USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=12 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 499 SER OG : rot 180:sc= -0.919 USER MOD Set 1.2: S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: S 471 THR OG1 : rot 50:sc= 1.23 USER MOD Set 2.2: S 472 GLN : amide:sc= 0.431 K(o=1.7,f=-4.4!) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.843 K(o=-0.84,f=-1.4) USER MOD Single : P 370 SER OG : rot -49:sc= 0.246 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : P 378 CYS SG : rot 9:sc= -10.3! USER MOD Single : P 379 SER OG : rot 180:sc= -0.443 USER MOD Single : P 381 SER OG : rot 150:sc= -0.796 USER MOD Single : P 382 THR OG1 : rot 167:sc= -5.98! USER MOD Single : P 383 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0263) USER MOD Single : P 385 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 460 SER OG : rot 25:sc= 0.346 USER MOD Single : S 461 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 467 SER OG : rot 180:sc= 0 USER MOD Single : S 468 TYR OH : rot -99:sc= -0.155 USER MOD Single : S 479 GLN : amide:sc= 0 X(o=0,f=-0.042) 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= -6.4! C(o=-6.4!,f=-13!) USER MOD Single : S 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.785 -9.667 2.656 1.00 0.00 N ATOM 91 CA SER S 460 -5.119 -9.503 2.088 1.00 0.00 C ATOM 92 C SER S 460 -5.003 -9.072 0.631 1.00 0.00 C ATOM 93 O SER S 460 -3.898 -8.966 0.101 1.00 0.00 O ATOM 94 CB SER S 460 -5.918 -8.467 2.881 1.00 0.00 C ATOM 95 OG SER S 460 -5.683 -8.594 4.273 1.00 0.00 O ATOM 0 HA SER S 460 -5.645 -10.456 2.143 1.00 0.00 H new ATOM 0 HB2 SER S 460 -5.644 -7.464 2.553 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.982 -8.590 2.676 1.00 0.00 H new ATOM 0 HG SER S 460 -4.809 -9.013 4.420 1.00 0.00 H new ATOM 101 N GLN S 461 -6.133 -8.822 -0.024 1.00 0.00 N ATOM 102 CA GLN S 461 -6.101 -8.405 -1.422 1.00 0.00 C ATOM 103 C GLN S 461 -7.351 -7.630 -1.823 1.00 0.00 C ATOM 104 O GLN S 461 -8.444 -7.869 -1.309 1.00 0.00 O ATOM 105 CB GLN S 461 -5.946 -9.620 -2.340 1.00 0.00 C ATOM 106 CG GLN S 461 -4.791 -10.531 -1.969 1.00 0.00 C ATOM 107 CD GLN S 461 -4.620 -11.682 -2.940 1.00 0.00 C ATOM 108 OE1 GLN S 461 -5.485 -12.549 -3.052 1.00 0.00 O ATOM 109 NE2 GLN S 461 -3.498 -11.694 -3.652 1.00 0.00 N ATOM 0 H GLN S 461 -7.066 -8.899 0.381 1.00 0.00 H new ATOM 0 HA GLN S 461 -5.242 -7.743 -1.532 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.871 -10.197 -2.321 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.807 -9.273 -3.364 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.870 -9.949 -1.936 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -4.953 -10.927 -0.967 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -2.807 -10.954 -3.527 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -3.328 -12.443 -4.323 1.00 0.00 H new ATOM 118 N VAL S 462 -7.169 -6.710 -2.765 1.00 0.00 N ATOM 119 CA VAL S 462 -8.260 -5.890 -3.279 1.00 0.00 C ATOM 120 C VAL S 462 -7.881 -5.293 -4.628 1.00 0.00 C ATOM 121 O VAL S 462 -6.904 -4.551 -4.730 1.00 0.00 O ATOM 122 CB VAL S 462 -8.626 -4.746 -2.315 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.688 -5.198 -1.324 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.388 -4.234 -1.593 1.00 0.00 C ATOM 0 H VAL S 462 -6.264 -6.512 -3.192 1.00 0.00 H new ATOM 0 HA VAL S 462 -9.126 -6.543 -3.385 1.00 0.00 H new ATOM 0 HB VAL S 462 -9.039 -3.924 -2.899 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.932 -4.375 -0.652 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.584 -5.503 -1.865 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -9.310 -6.040 -0.744 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.669 -3.426 -0.917 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.938 -5.046 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.669 -3.863 -2.323 1.00 0.00 H new ATOM 134 N GLU S 463 -8.648 -5.616 -5.665 1.00 0.00 N ATOM 135 CA GLU S 463 -8.367 -5.096 -6.999 1.00 0.00 C ATOM 136 C GLU S 463 -8.259 -3.572 -6.965 1.00 0.00 C ATOM 137 O GLU S 463 -8.872 -2.919 -6.119 1.00 0.00 O ATOM 138 CB GLU S 463 -9.450 -5.543 -7.989 1.00 0.00 C ATOM 139 CG GLU S 463 -10.620 -4.578 -8.112 1.00 0.00 C ATOM 140 CD GLU S 463 -11.862 -5.235 -8.684 1.00 0.00 C ATOM 141 OE1 GLU S 463 -11.957 -6.479 -8.622 1.00 0.00 O ATOM 142 OE2 GLU S 463 -12.739 -4.505 -9.192 1.00 0.00 O ATOM 0 H GLU S 463 -9.461 -6.229 -5.609 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.412 -5.499 -7.335 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -8.997 -5.674 -8.972 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.828 -6.518 -7.681 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -10.851 -4.166 -7.130 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -10.331 -3.741 -8.748 1.00 0.00 H new ATOM 149 N ALA S 464 -7.481 -3.007 -7.882 1.00 0.00 N ATOM 150 CA ALA S 464 -7.307 -1.564 -7.938 1.00 0.00 C ATOM 151 C ALA S 464 -8.356 -0.930 -8.842 1.00 0.00 C ATOM 152 O ALA S 464 -9.097 -1.631 -9.531 1.00 0.00 O ATOM 153 CB ALA S 464 -5.906 -1.212 -8.416 1.00 0.00 C ATOM 0 H ALA S 464 -6.964 -3.525 -8.592 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.437 -1.165 -6.932 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.795 -0.128 -8.451 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.171 -1.630 -7.728 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.747 -1.626 -9.412 1.00 0.00 H new ATOM 159 N LEU S 465 -8.425 0.393 -8.829 1.00 0.00 N ATOM 160 CA LEU S 465 -9.401 1.107 -9.645 1.00 0.00 C ATOM 161 C LEU S 465 -8.815 2.366 -10.284 1.00 0.00 C ATOM 162 O LEU S 465 -9.473 3.019 -11.095 1.00 0.00 O ATOM 163 CB LEU S 465 -10.611 1.478 -8.792 1.00 0.00 C ATOM 164 CG LEU S 465 -11.227 0.316 -8.009 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.363 -0.040 -6.811 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.643 0.660 -7.572 1.00 0.00 C ATOM 0 H LEU S 465 -7.821 0.993 -8.267 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.701 0.440 -10.454 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.316 2.256 -8.088 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.376 1.907 -9.439 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.274 -0.555 -8.663 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.818 -0.868 -6.268 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.370 -0.332 -7.153 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.280 0.824 -6.152 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.066 -0.177 -7.017 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.623 1.544 -6.935 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.257 0.860 -8.451 1.00 0.00 H new ATOM 178 N PHE S 466 -7.584 2.711 -9.920 1.00 0.00 N ATOM 179 CA PHE S 466 -6.936 3.897 -10.466 1.00 0.00 C ATOM 180 C PHE S 466 -5.435 3.703 -10.607 1.00 0.00 C ATOM 181 O PHE S 466 -4.868 2.725 -10.119 1.00 0.00 O ATOM 182 CB PHE S 466 -7.173 5.101 -9.558 1.00 0.00 C ATOM 183 CG PHE S 466 -8.603 5.325 -9.181 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.442 6.042 -10.014 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.100 4.838 -7.983 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.754 6.270 -9.662 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.413 5.066 -7.624 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.238 5.785 -8.466 1.00 0.00 C ATOM 0 H PHE S 466 -7.018 2.188 -9.252 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.371 4.068 -11.450 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.587 4.974 -8.648 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.798 5.995 -10.057 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.065 6.427 -10.950 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.455 4.275 -7.325 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.402 6.828 -10.322 