1.00 0.00 N ATOM 910 CA GLU S 512 -12.416 -1.158 -3.077 1.00 0.00 C ATOM 911 C GLU S 512 -12.512 -2.682 -2.944 1.00 0.00 C ATOM 912 O GLU S 512 -13.552 -3.216 -2.554 1.00 0.00 O ATOM 913 CB GLU S 512 -13.643 -0.616 -3.812 1.00 0.00 C ATOM 914 CG GLU S 512 -13.865 -1.246 -5.178 1.00 0.00 C ATOM 915 CD GLU S 512 -15.194 -0.852 -5.793 1.00 0.00 C ATOM 916 OE1 GLU S 512 -16.097 -0.437 -5.037 1.00 0.00 O ATOM 917 OE2 GLU S 512 -15.330 -0.959 -7.030 1.00 0.00 O ATOM 0 H GLU S 512 -11.341 -0.272 -4.649 1.00 0.00 H new ATOM 0 HA GLU S 512 -12.386 -0.737 -2.072 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -14.527 -0.783 -3.197 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -13.537 0.462 -3.932 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -13.057 -0.949 -5.847 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -13.819 -2.331 -5.085 1.00 0.00 H new ATOM 986 N LYS P 360 -11.398 7.353 -15.361 1.00 0.00 N ATOM 987 CA LYS P 360 -11.851 7.767 -14.038 1.00 0.00 C ATOM 988 C LYS P 360 -10.810 8.642 -13.349 1.00 0.00 C ATOM 989 O LYS P 360 -9.617 8.343 -13.373 1.00 0.00 O ATOM 990 CB LYS P 360 -12.153 6.545 -13.167 1.00 0.00 C ATOM 991 CG LYS P 360 -13.593 6.064 -13.263 1.00 0.00 C ATOM 992 CD LYS P 360 -14.153 5.715 -11.892 1.00 0.00 C ATOM 993 CE LYS P 360 -15.673 5.671 -11.907 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.185 4.370 -12.421 1.00 0.00 N ATOM 0 HA LYS P 360 -12.763 8.349 -14.168 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.488 5.731 -13.456 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -11.929 6.787 -12.128 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.207 6.838 -13.722 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.644 5.190 -13.912 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.763 4.748 -11.574 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -13.816 6.451 -11.162 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.051 5.837 -10.898 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.054 6.482 -12.528 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.225 4.380 -12.416 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.845 4.223 -13.393 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.843 3.598 -11.814 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.257 9.740 -12.719 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.384 10.671 -12.011 1.00 0.00 C ATOM 1010 C PRO P 361 -10.066 10.182 -10.605 1.00 0.00 C ATOM 1011 O PRO P 361 -10.864 10.353 -9.684 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.215 11.968 -11.960 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.500 11.660 -12.674 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.650 10.176 -12.635 1.00 0.00 C ATOM 0 HA PRO P 361 -9.418 10.793 -12.502 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.403 12.271 -10.930 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.687 12.790 -12.443 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.343 12.150 -12.187 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.471 12.022 -13.702 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.132 9.836 -11.718 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.248 9.802 -13.466 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.902 9.554 -10.447 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.489 9.024 -9.150 1.00 0.00 C ATOM 1024 C GLN P 362 -8.717 10.031 -8.030 1.00 0.00 C ATOM 1025 O GLN P 362 -8.777 11.239 -8.260 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.010 8.627 -9.165 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.065 9.799 -9.373 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.982 10.232 -10.824 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -5.550 9.467 -11.689 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -6.397 11.462 -11.100 1.00 0.00 N ATOM 0 H GLN P 362 -8.230 9.400 -11.199 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.103 8.143 -8.963 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.765 8.137 -8.223 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.847 7.896 -9.957 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.397 10.641 -8.765 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.070 9.525 -9.022 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -6.747 12.062 -10.353 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -6.366 11.808 -12.059 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.835 9.528 -6.798 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.043 10.360 -5.623 1.00 0.00 C ATOM 1041 C PRO P 363 -7.768 11.053 -5.166 1.00 0.00 C ATOM 1042 O PRO P 363 -6.670 10.540 -5.362 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.499 9.376 -4.542 1.00 0.00 C ATOM 1044 CG PRO P 363 -9.196 7.998 -5.043 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.762 8.096 -6.476 1.00 0.00 C ATOM 0 HA PRO P 363 -9.759 11.155 -5.831 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.979 9.567 -3.603 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.565 9.488 -4.344 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -8.412 7.540 -4.440 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -10.077 7.362 -4.957 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.750 7.713 -6.609 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.413 7.511 -7.126 1.00 0.00 H new ATOM 1053 N ALA P 364 -7.919 12.204 -4.522 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.769 12.925 -4.004 1.00 0.00 C ATOM 1055 C ALA P 364 -6.160 12.109 -2.874 1.00 0.00 C ATOM 1056 O ALA P 364 -6.729 12.026 -1.785 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.172 14.308 -3.519 1.00 0.00 C ATOM 0 H ALA P 364 -8.818 12.653 -4.348 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.032 13.063 -4.796 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.295 14.829 -3.136 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.597 14.874 -4.347 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -7.913 14.214 -2.726 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.025 11.472 -3.141 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.389 10.627 -2.134 1.00 0.00 C ATOM 1065 C VAL P 365 -4.262 11.355 -0.796 1.00 0.00 C ATOM 1066 O VAL P 365 -3.872 12.522 -0.742 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.006 10.094 -2.570 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.736 8.759 -1.905 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.918 9.934 -4.078 1.00 0.00 C ATOM 0 H VAL P 365 -4.532 11.522 -4.032 1.00 0.00 H new ATOM 0 HA VAL P 365 -5.047 9.766 -2.017 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.257 10.823 -2.261 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.759 8.388 -2.216 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.749 8.883 -0.822 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.505 8.045 -2.198 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.931 9.557 -4.347 