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.794 4.684 -6.688 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.265 5.968 -8.187 1.00 0.00 H new ATOM 198 N SER S 467 -4.797 4.679 -11.240 1.00 0.00 N ATOM 199 CA SER S 467 -3.355 4.670 -11.412 1.00 0.00 C ATOM 200 C SER S 467 -2.745 5.646 -10.419 1.00 0.00 C ATOM 201 O SER S 467 -2.811 6.861 -10.603 1.00 0.00 O ATOM 202 CB SER S 467 -2.976 5.053 -12.843 1.00 0.00 C ATOM 203 OG SER S 467 -3.709 4.293 -13.787 1.00 0.00 O ATOM 0 H SER S 467 -5.262 5.492 -11.645 1.00 0.00 H new ATOM 0 HA SER S 467 -2.971 3.666 -11.229 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.166 6.115 -13.001 1.00 0.00 H new ATOM 0 HB3 SER S 467 -1.908 4.894 -12.994 1.00 0.00 H new ATOM 0 HG SER S 467 -3.449 4.559 -14.694 1.00 0.00 H new ATOM 209 N TYR S 468 -2.189 5.107 -9.347 1.00 0.00 N ATOM 210 CA TYR S 468 -1.607 5.924 -8.295 1.00 0.00 C ATOM 211 C TYR S 468 -0.222 6.429 -8.677 1.00 0.00 C ATOM 212 O TYR S 468 0.700 5.645 -8.899 1.00 0.00 O ATOM 213 CB TYR S 468 -1.535 5.109 -7.001 1.00 0.00 C ATOM 214 CG TYR S 468 -0.972 5.862 -5.818 1.00 0.00 C ATOM 215 CD1 TYR S 468 0.349 6.299 -5.801 1.00 0.00 C ATOM 216 CD2 TYR S 468 -1.762 6.129 -4.711 1.00 0.00 C ATOM 217 CE1 TYR S 468 0.861 6.981 -4.717 1.00 0.00 C ATOM 218 CE2 TYR S 468 -1.258 6.809 -3.623 1.00 0.00 C ATOM 219 CZ TYR S 468 0.054 7.234 -3.629 1.00 0.00 C ATOM 220 OH TYR S 468 0.561 7.913 -2.545 1.00 0.00 O ATOM 0 H TYR S 468 -2.128 4.102 -9.182 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.243 6.797 -8.147 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.537 4.760 -6.750 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -0.923 4.224 -7.177 1.00 0.00 H new ATOM 0 HD1 TYR S 468 0.984 6.101 -6.651 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -2.790 5.799 -4.701 1.00 0.00 H new ATOM 0 HE1 TYR S 468 1.888 7.315 -4.721 1.00 0.00 H new ATOM 0 HE2 TYR S 468 -1.888 7.008 -2.769 1.00 0.00 H new ATOM 0 HH TYR S 468 0.812 7.273 -1.846 1.00 0.00 H new ATOM 230 N GLU S 469 -0.082 7.751 -8.727 1.00 0.00 N ATOM 231 CA GLU S 469 1.192 8.372 -9.055 1.00 0.00 C ATOM 232 C GLU S 469 2.098 8.361 -7.831 1.00 0.00 C ATOM 233 O GLU S 469 1.838 9.055 -6.847 1.00 0.00 O ATOM 234 CB GLU S 469 0.982 9.806 -9.541 1.00 0.00 C ATOM 235 CG GLU S 469 1.916 10.208 -10.670 1.00 0.00 C ATOM 236 CD GLU S 469 1.324 11.279 -11.564 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.769 12.261 -11.028 1.00 0.00 O ATOM 238 OE2 GLU S 469 1.414 11.136 -12.802 1.00 0.00 O ATOM 0 H GLU S 469 -0.838 8.411 -8.544 1.00 0.00 H new ATOM 0 HA GLU S 469 1.663 7.804 -9.857 1.00 0.00 H new ATOM 0 HB2 GLU S 469 -0.049 9.920 -9.875 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.123 10.489 -8.703 1.00 0.00 H new ATOM 0 HG2 GLU S 469 2.854 10.569 -10.249 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.153 9.330 -11.270 1.00 0.00 H new ATOM 245 N ALA S 470 3.149 7.559 -7.892 1.00 0.00 N ATOM 246 CA ALA S 470 4.083 7.440 -6.782 1.00 0.00 C ATOM 247 C ALA S 470 5.205 8.465 -6.884 1.00 0.00 C ATOM 248 O ALA S 470 6.052 8.389 -7.776 1.00 0.00 O ATOM 249 CB ALA S 470 4.647 6.029 -6.726 1.00 0.00 C ATOM 0 H ALA S 470 3.378 6.979 -8.700 1.00 0.00 H new ATOM 0 HA ALA S 470 3.540 7.642 -5.859 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.345 5.949 -5.893 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.833 5.317 -6.588 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.168 5.808 -7.658 1.00 0.00 H new ATOM 255 N THR S 471 5.206 9.420 -5.960 1.00 0.00 N ATOM 256 CA THR S 471 6.225 10.461 -5.935 1.00 0.00 C ATOM 257 C THR S 471 7.295 10.140 -4.898 1.00 0.00 C ATOM 258 O THR S 471 8.456 10.520 -5.052 1.00 0.00 O ATOM 259 CB THR S 471 5.591 11.820 -5.632 1.00 0.00 C ATOM 260 OG1 THR S 471 4.439 11.667 -4.822 1.00 0.00 O ATOM 261 CG2 THR S 471 5.181 12.579 -6.875 1.00 0.00 C ATOM 0 H THR S 471 4.511 9.494 -5.217 1.00 0.00 H new ATOM 0 HA THR S 471 6.695 10.503 -6.918 1.00 0.00 H new ATOM 0 HB THR S 471 6.363 12.390 -5.116 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.652 11.097 -4.054 1.00 0.00 H new ATOM 0 HG21 THR S 471 4.739 13.533 -6.589 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.057 12.757 -7.498 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.451 11.994 -7.434 1.00 0.00 H new ATOM 269 N GLN S 472 6.899 9.431 -3.844 1.00 0.00 N ATOM 270 CA GLN S 472 7.831 9.053 -2.785 1.00 0.00 C ATOM 271 C GLN S 472 8.176 7.567 -2.874 1.00 0.00 C ATOM 272 O GLN S 472 7.573 6.826 -3.651 1.00 0.00 O ATOM 273 CB GLN S 472 7.261 9.390 -1.403 1.00 0.00 C ATOM 274 CG GLN S 472 5.743 9.331 -1.321 1.00 0.00 C ATOM 275 CD GLN S 472 5.086 10.643 -1.704 1.00 0.00 C ATOM 276 OE1 GLN S 472 4.205 10.682 -2.562 1.00 0.00 O ATOM 277 NE2 GLN S 472 5.512 11.727 -1.065 1.00 0.00 N ATOM 0 H GLN S 472 5.942 9.108 -3.700 1.00 0.00 H new ATOM 0 HA GLN S 472 8.746 9.629 -2.923 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.680 8.699 -0.672 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.590 10.390 -1.121 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.378 8.541 -1.977 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.448 9.064 -0.306 1.00 0.00 H new ATOM 0 HE21 GLN S 472 6.245 11.648 -0.360 1.00 0.00 H new ATOM 0 HE22 GLN S 472 5.106 12.638 -1.279 1.00 0.00 H new ATOM 286 N PRO S 473 9.176 7.119 -2.095 1.00 0.00 N ATOM 287 CA PRO S 473 9.633 5.722 -2.102 1.00 0.00 C ATOM 288 C PRO S 473 8.622 4.731 -1.517 1.00 0.00 C ATOM 289 O PRO S 473 8.084 3.889 -2.236 1.00 0.00 O ATOM 290 CB PRO S 473 10.906 5.750 -1.240 1.00 0.00 C ATOM 291 CG PRO S 473 11.260 7.191 -1.092 1.00 0.00 C ATOM 292 CD PRO S 473 9.965 7.942 -1.171 1.00 0.00 C ATOM 0 HA PRO S 473 9.787 5.375 -3.124 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.731 5.288 -0.268 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.714 5.195 -1.717 1.00 0.00 H new ATOM 0 HG2 PRO S 473 11.761 7.375 -0.141 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.944 7.508 -1.879 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.486 8.029 -0.196 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.106 8.955 -1.549 1.00 0.00 H new ATOM 300 N GLU S 474 8.392 4.809 -0.206 1.00 0.00 N ATOM 301 CA GLU S 474 7.473 3.891 0.472 1.00 0.00 C ATOM 302 C GLU S 474 6.160 3.712 -0.293 1.00 0.00 C ATOM 303 O GLU S 474 5.636 2.601 -0.381 1.00 0.00 O ATOM 304 CB GLU S 474 7.190 4.362 1.904 1.00 0.00 C ATOM 305 CG GLU S 474 6.186 5.499 2.000 1.00 0.00 C ATOM 306 CD GLU S 474 6.704 6.789 1.397 1.00 0.00 C ATOM 307 OE1 GLU S 474 6.836 6.851 0.157 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.978 7.735 2.164 1.00 0.00 O ATOM 0 H GLU S 474 8.828 5.497 0.408 1.00 0.00 H new ATOM 0 HA GLU S 474 7.967 2.920 0.507 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.822 3.517 2.486 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.127 4.680 2.362 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.266 5.209 1.493 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.933 5.668 3.047 1.00 0.00 H new ATOM 315 N ASP S 475 5.632 4.800 -0.842 1.00 0.00 N ATOM 316 CA ASP S 475 4.384 4.744 -1.588 1.00 0.00 C ATOM 317 C ASP S 475 4.480 3.770 -2.757 1.00 0.00 C ATOM 318 O ASP S 475 5.296 3.943 -3.661 1.00 0.00 O ATOM 319 CB ASP S 475 4.016 6.137 -2.091 1.00 0.00 C ATOM 320 CG ASP S 475 3.151 6.894 -1.103 1.00 0.00 C ATOM 321 OD1 ASP S 475 1.946 6.576 -1.006 1.00 0.00 O ATOM 322 OD2 ASP S 475 3.675 7.803 -0.427 1.00 0.00 O ATOM 0 H ASP S 475 6.049 5.729 -0.784 1.00 0.00 H new ATOM 0 HA ASP S 475 3.603 4.385 -0.917 1.00 0.00 H new ATOM 0 HB2 ASP S 475 4.927 6.704 -2.283 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.489 6.051 -3.041 1.00 0.00 H new ATOM 327 N LEU S 476 3.632 2.747 -2.729 1.00 0.00 N ATOM 328 CA LEU S 476 3.606 1.742 -3.782 1.00 0.00 C ATOM 329 C LEU S 476 2.836 2.262 -4.992 