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.679 9.230 -4.414 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.080 10.900 -4.556 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.622 10.667 0.302 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.586 11.234 1.659 1.00 0.00 C ATOM 1081 C PRO P 366 -3.176 11.333 2.238 1.00 0.00 C ATOM 1082 O PRO P 366 -2.213 10.849 1.644 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.421 10.239 2.466 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.252 8.942 1.755 1.00 0.00 C ATOM 1085 CD PRO P 366 -5.119 9.278 0.297 1.00 0.00 C ATOM 0 HA PRO P 366 -4.958 12.258 1.675 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.073 10.174 3.497 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.469 10.538 2.501 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.369 8.413 2.115 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.108 8.289 1.928 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.424 8.606 -0.207 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -6.074 9.196 -0.221 1.00 0.00 H new ATOM 1093 N PRO P 367 -3.044 11.960 3.425 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.753 12.120 4.108 1.00 0.00 C ATOM 1095 C PRO P 367 -1.209 10.789 4.605 1.00 0.00 C ATOM 1096 O PRO P 367 -1.447 10.388 5.745 1.00 0.00 O ATOM 1097 CB PRO P 367 -2.086 13.029 5.285 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.512 12.736 5.559 1.00 0.00 C ATOM 1099 CD PRO P 367 -4.142 12.556 4.209 1.00 0.00 C ATOM 0 HA PRO P 367 -0.984 12.523 3.449 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.459 12.812 6.149 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.933 14.079 5.036 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.620 11.838 6.167 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -3.983 13.551 6.108 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -5.013 11.902 4.251 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.475 13.504 3.786 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.491 10.118 3.727 1.00 0.00 N ATOM 1108 CA ARG P 368 0.105 8.818 4.014 1.00 0.00 C ATOM 1109 C ARG P 368 0.677 8.736 5.434 1.00 0.00 C ATOM 1110 O ARG P 368 1.398 9.631 5.875 1.00 0.00 O ATOM 1111 CB ARG P 368 1.200 8.533 2.987 1.00 0.00 C ATOM 1112 CG ARG P 368 1.723 7.110 3.017 1.00 0.00 C ATOM 1113 CD ARG P 368 2.926 6.978 3.936 1.00 0.00 C ATOM 1114 NE ARG P 368 4.034 7.830 3.511 1.00 0.00 N ATOM 1115 CZ ARG P 368 5.022 8.220 4.313 1.00 0.00 C ATOM 1116 NH1 ARG P 368 5.044 7.841 5.585 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.989 8.996 3.844 1.00 0.00 N ATOM 0 H ARG P 368 -0.300 10.458 2.785 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.681 8.066 3.948 1.00 0.00 H new ATOM 0 HB2 ARG P 368 0.812 8.745 1.991 1.00 0.00 H new ATOM 0 HB3 ARG P 368 2.031 9.218 3.158 1.00 0.00 H new ATOM 0 HG2 ARG P 368 0.933 6.438 3.352 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.999 6.801 2.009 1.00 0.00 H new ATOM 0 HD2 ARG P 368 2.636 7.241 4.953 1.00 0.00 H new ATOM 0 HD3 ARG P 368 3.255 5.939 3.957 1.00 0.00 H new ATOM 0 HE ARG P 368 4.052 8.145 2.541 1.00 0.00 H new ATOM 0 HH11 ARG P 368 4.301 7.247 5.953 1.00 0.00 H new ATOM 0 HH12 ARG P 368 5.804 8.143 6.194 1.00 0.00 H new ATOM 0 HH21 ARG P 368 5.976 9.294 2.869 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.746 9.295 4.459 1.00 0.00 H new ATOM 1131 N PRO P 369 0.345 7.641 6.155 1.00 0.00 N ATOM 1132 CA PRO P 369 0.783 7.357 7.520 1.00 0.00 C ATOM 1133 C PRO P 369 2.082 8.052 7.923 1.00 0.00 C ATOM 1134 O PRO P 369 2.889 8.435 7.077 1.00 0.00 O ATOM 1135 CB PRO P 369 0.981 5.845 7.459 1.00 0.00 C ATOM 1136 CG PRO P 369 0.019 5.353 6.411 1.00 0.00 C ATOM 1137 CD PRO P 369 -0.513 6.554 5.687 1.00 0.00 C ATOM 0 HA PRO P 369 0.071 7.714 8.263 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.009 5.595 7.196 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.778 5.384 8.425 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.520 4.678 5.717 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.794 4.791 6.871 1.00 0.00 H new ATOM 0 HD2 PRO P 369 -0.451 6.431 4.606 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -1.560 6.737 5.928 1.00 0.00 H new ATOM 1145 N SER P 370 2.279 8.200 9.231 1.00 0.00 N ATOM 1146 CA SER P 370 3.477 8.844 9.763 1.00 0.00 C ATOM 1147 C SER P 370 4.683 7.906 9.746 1.00 0.00 C ATOM 1148 O SER P 370 5.581 8.028 10.580 1.00 0.00 O ATOM 1149 CB SER P 370 3.221 9.334 11.190 1.00 0.00 C ATOM 1150 OG SER P 370 2.499 8.371 11.937 1.00 0.00 O ATOM 0 H SER P 370 1.622 7.882 9.944 1.00 0.00 H new ATOM 0 HA SER P 370 3.706 9.693 9.119 1.00 0.00 H new ATOM 0 HB2 SER P 370 4.171 9.543 11.682 1.00 0.00 H new ATOM 0 HB3 SER P 370 2.663 10.270 11.162 1.00 0.00 H new ATOM 0 HG SER P 370 3.002 7.530 11.960 1.00 0.00 H new ATOM 1156 N ALA P 371 4.710 6.981 8.787 1.00 0.00 N ATOM 1157 CA ALA P 371 5.813 6.036 8.652 1.00 0.00 C ATOM 1158 C ALA P 371 5.867 5.040 9.810 1.00 0.00 C ATOM 1159 O ALA P 371 5.769 3.834 9.604 1.00 0.00 O ATOM 1160 CB ALA P 371 7.136 6.784 8.533 1.00 0.00 C ATOM 0 H ALA P 371 3.975 6.868 8.089 1.00 0.00 H new ATOM 0 HA ALA P 371 5.640 5.462 7.742 1.00 0.00 H new ATOM 0 HB1 ALA P 371 7.951 6.068 8.433 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.111 7.430 7.656 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.293 7.390 9.425 1.00 0.00 H new ATOM 1166 N ASP P 372 6.050 5.539 11.023 1.00 0.00 N ATOM 1167 CA ASP P 372 6.138 4.673 12.198 1.00 0.00 C ATOM 1168 C ASP P 372 5.042 3.612 12.216 1.00 0.00 C ATOM 1169 O ASP P 372 5.348 2.420 12.206 1.00 0.00 O ATOM 1170 CB ASP P 372 6.095 5.501 13.484 1.00 0.00 C ATOM 1171 CG ASP P 372 5.015 6.564 13.454 1.00 0.00 C ATOM 1172 OD1 ASP P 372 3.836 6.221 13.685 1.00 0.00 O ATOM 1173 OD2 ASP P 372 5.348 7.742 13.200 1.00 0.00 O ATOM 0 H ASP P 372 6.141 6.535 11.223 1.00 0.00 H new ATOM 0 HA ASP P 372 7.095 4.154 12.140 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.925 4.839 14.333 1.00 0.00 H new ATOM 0 HB3 ASP P 372 7.064 5.976 13.639 1.00 0.00 H new ATOM 1178 N LEU P 373 3.765 4.013 12.238 1.00 0.00 N ATOM 1179 CA LEU P 373 2.702 3.010 12.249 1.00 0.00 C ATOM 1180 C LEU P 373 2.891 2.060 11.076 1.00 0.00 C ATOM 1181 O LEU P 373 2.535 0.885 11.152 1.00 0.00 O ATOM 1182 CB LEU P 373 1.288 3.625 12.287 1.00 0.00 C ATOM 1183 CG LEU P 373 0.771 4.342 11.031 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.884 3.474 9.791 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.681 4.734 11.238 1.00 0.00 C ATOM 0 H LEU P 373 3.454 4.984 12.248 1.00 0.00 H new ATOM 0 HA LEU P 373 2.782 2.443 13.177 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.585 2.827 12.527 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.257 4.336 13.112 1.00 0.00 H new ATOM 0 HG LEU P 373 1.389 5.226 10.876 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.507 4.022 8.928 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.929 3.210 9.625 