1.00 0.00 C ATOM 330 O LEU S 476 1.660 2.610 -4.889 1.00 0.00 O ATOM 331 CB LEU S 476 2.968 0.446 -3.257 1.00 0.00 C ATOM 332 CG LEU S 476 2.382 -0.482 -4.325 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.428 -0.818 -5.377 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.835 -1.753 -3.694 1.00 0.00 C ATOM 0 H LEU S 476 2.952 2.593 -1.985 1.00 0.00 H new ATOM 0 HA LEU S 476 4.629 1.529 -4.090 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.721 -0.106 -2.694 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.176 0.710 -2.556 1.00 0.00 H new ATOM 0 HG LEU S 476 1.559 0.040 -4.812 1.00 0.00 H new ATOM 0 HD11 LEU S 476 2.991 -1.478 -6.126 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.770 0.099 -5.856 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.274 -1.316 -4.903 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.424 -2.397 -4.471 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.638 -2.277 -3.176 1.00 0.00 H new ATOM 0 HD23 LEU S 476 1.050 -1.497 -2.982 1.00 0.00 H new ATOM 346 N GLU S 477 3.509 2.315 -6.134 1.00 0.00 N ATOM 347 CA GLU S 477 2.892 2.793 -7.364 1.00 0.00 C ATOM 348 C GLU S 477 2.166 1.659 -8.079 1.00 0.00 C ATOM 349 O GLU S 477 2.641 0.522 -8.097 1.00 0.00 O ATOM 350 CB GLU S 477 3.951 3.384 -8.295 1.00 0.00 C ATOM 351 CG GLU S 477 3.423 4.488 -9.194 1.00 0.00 C ATOM 352 CD GLU S 477 4.530 5.239 -9.907 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.317 4.591 -10.627 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.608 6.475 -9.744 1.00 0.00 O ATOM 0 H GLU S 477 4.484 2.032 -6.234 1.00 0.00 H new ATOM 0 HA GLU S 477 2.170 3.566 -7.101 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.772 3.777 -7.695 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.363 2.588 -8.915 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.747 4.058 -9.933 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.839 5.189 -8.598 1.00 0.00 H new ATOM 361 N PHE S 478 1.021 1.969 -8.671 1.00 0.00 N ATOM 362 CA PHE S 478 0.242 0.964 -9.389 1.00 0.00 C ATOM 363 C PHE S 478 -0.760 1.610 -10.339 1.00 0.00 C ATOM 364 O PHE S 478 -1.079 2.792 -10.214 1.00 0.00 O ATOM 365 CB PHE S 478 -0.488 0.051 -8.402 1.00 0.00 C ATOM 366 CG PHE S 478 -1.205 0.797 -7.316 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.500 1.372 -6.272 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.585 0.923 -7.338 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.156 2.062 -5.271 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.247 1.611 -6.339 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.532 2.181 -5.304 1.00 0.00 C ATOM 0 H PHE S 478 0.611 2.903 -8.670 1.00 0.00 H new ATOM 0 HA PHE S 478 0.936 0.369 -9.982 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.207 -0.560 -8.948 1.00 0.00 H new ATOM 0 HB3 PHE S 478 0.232 -0.631 -7.949 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.576 1.280 -6.240 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.149 0.479 -8.145 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.594 2.508 -4.464 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.323 1.703 -6.368 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.048 2.719 -4.522 1.00 0.00 H new ATOM 381 N GLN S 479 -1.254 0.820 -11.288 1.00 0.00 N ATOM 382 CA GLN S 479 -2.221 1.306 -12.266 1.00 0.00 C ATOM 383 C GLN S 479 -3.645 0.977 -11.825 1.00 0.00 C ATOM 384 O GLN S 479 -3.854 0.361 -10.781 1.00 0.00 O ATOM 385 CB GLN S 479 -1.946 0.690 -13.638 1.00 0.00 C ATOM 386 CG GLN S 479 -2.098 -0.823 -13.669 1.00 0.00 C ATOM 387 CD GLN S 479 -1.008 -1.503 -14.471 1.00 0.00 C ATOM 388 OE1 GLN S 479 0.176 -1.402 -14.143 1.00 0.00 O ATOM 389 NE2 GLN S 479 -1.399 -2.201 -15.531 1.00 0.00 N ATOM 0 H GLN S 479 -1.000 -0.161 -11.400 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.119 2.389 -12.337 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.626 1.130 -14.367 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.934 0.951 -13.948 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -2.086 -1.206 -12.649 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -3.069 -1.078 -14.094 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -2.390 -2.258 -15.767 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -0.709 -2.680 -16.109 1.00 0.00 H new ATOM 398 N GLU S 480 -4.620 1.392 -12.629 1.00 0.00 N ATOM 399 CA GLU S 480 -6.023 1.138 -12.319 1.00 0.00 C ATOM 400 C GLU S 480 -6.397 -0.304 -12.646 1.00 0.00 C ATOM 401 O GLU S 480 -5.752 -0.951 -13.471 1.00 0.00 O ATOM 402 CB GLU S 480 -6.923 2.105 -13.094 1.00 0.00 C ATOM 403 CG GLU S 480 -6.993 1.815 -14.585 1.00 0.00 C ATOM 404 CD GLU S 480 -6.683 3.033 -15.434 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.203 4.124 -15.118 1.00 0.00 O ATOM 406 OE2 GLU S 480 -5.923 2.895 -16.415 1.00 0.00 O ATOM 0 H GLU S 480 -4.465 1.904 -13.497 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.170 1.298 -11.251 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -7.929 2.063 -12.677 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.559 3.122 -12.948 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.290 1.019 -14.829 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -7.989 1.448 -14.833 1.00 0.00 H new ATOM 413 N GLY S 481 -7.445 -0.802 -11.993 1.00 0.00 N ATOM 414 CA GLY S 481 -7.888 -2.167 -12.229 1.00 0.00 C ATOM 415 C GLY S 481 -6.749 -3.167 -12.180 1.00 0.00 C ATOM 416 O GLY S 481 -6.421 -3.791 -13.189 1.00 0.00 O ATOM 0 H GLY S 481 -7.995 -0.286 -11.306 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.635 -2.437 -11.483 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.375 -2.224 -13.203 1.00 0.00 H new ATOM 420 N ASP S 482 -6.138 -3.317 -11.008 1.00 0.00 N ATOM 421 CA ASP S 482 -5.027 -4.248 -10.849 1.00 0.00 C ATOM 422 C ASP S 482 -5.238 -5.182 -9.666 1.00 0.00 C ATOM 423 O ASP S 482 -6.020 -4.896 -8.764 1.00 0.00 O ATOM 424 CB ASP S 482 -3.708 -3.483 -10.690 1.00 0.00 C ATOM 425 CG ASP S 482 -2.535 -4.393 -10.375 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.435 -5.470 -11.000 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.718 -4.028 -9.502 1.00 0.00 O ATOM 0 H ASP S 482 -6.392 -2.809 -10.160 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.980 -4.859 -11.750 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.499 -2.933 -11.608 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.814 -2.746 -9.894 1.00 0.00 H new ATOM 432 N ILE S 483 -4.528 -6.305 -9.689 1.00 0.00 N ATOM 433 CA ILE S 483 -4.626 -7.299 -8.628 1.00 0.00 C ATOM 434 C ILE S 483 -3.493 -7.139 -7.620 1.00 0.00 C ATOM 435 O ILE S 483 -2.498 -7.862 -7.665 1.00 0.00 O ATOM 436 CB ILE S 483 -4.593 -8.729 -9.197 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.582 -8.864 -10.356 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.907 -9.738 -8.106 1.00 0.00 C ATOM 439 CD1 ILE S 483 -7.006 -8.514 -9.980 1.00 0.00 C ATOM 0 H ILE S 483 -3.876 -6.550 -10.434 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.580 -7.136 -8.127 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.591 -8.931 -9.575 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.262 -8.218 -11.173 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.554 -9.888 -10.729 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.880 -10.745 -8.523 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -4.167 -9.655 -7.310 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.899 -9.539 -7.701 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.652 -8.632 -10.850 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.345 -9.176 -9.184 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -7.048 -7.481 -9.635 1.00 0.00 H new ATOM 451 N ILE S 484 -3.656 -6.187 -6.709 1.00 0.00 N ATOM 452 CA ILE S 484 -2.653 -5.926 -5.683 1.00 0.00 C ATOM 453 C ILE S 484 -2.766 -6.927 -4.541 1.00 0.00 C ATOM 454 O ILE S 484 -3.865 -7.345 -4.174 1.00 0.00 O ATOM 455 CB ILE S 484 -2.807 -4.501 -5.109 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.669 -3.459 -6.220 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.788 -4.247 -4.008 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.297 -2.129 -5.873 1.00 0.00 C ATOM 0 H ILE S 484 -4.475 -5.581 -6.660 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.676 -6.024 -6.157 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.803 -4.414 -4.675 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.612 -3.308 -6.438 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -3.130 -3.844 -7.129 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.916 -3.237 -3.619 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.935 -4.967 -3.203 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.781 -4.355 -4.412 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -3.163 -1.436 -6.704 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.361 -2.268 -5.684 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.820 -1.723 -4.981 1.00 0.00 H new ATOM 470 N LEU S 485 -1.627 -7.294 -3.965 1.00 0.00 N ATOM 471 CA LEU S 485 -1.608 -8.227 -2.848 1.00 0.00 C ATOM 472 C LEU S 485 -1.373 -7.464 -1.561 1.00 0.00 C ATOM 473 O LEU S 485 -0.234 -7.260 -1.139 1.00 0.00 O ATOM 474 CB LEU S 485 -0.530 -9.299 -3.047 1.00 0.00 C ATOM 475 CG LEU S 485 -0.194 -10.190 -1.828 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.133 -9.776 -1.217 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.288 -10.158 -0.766 1.00 0.00 C ATOM 0 H LEU S 485 -0.707 -6.960 -4.253 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.571 -8.735 -2.794 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.844 -9.948 -3.865 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.386 -8.803 -3.367 1.00 0.00 H new ATOM 0 HG LEU S 485 -0.123 -11.214 -2.194 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.354 -10.413 -0.361 1.00 0.00 H new ATOM 0 HD12 LEU S 485 1.924 -9.880 -1.960 1.00 0.00 H new ATOM 0 HD13 LEU S 485 1.075 -8.737 -0.891 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -1.004 -10.799 0.068 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.420 -9.136 -0.410 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -2.223 -10.516 -1.196 1.00 0.00 H new ATOM 489 N VAL S 486 -2.462 -7.047 -0.937 1.00 0.00 N ATOM 490 CA VAL S 486 -2.380 -6.305 0.312 1.00 0.00 C ATOM 491 C VAL S 486 -1.613 -7.111 1.338 1.00 0.00 C ATOM 492 O VAL S 486 -2.001 -8.226 1.677 1.00 0.00 O ATOM 493 CB VAL S 486 -3.763 -5.964 0.905 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.659 -4.759 1.814 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.804 -5.718 -0.180 1.00 0.00 C ATOM 0 H VAL S 486 -3.411 -7.209 -1.273 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.872 -5.369 0.080 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.093 -6.826 1.485 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.641 -4.528 2.226 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.966 -4.975 2.627 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.295 -3.904 1.244 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.762 -5.481 0.282 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.487 -4.884 -0.806 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.908 -6.613 -0.794 1.00 0.00 H new ATOM 505 N LEU S 487 -0.525 -6.556 1.829 1.00 0.00 N ATOM 506 CA LEU S 487 0.280 -7.251 2.814 1.00 0.00 C ATOM 507 C LEU S 487 -0.328 -7.135 4.209 1.00 0.00 C ATOM 508 O LEU S 487 -0.071 -7.975 5.070 1.00 0.00 O ATOM 509 CB LEU S 487 1.700 -6.696 2.818 1.00 0.00 C ATOM 510 CG LEU S 487 2.674 -7.404 1.880 1.00 0.00 C ATOM 511 CD1 LEU S 487 3.088 -8.747 2.464 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.049 -7.588 0.508 1.00 0.00 C ATOM 0 H LEU S 487 -0.179 -5.633 1.566 1.00 0.00 H new ATOM 0 HA LEU S 487 0.306 -8.306 2.542 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.662 -5.641 2.548 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.092 -6.751 3.833 1.00 0.00 H new ATOM 0 HG LEU S 487 3.565 -6.786 1.771 1.00 0.00 H new ATOM 0 HD11 LEU S 487 3.783 -9.241 1.784 1.00 0.00 H new ATOM 0 HD12 LEU S 487 3.573 -8.591 3.428 1.00 0.00 H new ATOM 0 HD13 LEU S 487 2.206 -9.373 2.599 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.756 -8.094 -0.149 1.00 0.00 H new ATOM 0 HD22 LEU S 487 1.144 -8.188 0.598 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.798 -6.614 0.089 1.00 0.00 H new ATOM 524 N SER S 488 -1.131 -6.091 4.423 1.00 0.00 N ATOM 525 CA SER S 488 -1.774 -5.858 5.722 1.00 0.00 C ATOM 526 C SER S 488 -2.334 -4.444 5.805 1.00 0.00 C ATOM 527 O SER S 488 -2.010 -3.591 4.982 1.00 0.00 O ATOM 528 CB SER S 488 -0.773 -6.032 6.873 1.00 0.00 C ATOM 529 OG SER S 488 -1.417 -6.505 8.043 1.00 0.00 O ATOM 0 H SER S 488 -1.353 -5.392 3.714 1.00 0.00 H new ATOM 0 HA SER S 488 -2.578 -6.589 5.812 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.009 -6.732 6.576 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.286 -5.080 7.082 1.00 0.00 H new ATOM 0 HG SER S 488 -0.757 -6.609 8.760 1.00 0.00 H new ATOM 535 N LYS S 489 -3.139 -4.190 6.834 1.00 0.00 N ATOM 536 CA LYS S 489 -3.698 -2.862 7.052 1.00 0.00 C ATOM 537 C LYS S 489 -2.641 -1.987 7.715 1.00 0.00 C ATOM 538 O LYS S 489 -1.994 -2.414 8.673 1.00 0.00 O ATOM 539 CB LYS S 489 -4.950 -2.939 7.929 1.00 0.00 C ATOM 540 CG LYS S 489 -5.778 -1.664 7.923 1.00 0.00 C ATOM 541 CD LYS S 489 -7.245 -1.951 8.200 1.00 0.00 C ATOM 542 CE LYS S 489 -7.870 -0.868 9.062 1.00 0.00 C ATOM 543 NZ LYS S 489 -7.918 -1.257 10.499 1.00 0.00 N ATOM 0 H LYS S 489 -3.417 -4.885 7.527 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.987 -2.430 6.094 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.571 -3.767 7.588 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.652 -3.164 8.953 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.393 -0.975 8.675 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -5.679 -1.169 6.957 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.787 -2.025 7.257 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -7.340 -2.915 8.699 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.300 0.055 8.955 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -8.880 -0.661 8.708 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -8.352 -0.490 11.052 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -8.484 -2.123 10.605 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -6.952 -1.430 10.844 1.00 0.00 H new ATOM 557 N VAL S 490 -2.430 -0.785 7.193 1.00 0.00 N ATOM 558 CA VAL S 490 -1.403 0.095 7.746 1.00 0.00 C ATOM 559 C VAL S 490 -1.988 1.283 8.518 1.00 0.00 C ATOM 560 O VAL S 490 -1.339 1.812 9.419 1.00 0.00 O ATOM 561 CB VAL S 490 -0.439 0.577 6.638 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.463 1.704 7.126 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.404 -0.595 6.142 1.00 0.00 C ATOM 0 H VAL S 490 -2.945 -0.400 6.401 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.840 -0.497 8.468 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.039 0.969 5.817 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.126 2.015 6.319 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.149 2.550 7.440 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.058 1.354 7.970 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.082 -0.251 5.361 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.982 -1.004 6.971 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.250 -1.369 5.740 1.00 0.00 H new ATOM 573 N ASN S 491 -3.209 1.697 8.192 1.00 0.00 N ATOM 574 CA ASN S 491 -3.833 2.812 8.907 1.00 0.00 C ATOM 575 C ASN S 491 -5.237 3.110 8.375 1.00 0.00 C ATOM 576 O ASN S 491 -5.659 4.265 8.319 1.00 0.00 O