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.298 2.565 9.928 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -1.051 5.243 10.348 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.277 3.840 11.418 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.759 5.401 12.096 1.00 0.00 H new ATOM 1197 N ILE P 374 3.524 2.561 10.011 1.00 0.00 N ATOM 1198 CA ILE P 374 3.826 1.726 8.861 1.00 0.00 C ATOM 1199 C ILE P 374 4.882 0.737 9.306 1.00 0.00 C ATOM 1200 O ILE P 374 4.757 -0.471 9.121 1.00 0.00 O ATOM 1201 CB ILE P 374 4.372 2.539 7.665 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.343 3.567 7.194 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.772 1.608 6.535 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.807 4.395 6.015 1.00 0.00 C ATOM 0 H ILE P 374 3.831 3.530 9.928 1.00 0.00 H new ATOM 0 HA ILE P 374 2.911 1.240 8.522 1.00 0.00 H new ATOM 0 HB ILE P 374 5.259 3.082 7.989 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.423 3.049 6.924 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.102 4.233 8.022 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.155 2.194 5.699 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.546 0.924 6.884 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.903 1.036 6.210 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.025 5.102 5.737 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.710 4.941 6.287 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.020 3.739 5.171 1.00 0.00 H new ATOM 1216 N LEU P 375 5.900 1.287 9.955 1.00 0.00 N ATOM 1217 CA LEU P 375 6.982 0.498 10.509 1.00 0.00 C ATOM 1218 C LEU P 375 6.418 -0.481 11.530 1.00 0.00 C ATOM 1219 O LEU P 375 7.025 -1.507 11.838 1.00 0.00 O ATOM 1220 CB LEU P 375 8.009 1.441 11.146 1.00 0.00 C ATOM 1221 CG LEU P 375 8.679 2.395 10.155 1.00 0.00 C ATOM 1222 CD1 LEU P 375 8.932 3.751 10.795 1.00 0.00 C ATOM 1223 CD2 LEU P 375 9.983 1.810 9.631 1.00 0.00 C ATOM 0 H LEU P 375 5.995 2.291 10.110 1.00 0.00 H new ATOM 0 HA LEU P 375 7.479 -0.076 9.727 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.516 2.027 11.922 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.778 0.845 11.637 1.00 0.00 H new ATOM 0 HG LEU P 375 7.999 2.530 9.314 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.409 4.412 10.071 1.00 0.00 H new ATOM 0 HD12 LEU P 375 7.984 4.185 11.114 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.584 3.629 11.660 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.439 2.508 8.929 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.664 1.636 10.464 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.781 0.866 9.125 1.00 0.00 H new ATOM 1235 N ASN P 376 5.234 -0.149 12.030 1.00 0.00 N ATOM 1236 CA ASN P 376 4.532 -0.972 12.995 1.00 0.00 C ATOM 1237 C ASN P 376 3.621 -1.971 12.286 1.00 0.00 C ATOM 1238 O ASN P 376 3.262 -3.005 12.851 1.00 0.00 O ATOM 1239 CB ASN P 376 3.695 -0.078 13.913 1.00 0.00 C ATOM 1240 CG ASN P 376 3.835 -0.453 15.375 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.615 0.152 16.111 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.078 -1.456 15.805 1.00 0.00 N ATOM 0 H ASN P 376 4.735 0.703 11.774 1.00 0.00 H new ATOM 0 HA ASN P 376 5.264 -1.524 13.584 1.00 0.00 H new ATOM 0 HB2 ASN P 376 3.997 0.960 13.777 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.646 -0.145 13.623 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.130 -1.752 16.780 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.445 -1.930 15.161 