ATOM 577 CB ASN S 491 -2.937 4.065 8.842 1.00 0.00 C ATOM 578 CG ASN S 491 -3.219 4.965 7.651 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.825 4.545 6.665 1.00 0.00 O ATOM 580 ND2 ASN S 491 -2.778 6.216 7.745 1.00 0.00 N ATOM 0 H ASN S 491 -3.779 1.288 7.452 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.940 2.520 9.952 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.068 4.641 9.758 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.894 3.752 8.809 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -2.937 6.872 6.980 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.280 6.520 8.582 1.00 0.00 H new ATOM 587 N GLU S 492 -5.957 2.063 7.982 1.00 0.00 N ATOM 588 CA GLU S 492 -7.311 2.222 7.450 1.00 0.00 C ATOM 589 C GLU S 492 -7.265 2.808 6.043 1.00 0.00 C ATOM 590 O GLU S 492 -7.742 2.194 5.088 1.00 0.00 O ATOM 591 CB GLU S 492 -8.151 3.118 8.364 1.00 0.00 C ATOM 592 CG GLU S 492 -9.605 2.689 8.467 1.00 0.00 C ATOM 593 CD GLU S 492 -10.536 3.847 8.767 1.00 0.00 C ATOM 594 OE1 GLU S 492 -10.362 4.490 9.823 1.00 0.00 O ATOM 595 OE2 GLU S 492 -11.440 4.110 7.947 1.00 0.00 O ATOM 0 H GLU S 492 -5.629 1.098 8.021 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.776 1.237 7.407 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.710 3.121 9.361 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -8.108 4.142 7.994 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.908 2.217 7.532 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.703 1.937 9.250 1.00 0.00 H new ATOM 602 N GLU S 493 -6.670 3.991 5.920 1.00 0.00 N ATOM 603 CA GLU S 493 -6.541 4.654 4.626 1.00 0.00 C ATOM 604 C GLU S 493 -5.201 4.309 3.977 1.00 0.00 C ATOM 605 O GLU S 493 -4.767 4.970 3.033 1.00 0.00 O ATOM 606 CB GLU S 493 -6.667 6.169 4.790 1.00 0.00 C ATOM 607 CG GLU S 493 -8.105 6.653 4.897 1.00 0.00 C ATOM 608 CD GLU S 493 -8.525 6.914 6.330 1.00 0.00 C ATOM 609 OE1 GLU S 493 -7.935 7.811 6.968 1.00 0.00 O ATOM 610 OE2 GLU S 493 -9.446 6.222 6.814 1.00 0.00 O ATOM 0 H GLU S 493 -6.269 4.510 6.701 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.344 4.301 3.979 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.122 6.476 5.683 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.190 6.659 3.941 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -8.221 7.568 4.315 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.769 5.909 4.457 1.00 0.00 H new ATOM 617 N TRP S 494 -4.559 3.259 4.486 1.00 0.00 N ATOM 618 CA TRP S 494 -3.277 2.804 3.968 1.00 0.00 C ATOM 619 C TRP S 494 -3.023 1.366 4.381 1.00 0.00 C ATOM 620 O TRP S 494 -3.618 0.865 5.335 1.00 0.00 O ATOM 621 CB TRP S 494 -2.129 3.681 4.468 1.00 0.00 C ATOM 622 CG TRP S 494 -2.124 5.067 3.900 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.758 6.159 4.413 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.440 5.515 2.722 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.501 7.260 3.636 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.703 6.891 2.590 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.629 4.894 1.768 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.188 7.656 1.550 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.119 5.655 0.732 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.399 7.023 0.630 1.00 0.00 C ATOM 0 H TRP S 494 -4.913 2.704 5.265 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.320 2.874 2.881 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.183 3.746 5.555 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.184 3.197 4.224 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.373 6.158 5.301 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.850 8.202 3.811 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.405 3.840 1.839 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.403 8.711 1.471 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.507 5.185 -0.012 1.00 0.00 H new ATOM 0 HH2 TRP S 494 0.016 7.589 -0.191 1.00 0.00 H new ATOM 641 N LEU S 495 -2.141 0.707 3.653 1.00 0.00 N ATOM 642 CA LEU S 495 -1.801 -0.673 3.926 1.00 0.00 C ATOM 643 C LEU S 495 -0.467 -1.037 3.299 1.00 0.00 C ATOM 644 O LEU S 495 0.087 -0.269 2.514 1.00 0.00 O ATOM 645 CB LEU S 495 -2.905 -1.595 3.415 1.00 0.00 C ATOM 646 CG LEU S 495 -3.702 -1.070 2.220 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.335 -1.816 0.948 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.190 -1.183 2.504 1.00 0.00 C ATOM 0 H LEU S 495 -1.643 1.112 2.860 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.709 -0.799 5.005 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.458 -2.550 3.140 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.598 -1.791 4.233 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.451 -0.020 2.068 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -3.917 -1.422 0.115 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.273 -1.685 0.743 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.552 -2.877 1.073 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.753 -0.808 1.649 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.449 -2.227 2.679 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.437 -0.595 3.388 1.00 0.00 H new ATOM 660 N GLU S 496 0.046 -2.208 3.649 1.00 0.00 N ATOM 661 CA GLU S 496 1.318 -2.653 3.112 1.00 0.00 C ATOM 662 C GLU S 496 1.126 -3.200 1.709 1.00 0.00 C ATOM 663 O GLU S 496 0.338 -4.120 1.489 1.00 0.00 O ATOM 664 CB GLU S 496 1.952 -3.705 4.024 1.00 0.00 C ATOM 665 CG GLU S 496 3.337 -4.143 3.573 1.00 0.00 C ATOM 666 CD GLU S 496 3.923 -5.231 4.452 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.233 -5.669 5.397 1.00 0.00 O ATOM 668 OE2 GLU S 496 5.072 -5.643 4.196 1.00 0.00 O ATOM 0 H GLU S 496 -0.396 -2.860 4.297 1.00 0.00 H new ATOM 0 HA GLU S 496 1.995 -1.800 3.064 1.00 0.00 H new ATOM 0 HB2 GLU S 496 2.018 -3.305 5.036 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.300 -4.577 4.068 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.283 -4.502 2.545 1.00 0.00 H new ATOM 0 HG3 GLU S 496 4.005 -3.281 3.575 1.00 0.00 H new ATOM 675 N GLY S 497 1.826 -2.598 0.759 1.00 0.00 N ATOM 676 CA GLY S 497 1.697 -3.003 -0.620 1.00 0.00 C ATOM 677 C GLY S 497 2.903 -3.749 -1.161 1.00 0.00 C ATOM 678 O GLY S 497 4.042 -3.323 -0.981 1.00 0.00 O ATOM 0 H GLY S 497 2.482 -1.834 0.922 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.816 -3.637 -0.721 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.525 -2.118 -1.233 1.00 0.00 H new ATOM 682 N GLU S 498 2.640 -4.857 -1.847 1.00 0.00 N ATOM 683 CA GLU S 498 3.691 -5.668 -2.452 1.00 0.00 C ATOM 684 C GLU S 498 3.189 -6.259 -3.765 1.00 0.00 C ATOM 685 O GLU S 498 2.440 -7.236 -3.770 1.00 0.00 O ATOM 686 CB GLU S 498 4.122 -6.788 -1.503 1.00 0.00 C ATOM 687 CG GLU S 498 5.573 -7.208 -1.679 1.00 0.00 C ATOM 688 CD GLU S 498 5.721 -8.685 -1.987 1.00 0.00 C ATOM 689 OE1 GLU S 498 4.982 -9.494 -1.386 1.00 0.00 O ATOM 690 OE2 GLU S 498 6.574 -9.035 -2.829 1.00 0.00 O ATOM 0 H GLU S 498 1.698 -5.217 -1.999 1.00 0.00 H new ATOM 0 HA GLU S 498 4.555 -5.033 -2.648 1.00 0.00 H new ATOM 0 HB2 GLU S 498 3.969 -6.461 -0.475 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.480 -7.654 -1.661 1.00 0.00 H new ATOM 0 HG2 GLU S 498 6.020 -6.626 -2.485 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.128 -6.973 -0.771 1.00 0.00 H new ATOM 697 N SER S 499 3.581 -5.646 -4.879 1.00 0.00 N ATOM 698 CA SER S 499 3.139 -6.106 -6.192 1.00 0.00 C ATOM 699 C SER S 499 4.306 -6.245 -7.168 1.00 0.00 C ATOM 700 O SER S 499 4.928 -5.256 -7.556 1.00 0.00 O ATOM 701 CB SER S 499 2.099 -5.140 -6.764 1.00 0.00 C ATOM 702 OG SER S 499 1.403 -5.726 -7.850 1.00 0.00 O ATOM 0 H SER S 499 4.199 -4.835 -4.899 1.00 0.00 H new ATOM 0 HA SER S 499 2.693 -7.092 -6.062 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.392 -4.858 -5.984 1.00 0.00 H new ATOM 0 HB3 SER S 499 2.591 -4.225 -7.094 1.00 0.00 H new ATOM 0 HG SER S 499 0.743 -5.090 -8.197 1.00 0.00 H new ATOM 708 N LYS S 500 4.575 -7.479 -7.575 1.00 0.00 N ATOM 709 CA LYS S 500 5.647 -7.768 -8.526 1.00 0.00 C ATOM 710 C LYS S 500 7.019 -7.394 -7.974 1.00 0.00 C ATOM 711 O LYS S 500 7.515 -6.295 -8.218 1.00 0.00 O ATOM 712 CB LYS S 500 5.399 -7.024 -9.840 1.00 0.00 C ATOM 713 CG LYS S 500 4.110 -7.433 -10.536 1.00 0.00 C ATOM 714 CD LYS S 500 3.329 -6.223 -11.023 1.00 0.00 C ATOM 715 CE LYS S 500 1.831 -6.425 -10.864 1.00 0.00 C ATOM 716 NZ LYS S 500 1.068 -5.185 -11.170 1.00 0.00 N ATOM 0 H LYS S 500 4.063 -8.303 -7.260 1.00 0.00 H new ATOM 0 HA LYS S 500 5.642 -8.843 -8.704 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.371 -5.953 -9.642 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.238 -7.202 -10.513 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.342 -8.081 -11.381 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.493 -8.013 -9.849 1.00 0.00 H new ATOM 0 HD2 LYS S 500 3.639 -5.340 -10.465 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.563 -6.036 -12.071 1.00 0.00 H new ATOM 0 HE2 LYS S 500 1.501 -7.227 -11.525 1.00 0.00 H new ATOM 0 HE3 LYS S 500 1.614 -6.742 -9.844 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.051 -5.365 -11.050 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 1.364 -4.426 -10.523 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 1.255 -4.896 -12.151 1.00 0.00 H new ATOM 730 N GLY S 501 7.631 -8.328 -7.244 1.00 0.00 N ATOM 731 CA GLY S 501 8.955 -8.107 -6.671 1.00 0.00 C ATOM 732 C GLY S 501 9.213 -6.665 -6.275 1.00 0.00 C ATOM 733 O GLY S 501 10.276 -6.116 -6.566 1.00 0.00 O ATOM 0 H GLY S 501 7.230 -9.243 -7.037 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.072 -8.743 -5.793 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.710 -8.417 -7.393 1.00 0.00 H new ATOM 737 N LYS S 502 8.244 -6.053 -5.608 1.00 0.00 N ATOM 738 CA LYS S 502 8.371 -4.671 -5.171 1.00 0.00 C ATOM 739 C LYS S 502 7.511 -4.421 -3.943 1.00 0.00 C ATOM 740 O LYS S 502 6.311 -4.696 -3.949 1.00 0.00 O ATOM 741 CB LYS S 502 7.974 -3.712 -6.294 1.00 0.00 C ATOM 742 CG LYS S 502 9.137 -3.308 -7.184 1.00 0.00 C ATOM 743 CD LYS S 502 8.796 -3.461 -8.659 1.00 0.00 C ATOM 744 CE LYS S 502 9.984 -3.978 -9.453 1.00 0.00 C ATOM 745 NZ LYS S 502 9.799 -3.783 -10.919 1.00 0.00 N ATOM 0 H LYS S 502 7.359 -6.494 -5.358 1.00 0.00 H new ATOM 0 HA LYS S 502 9.414 -4.490 -4.912 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.204 -4.181 -6.906 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.533 -2.816 -5.857 1.00 0.00 H new ATOM 0 HG2 LYS S 502 9.410 -2.273 -6.979 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.007 -3.920 -6.946 1.00 0.00 H new ATOM 0 HD2 LYS S 502 7.956 -4.147 -8.770 1.00 0.00 H new ATOM 0 HD3 LYS S 502 8.478 -2.499 -9.062 1.00 0.00 H new ATOM 0 HE2 LYS S 502 10.889 -3.463 -9.129 1.00 0.00 H new ATOM 0 HE3 LYS S 502 10.128 -5.038 -9.243 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 10.631 -4.148 -11.425 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 8.950 -4.295 -11.233 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 9.687 -2.769 -11.123 1.00 0.00 H new ATOM 759 N VAL S 503 8.129 -3.909 -2.889 1.00 0.00 N ATOM 760 CA VAL S 503 7.413 -3.637 -1.652 1.00 0.00 C ATOM 761 C VAL S 503 7.222 -2.139 -1.434 1.00 0.00 C ATOM 762 O VAL S 503 8.089 -1.329 -1.760 1.00 0.00 O ATOM 763 CB VAL S 503 8.139 -4.245 -0.437 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.305 -4.084 0.827 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.455 -5.713 -0.693 1.00 0.00 C ATOM 0 H VAL S 503 9.121 -3.674 -2.865 1.00 0.00 H new ATOM 0 HA VAL S 503 6.433 -4.105 -1.747 1.00 0.00 H new ATOM 0 HB VAL S 503 9.077 -3.709 -0.290 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.837 -4.521 1.672 1.00 0.00 H new ATOM 0 HG12 VAL S 503 7.131 -3.025 1.016 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.349 -4.591 0.699 1.00 0.00 H new ATOM 0 HG21 VAL S 503 8.968 -6.131 0.173 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.528 -6.260 -0.865 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.095 -5.800 -1.571 1.00 0.00 H new ATOM 775 N GLY S 504 6.070 -1.793 -0.879 1.00 0.00 N ATOM 776 CA GLY S 504 5.735 -0.410 -0.609 1.00 0.00 C ATOM 777 C GLY S 504 4.411 -0.314 0.114 1.00 0.00 C ATOM 778 O GLY S 504 3.982 -1.281 0.740 1.00 0.00 O ATOM 0 H GLY S 504 5.348 -2.460 -0.606 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.519 0.048 -0.006 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.686 0.147 -1.545 1.00 0.00 H new ATOM 782 N ILE S 505 3.750 0.835 0.028 1.00 0.00 N ATOM 783 CA ILE S 505 2.460 1.004 0.688 1.00 0.00 C ATOM 784 C ILE S 505 1.549 1.939 -0.087 1.00 0.00 C ATOM 785 O ILE S 505 2.009 2.850 -0.773 1.00 0.00 O ATOM 786 CB ILE S 505 2.611 1.523 2.127 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.715 2.581 2.214 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.895 0.361 3.060 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.304 3.820 2.978 1.00 0.00 C ATOM 0 H ILE S 505 4.080 1.653 -0.485 1.00 0.00 H new ATOM 0 HA ILE S 505 2.008 0.013 0.720 1.00 0.00 H new ATOM 0 HB ILE S 505 1.679 1.998 2.431 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.591 2.142 2.692 1.00 0.00 H new ATOM 0 HG13 ILE S 505 4.013 2.868 1.205 1.00 0.00 H new ATOM 0 HG21 ILE S 505 3.002 0.731 4.080 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.070 -0.350 3.017 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.817 -0.133 2.755 1.00 0.00 H new ATOM 0 HD11 ILE S 505 4.134 4.526 3.000 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.447 4.282 2.488 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.034 3.546 3.998 1.00 0.00 H new ATOM 801 N PHE S 506 0.250 1.702 0.025 1.00 0.00 N ATOM 802 CA PHE S 506 -0.731 2.523 -0.676 1.00 0.00 C ATOM 803 C PHE S 506 -2.056 2.578 0.080 1.00 0.00 C ATOM 804 O PHE S 506 -2.329 1.737 0.937 1.00 0.00 O ATOM 805 CB PHE S 506 -0.956 1.979 -2.089 1.00 0.00 C ATOM 806 CG PHE S 506 -1.631 0.637 -2.120 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.917 -0.519 -1.850 1.00 0.00 C ATOM 808 CD2 PHE S 506 -2.978 0.533 -2.424 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.535 -1.754 -1.881 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.602 -0.700 -2.457 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.880 -1.846 -2.185 1.00 0.00 C ATOM 0 H PHE S 506 -0.149 0.953 0.591 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.337 3.538 -0.737 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.559 2.692 -2.651 1.00 0.00 H new ATOM 0 HB3 PHE S 506 0.005 1.904 -2.597 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.135 -0.454 -1.613 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.547 1.425 -2.638 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.967 -2.648 -1.668 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.653 -0.767 -2.695 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.365 -2.811 -2.210 1.00 0.00 H new ATOM 821 N PRO S 507 -2.903 3.575 -0.235 1.00 0.00 N ATOM 822 CA PRO S 507 -4.199 3.738 0.407 1.00 0.00 C ATOM 823 C PRO S 507 -5.272 2.859 -0.224 1.00 0.00 C ATOM 824 O PRO S 507 -5.482 2.883 -1.436 1.00 0.00 O ATOM 825 CB PRO S 507 -4.501 5.218 0.195 1.00 0.00 C ATOM 826 CG PRO S 507 -3.826 5.567 -1.087 1.00 0.00 C ATOM 827 CD PRO S 507 -2.659 4.620 -1.248 1.00 0.00 C ATOM 0 HA PRO S 507 -4.187 3.441 1.456 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.575 5.398 0.138 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.120 5.821 1.019 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.517 5.472 -1.924 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.483 6.602 -1.072 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.622 4.200 -2.253 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.708 5.126 -1.078 1.00 0.00 H new ATOM 835 N LYS S 508 -5.938 2.073 0.616 1.00 0.00 N ATOM 836 CA LYS S 508 -6.984 1.161 0.174 1.00 0.00 C ATOM 837 C LYS S 508 -8.027 1.858 -0.699 1.00 0.00 C ATOM 838 O LYS S 508 -8.737 1.203 -1.460 1.00 0.00 O ATOM 839 CB LYS S 508 -7.661 0.543 1.396 1.00 0.00 C ATOM 840 CG LYS S 508 -8.191 -0.858 1.153 1.00 0.00 C ATOM 841 CD LYS S 508 -9.635 -0.834 0.677 1.00 0.00 C ATOM 842 CE LYS S 508 -10.607 -0.951 1.840 1.00 0.00 C ATOM 843 NZ LYS S 508 -12.000 -1.204 1.377 1.00 0.00 N ATOM 0 H LYS S 508 -5.767 2.051 1.621 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.518 0.386 -0.435 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -6.948 0.515 2.220 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.485 1.185 1.708 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -7.570 -1.359 0.410 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -8.120 -1.439 2.072 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -9.825 0.092 0.134 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -9.802 -1.653 -0.022 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -10.290 -1.761 2.498 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -10.581 -0.034 2.428 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -12.631 -1.277 2.200 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -12.312 -0.419 0.770 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -12.030 -2.092 0.837 1.00 0.00 H new ATOM 857 N VAL S 509 -8.124 3.181 -0.588 1.00 0.00 N ATOM 858 CA VAL S 509 -9.092 3.938 -1.378 1.00 0.00 C ATOM 859 C VAL S 509 -8.973 3.597 -2.867 1.00 0.00 C ATOM 860 O VAL S 509 -9.949 3.692 -3.612 1.00 0.00 O ATOM 861 CB VAL S 509 -8.926 5.460 -1.172 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.469 5.867 -1.303 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.794 6.242 -2.148 1.00 0.00 C ATOM 0 H VAL S 509 -7.549 3.747 0.036 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.084 3.652 -1.030 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.257 5.699 -0.161 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.377 6.943 -1.154 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -6.876 5.345 -0.552 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.106 5.606 -2.297 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.658 7.310 -1.981 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.506 5.995 -3.170 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.841 5.981 -1.993 1.00 0.00 H new ATOM 873 N PHE S 510 -7.779 3.189 -3.291 1.00 0.00 N ATOM 874 CA PHE S 510 -7.548 2.822 -4.688 1.00 0.00 C ATOM 875 C PHE S 510 -7.807 1.336 -4.911 1.00 0.00 C ATOM 876 O PHE S 510 -7.473 0.792 -5.963 1.00 0.00 O ATOM 877 CB PHE S 510 -6.113 3.150 -5.101 1.00 0.00 C ATOM 878 CG PHE S 510 -5.809 4.617 -5.103 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.820 5.335 -3.925 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.519 5.277 -6.284 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.547 6.687 -3.919 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.251 6.630 -6.289 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.266 7.338 -5.102 1.00 0.00 C ATOM 0 H PHE S 510 -6.959 3.104 -2.691 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.241 3.400 -5.299 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.425 2.646 -4.423 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.930 2.748 -6.098 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.045 4.832 -2.996 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.502 4.726 -7.213 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.553 7.235 -2.989 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.030 7.135 -7.218 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.058 8.398 -5.101 1.00 0.00 H new ATOM 893 N VAL S 511 -8.388 0.680 -3.913 1.00 0.00 N ATOM 894 CA VAL S 511 -8.675 -0.744 -3.994 1.00 0.00 C ATOM 895 C VAL S 511 -9.861 -1.112 -3.105 1.00 0.00 C ATOM 896 O VAL S 511 -9.752 -1.959 -2.219 1.00 0.00 O ATOM 897 CB VAL S 511 -7.451 -1.573 -3.558 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.277 -1.352 -4.492 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.050 -1.212 -2.145 1.00 0.00 C ATOM 0 H VAL S 511 -8.670 1.116 -3.035 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.917 -0.970 -5.033 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.731 -2.626 -3.598 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.429 -1.950 -4.158 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.555 -1.649 -5.503 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -6.002 -0.297 -4.487 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.184 -1.805 -1.850 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -6.798 -0.153 -2.098 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -7.879 -1.418 -1.468 1.00 0.00 H new ATOM 909 N GLU S 512 -10.999 -0.469 -3.344 1.00 0.00 N ATOM 910 CA GLU S 512 -12.204 -0.727 -2.560 1.00 0.00 C ATOM 911 C GLU S 512 -12.772 -2.123 -2.819 1.00 0.00 C ATOM 912 O GLU S 512 -13.903 -2.420 -2.437 1.00 0.00 O ATOM 913 CB GLU S 512 -13.266 0.327 -2.869 1.00 0.00 C ATOM 914 CG GLU S 512 -13.756 0.279 -4.306 1.00 0.00 C ATOM 915 CD GLU S 512 -14.766 1.367 -4.615 1.00 0.00 C ATOM 916 OE1 GLU S 512 -15.775 1.465 -3.884 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.549 2.118 -5.588 1.00 0.00 O ATOM 0 H GLU S 512 -11.113 0.234 -4.074 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.924 -0.673 -1.508 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -14.114 0.187 -2.198 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.857 1.316 -2.664 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.905 0.377 -4.980 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.206 -0.695 -4.500 1.00 0.00 H new ATOM 986 N LYS P 360 -11.341 8.597 -15.365 1.00 0.00 N ATOM 987 CA LYS P 360 -11.747 8.824 -13.983 1.00 0.00 C ATOM 988 C LYS P 360 -10.627 9.470 -13.177 1.00 0.00 C ATOM 989 O LYS P 360 -9.463 9.084 -13.291 1.00 0.00 O ATOM 990 CB LYS P 360 -12.161 7.507 -13.323 1.00 0.00 C ATOM 991 CG LYS P 360 -13.639 7.183 -13.470 1.00 0.00 C ATOM 992 CD LYS P 360 -14.198 6.553 -12.205 1.00 0.00 C ATOM 993 CE LYS P 360 -15.712 6.445 -12.257 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.337 6.746 -10.939 1.00 0.00 N ATOM 0 HA LYS P 360 -12.599 9.503 -13.997 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.576 6.695 -13.756 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -11.912 7.549 -12.263 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.192 8.094 -13.699 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.782 6.504 -14.310 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.766 5.561 -12.070 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -13.904 7.149 -11.341 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.099 7.134 -13.008 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -15.993 5.440 -12.571 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.371 6.661 -11.017 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -15.987 6.073 -10.227 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -16.090 7.714 -10.651 1.00 0.00 H new ATOM 1008 N PRO P 361 -10.969 10.468 -12.347 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.009 11.182 -11.510 1.00 0.00 C ATOM 1010 C PRO P 361 -9.728 10.428 -10.215 1.00 0.00 C ATOM 1011 O PRO P 361 -10.555 10.420 -9.302 1.00 0.00 O ATOM 1012 CB PRO P 361 -10.717 12.518 -11.218 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.038 12.446 -11.928 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.315 10.996 -12.145 1.00 0.00 C ATOM 0 HA PRO P 361 -9.040 11.302 -11.994 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -10.857 