1.00 0.00 H new ATOM 1249 N ARG P 377 3.220 -1.641 11.056 1.00 0.00 N ATOM 1250 CA ARG P 377 2.318 -2.498 10.293 1.00 0.00 C ATOM 1251 C ARG P 377 2.788 -2.711 8.846 1.00 0.00 C ATOM 1252 O ARG P 377 2.005 -2.554 7.911 1.00 0.00 O ATOM 1253 CB ARG P 377 0.905 -1.895 10.293 1.00 0.00 C ATOM 1254 CG ARG P 377 0.491 -1.270 11.624 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.171 0.090 11.430 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.625 0.008 11.541 1.00 0.00 N ATOM 1257 CZ ARG P 377 -2.285 0.027 12.698 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.624 0.119 13.846 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -3.608 -0.050 12.708 1.00 0.00 N ATOM 0 H ARG P 377 3.506 -0.790 10.571 1.00 0.00 H new ATOM 0 HA ARG P 377 2.313 -3.474 10.779 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.846 -1.135 9.514 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.189 -2.675 10.032 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.197 -1.939 12.141 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.368 -1.160 12.262 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.211 0.789 12.174 1.00 0.00 H new ATOM 0 HD3 ARG P 377 0.097 0.488 10.451 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.168 -0.068 10.681 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -0.606 0.176 13.845 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.135 0.133 14.729 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -4.121 -0.124 11.830 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -4.113 -0.035 13.594 1.00 0.00 H new ATOM 1273 N CYS P 378 4.053 -3.090 8.660 1.00 0.00 N ATOM 1274 CA CYS P 378 4.581 -3.341 7.315 1.00 0.00 C ATOM 1275 C CYS P 378 5.873 -4.152 7.361 1.00 0.00 C ATOM 1276 O CYS P 378 6.349 -4.530 8.431 1.00 0.00 O ATOM 1277 CB CYS P 378 4.828 -2.034 6.554 1.00 0.00 C ATOM 1278 SG CYS P 378 3.411 -1.461 5.589 1.00 0.00 S ATOM 0 H CYS P 378 4.726 -3.229 9.414 1.00 0.00 H new ATOM 0 HA CYS P 378 3.822 -3.918 6.787 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.106 -1.258 7.267 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.678 -2.171 5.885 1.00 0.00 H new ATOM 0 HG CYS P 378 2.330 -2.042 6.018 1.00 0.00 H new ATOM 1284 N SER P 379 6.433 -4.410 6.181 1.00 0.00 N ATOM 1285 CA SER P 379 7.672 -5.174 6.065 1.00 0.00 C ATOM 1286 C SER P 379 8.886 -4.258 6.181 1.00 0.00 C ATOM 1287 O SER P 379 8.768 -3.037 6.079 1.00 0.00 O ATOM 1288 CB SER P 379 7.709 -5.921 4.728 1.00 0.00 C ATOM 1289 OG SER P 379 7.345 -7.281 4.895 1.00 0.00 O ATOM 0 H SER P 379 6.047 -4.100 5.289 1.00 0.00 H new ATOM 0 HA SER P 379 7.704 -5.897 6.880 1.00 0.00 H new ATOM 0 HB2 SER P 379 7.030 -5.443 4.022 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.710 -5.859 4.300 1.00 0.00 H new ATOM 0 HG SER P 379 6.391 -7.391 4.698 1.00 0.00 H new ATOM 1295 N GLU P 380 10.054 -4.856 6.394 1.00 0.00 N ATOM 1296 CA GLU P 380 11.290 -4.094 6.523 1.00 0.00 C ATOM 1297 C GLU P 380 11.590 -3.319 5.245 1.00 0.00 C ATOM 1298 O GLU P 380 12.151 -2.225 5.289 1.00 0.00 O ATOM 1299 CB GLU P 380 12.457 -5.027 6.853 1.00 0.00 C ATOM 1300 CG GLU P 380 12.700 -5.195 8.345 1.00 0.00 C ATOM 1301 CD GLU P 380 13.892 -4.395 8.835 1.00 0.00 C ATOM 1302 OE1 GLU P 380 14.907 -4.338 8.109 1.00 0.00 O ATOM 1303 OE2 GLU P 380 13.810 -3.826 9.943 1.00 0.00 O ATOM 0 H GLU P 380 10.170 -5.866 6.481 1.00 0.00 H new ATOM 0 HA GLU P 380 11.162 -3.380 7.337 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.265 -6.005 6.412 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.363 -4.640 6.387 1.00 0.00 H new ATOM 0 HG2 GLU P 380 11.809 -4.885 8.892 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.859 -6.250 8.567 1.00 0.00 H new ATOM 1310 N SER P 381 11.208 -3.890 4.106 1.00 0.00 N ATOM 1311 CA SER P 381 11.435 -3.248 2.816 1.00 0.00 C ATOM 1312 C SER P 381 10.801 -1.862 2.782 1.00 0.00 C ATOM 1313 O SER P 381 11.499 -0.852 2.703 1.00 0.00 O ATOM 1314 CB SER P 381 10.871 -4.111 1.684 1.00 0.00 C ATOM 1315 OG SER P 381 10.637 -5.438 2.123 1.00 0.00 O ATOM 0 H SER P 381 10.740 -4.795 4.051 1.00 0.00 H new ATOM 0 HA SER P 381 12.510 -3.140 2.676 1.00 0.00 H new ATOM 0 HB2 SER P 381 9.941 -3.676 1.320 1.00 0.00 H new ATOM 0 HB3 SER P 381 11.569 -4.119 0.847 1.00 0.00 H new ATOM 0 HG SER P 381 11.042 -6.068 1.491 1.00 0.00 H new ATOM 1321 N THR P 382 9.473 -1.821 2.853 1.00 0.00 N ATOM 1322 CA THR P 382 8.748 -0.555 2.841 1.00 0.00 C ATOM 1323 C THR P 382 9.187 0.317 4.013 1.00 0.00 C ATOM 1324 O THR P 382 9.165 1.545 3.932 1.00 0.00 O ATOM 1325 CB THR P 382 7.237 -0.805 2.909 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.774 -1.393 1.707 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.422 0.451 3.144 1.00 0.00 C ATOM 0 H THR P 382 8.879 -2.648 2.919 1.00 0.00 H new ATOM 0 HA THR P 382 8.976 -0.035 1.911 1.00 0.00 H new ATOM 0 HB THR P 382 7.097 -1.470 3.761 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.913 -1.833 1.868 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.363 0.196 3.180 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.718 0.905 4.089 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.598 1.156 2.332 1.00 0.00 H new ATOM 1335 N LYS P 383 9.584 -0.331 5.101 1.00 0.00 N ATOM 1336 CA LYS P 383 10.029 0.372 6.296 1.00 0.00 C ATOM 1337 C LYS P 383 11.301 1.170 6.025 1.00 0.00 C ATOM 1338 O LYS P 383 11.396 2.345 6.375 1.00 0.00 O ATOM 1339 CB LYS P 383 10.275 -0.625 7.428 1.00 0.00 C ATOM 1340 CG LYS P 383 9.050 -0.877 8.286 1.00 0.00 C ATOM 1341 CD LYS P 383 9.057 -2.272 8.887 1.00 0.00 C ATOM 1342 CE LYS P 383 9.832 -2.309 10.194 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.069 -3.702 10.661 1.00 0.00 N ATOM 0 H LYS P 383 9.607 -1.348 5.180 1.00 0.00 H new ATOM 0 HA LYS P 383 9.244 1.069 6.589 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.612 -1.570 7.003 1.00 0.00 H new ATOM 0 HB3 LYS P 383 11.082 -0.254 8.060 1.00 0.00 H new ATOM 0 HG2 LYS P 383 9.008 -0.137 9.086 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.151 -0.746 7.683 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.032 -2.600 9.061 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.500 -2.972 8.179 1.00 0.00 H new ATOM 0 HE2 LYS P 383 10.788 -1.803 10.063 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.282 -1.759 10.958 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 9.677 -3.819 11.617 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.605 -4.369 10.012 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.091 -3.892 10.681 1.00 0.00 H new ATOM 1357 N ARG P 384 12.279 0.518 5.401 1.00 0.00 N ATOM 1358 CA ARG P 384 13.552 1.161 5.083 1.00 0.00 C ATOM 1359 C ARG P 384 13.336 2.511 4.407 1.00 0.00 C ATOM 1360 O ARG P 384 14.112 3.446 4.603 1.00 0.00 O ATOM 1361 CB ARG P 384 14.392 0.254 4.180 1.00 0.00 C ATOM 1362 CG ARG P 384 15.056 -0.894 4.920 1.00 0.00 C ATOM 1363 CD ARG P 384 16.454 -1.167 4.387 1.00 0.00 C ATOM 1364 NE ARG P 384 16.428 -1.989 3.179 1.00 0.00 N ATOM 1365 CZ ARG P 384 17.495 -2.613 2.686 1.00 0.00 C ATOM 1366 NH1 ARG P 384 18.672 -2.512 3.291 1.00 0.00 N ATOM 1367 NH2 ARG P 384 17.387 -3.342 1.583 1.00 0.00 N ATOM 0 H ARG P 384 12.215 -0.456 5.105 1.00 0.00 H new ATOM 0 HA ARG P 384 14.085 1.330 6.019 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.756 -0.151 3.393 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.160 0.853 3.691 1.00 0.00 H new ATOM 0 HG2 ARG P 384 15.110 -0.660 5.983 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.446 -1.792 4.822 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.951 -0.221 4.171 1.00 0.00 H new ATOM 0 HD3 ARG P 384 17.043 -1.669 5.155 1.00 0.00 H new ATOM 0 HE ARG P 384 15.541 -2.090 2.685 1.00 0.00 H new ATOM 0 HH11 ARG P 384 18.763 -1.953 4.140 1.00 0.00 H new ATOM 0 HH12 ARG P 384 19.486 -2.993 2.907 1.00 0.00 H new ATOM 0 HH21 ARG P 384 16.486 -3.424 1.112 1.00 0.00 H new ATOM 0 HH22 ARG P 384 18.205 -3.820 1.206 1.00 0.00 H new ATOM 1381 N LYS P 385 12.276 2.606 3.614 1.00 0.00 N ATOM 1382 CA LYS P 385 11.956 3.842 2.911 1.00 0.00 C ATOM 1383 C LYS P 385 11.567 4.943 3.894 1.00 0.00 C ATOM 1384 O LYS P 385 11.741 6.129 3.614 1.00 0.00 O ATOM 1385 CB LYS P 385 10.825 3.603 1.910 1.00 0.00 C ATOM 1386 CG LYS P 385 11.241 2.751 0.721 1.00 0.00 C ATOM 1387 CD LYS P 385 10.329 1.547 0.543 1.00 0.00 C ATOM 1388 CE LYS P 385 9.945 1.349 -0.916 1.00 0.00 C ATOM 1389 NZ LYS P 385 8.497 1.034 -1.072 1.00 0.00 N ATOM 0 H LYS P 385 11.623 1.842 3.442 1.00 0.00 H new ATOM 0 HA LYS P 385 12.845 4.167 2.370 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.993 3.118 2.422 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.460 4.565 1.549 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.224 3.357 -0.185 1.00 0.00 H new ATOM 0 HG3 LYS P 385 12.268 2.412 0.858 1.00 0.00 H new ATOM 0 HD2 LYS P 385 10.830 0.652 0.913 1.00 0.00 H new ATOM 0 HD3 LYS P 385 9.428 1.680 1.143 1.00 0.00 H new ATOM 0 HE2 LYS P 385 10.183 2.251 -1.480 1.00 0.00 H new ATOM 0 HE3 LYS P 385 10.540 0.541 -1.342 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 8.388 0.183 -1.660 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 8.076 0.865 -0.136 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 8.015 1.834 -1.529 1.00 0.00 H new ATOM 1403 N LEU P 386 11.048 4.541 5.051 1.00 0.00 N ATOM 1404 CA LEU P 386 10.644 5.493 6.081 1.00 0.00 C ATOM 1405 C LEU P 386 11.451 5.282 7.357 1.00 0.00 C ATOM 1406 O LEU P 386 12.360 4.453 7.398 1.00 0.00 O ATOM 1407 CB LEU P 386 9.146 5.363 6.385 1.00 0.00 C ATOM 1408 CG LEU P 386 8.555 3.965 6.187 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.511 3.672 7.248 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.942 3.836 4.802 1.00 0.00 C ATOM 0 H LEU P 386 10.897 3.563 5.299 1.00 0.00 H new ATOM 0 HA LEU P 386 10.839 6.497 5.703 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.974 5.669 7.417 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.602 6.062 5.750 1.00 0.00 H new ATOM 0 HG LEU P 386 9.362 3.238 6.281 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.102 2.674 7.091 1.00 0.00 H new ATOM 0 HD12 LEU P 386 7.971 3.724 8.235 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.709 4.407 7.182 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.527 2.836 4.680 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.149 4.575 4.685 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.710 4.005 4.047 1.00 0.00 H new