12.660 -10.146 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.126 13.360 -11.577 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -12.826 12.908 -11.333 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.000 12.981 -12.877 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -12.810 10.540 -11.287 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -12.956 10.826 -13.010 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.567 9.783 -10.145 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.191 9.013 -8.961 1.00 0.00 C ATOM 1024 C GLN P 362 -8.448 9.792 -7.678 1.00 0.00 C ATOM 1025 O GLN P 362 -8.509 11.021 -7.676 1.00 0.00 O ATOM 1026 CB GLN P 362 -6.712 8.614 -9.012 1.00 0.00 C ATOM 1027 CG GLN P 362 -5.764 9.795 -9.142 1.00 0.00 C ATOM 1028 CD GLN P 362 -5.519 10.190 -10.585 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -5.326 9.337 -11.451 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.527 11.492 -10.850 1.00 0.00 N ATOM 0 H GLN P 362 -7.872 9.777 -10.891 1.00 0.00 H new ATOM 0 HA GLN P 362 -8.812 8.117 -8.960 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.464 8.058 -8.108 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.556 7.940 -9.854 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.175 10.647 -8.601 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -4.813 9.546 -8.671 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -5.691 12.164 -10.100 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -5.369 11.819 -11.803 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.595 9.062 -6.569 1.00 0.00 N ATOM 1040 CA PRO P 363 -8.839 9.658 -5.263 1.00 0.00 C ATOM 1041 C PRO P 363 -7.660 10.487 -4.781 1.00 0.00 C ATOM 1042 O PRO P 363 -6.553 9.972 -4.632 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.045 8.466 -4.324 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.662 7.236 -5.081 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.528 7.596 -6.529 1.00 0.00 C ATOM 0 HA PRO P 363 -9.692 10.335 -5.298 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.434 8.572 -3.428 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.083 8.409 -3.997 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.723 6.834 -4.701 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.416 6.460 -4.951 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.585 7.234 -6.939 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.326 7.149 -7.121 1.00 0.00 H new ATOM 1053 N ALA P 364 -7.898 11.770 -4.512 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.839 12.640 -4.017 1.00 0.00 C ATOM 1055 C ALA P 364 -6.148 11.970 -2.837 1.00 0.00 C ATOM 1056 O ALA P 364 -6.694 11.919 -1.736 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.403 13.993 -3.612 1.00 0.00 C ATOM 0 H ALA P 364 -8.804 12.223 -4.628 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.111 12.807 -4.811 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.597 14.628 -3.245 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.872 14.465 -4.475 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.145 13.857 -2.825 1.00 0.00 H new ATOM 1063 N VAL P 365 -4.963 11.422 -3.080 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.233 10.717 -2.033 1.00 0.00 C ATOM 1065 C VAL P 365 -4.154 11.546 -0.751 1.00 0.00 C ATOM 1066 O VAL P 365 -3.874 12.744 -0.786 1.00 0.00 O ATOM 1067 CB VAL P 365 -2.809 10.304 -2.468 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.378 9.072 -1.704 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.739 10.023 -3.958 1.00 0.00 C ATOM 0 H VAL P 365 -4.491 11.451 -3.984 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.800 9.807 -1.840 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.139 11.135 -2.247 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.373 8.785 -2.014 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.380 9.287 -0.635 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.069 8.255 -1.911 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.722 9.736 -4.227 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.423 9.212 -4.208 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.021 10.919 -4.511 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.428 10.906 0.400 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.420 11.565 1.711 1.00 0.00 C ATOM 1081 C PRO P 366 -3.032 11.632 2.340 1.00 0.00 C ATOM 1082 O PRO P 366 -2.078 11.054 1.821 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.321 10.647 2.534 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.044 9.288 1.986 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.792 9.479 0.512 1.00 0.00 C ATOM 0 HA PRO P 366 -4.745 12.604 1.651 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.086 10.705 3.597 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.372 10.915 2.425 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.180 8.839 2.475 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -5.888 8.620 2.154 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -3.990 8.832 0.156 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.677 9.244 -0.079 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.908 12.321 3.492 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.636 12.436 4.211 1.00 0.00 C ATOM 1095 C PRO P 367 -1.192 11.086 4.744 1.00 0.00 C ATOM 1096 O PRO P 367 -1.655 10.626 5.789 1.00 0.00 O ATOM 1097 CB PRO P 367 -1.959 13.385 5.359 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.411 13.184 5.577 1.00 0.00 C ATOM 1099 CD PRO P 367 -3.993 13.017 4.203 1.00 0.00 C ATOM 0 HA PRO P 367 -0.824 12.792 3.578 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.382 13.145 6.252 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.731 14.419 5.101 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.599 12.306 6.194 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -3.854 14.036 6.092 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.912 12.431 4.218 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.233 13.975 3.743 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.318 10.451 3.992 1.00 0.00 N ATOM 1108 CA ARG P 368 0.199 9.124 4.329 1.00 0.00 C ATOM 1109 C ARG P 368 0.467 8.953 5.821 1.00 0.00 C ATOM 1110 O ARG P 368 0.588 9.918 6.576 1.00 0.00 O ATOM 1111 CB ARG P 368 1.470 8.789 3.528 1.00 0.00 C ATOM 1112 CG ARG P 368 2.074 9.958 2.762 1.00 0.00 C ATOM 1113 CD ARG P 368 2.402 11.123 3.683 1.00 0.00 C ATOM 1114 NE ARG P 368 3.833 11.208 3.969 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.345 11.890 4.991 1.00 0.00 C ATOM 1116 NH1 ARG P 368 3.548 12.547 5.825 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.657 11.917 5.180 1.00 0.00 N ATOM 0 H ARG P 368 0.060 10.834 3.126 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.589 8.423 4.053 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.221 8.397 4.214 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.237 7.993 2.821 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.980 9.630 2.253 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.377 10.288 1.992 1.00 0.00 H new ATOM 0 HD2 ARG P 368 2.068 12.053 3.224 1.00 0.00 H new ATOM 0 HD3 ARG P 368 1.851 11.013 4.617 1.00 0.00 H new ATOM 0 HE ARG P 368 4.477 10.716 3.349 1.00 0.00 H new ATOM 0 HH11 ARG P 368 2.538 12.531 5.684 1.00 0.00 H new ATOM 0 HH12 ARG P 368 3.946 13.068 6.607 1.00 0.00 H new ATOM 0 HH21 ARG P 368 6.275 11.415 4.542 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.049 12.440 5.963 1.00 0.00 H new ATOM 1131 N PRO P 369 0.546 7.683 6.236 1.00 0.00 N ATOM 1132 CA PRO P 369 0.784 7.281 7.629 1.00 0.00 C ATOM 1133 C PRO P 369 1.963 8.008 8.262 1.00 0.00 C ATOM 1134 O PRO P 369 2.648 8.793 7.608 1.00 0.00 O ATOM 1135 CB PRO P 369 1.072 5.787 7.493 1.00 0.00 C ATOM 1136 CG PRO P 369 0.282 5.382 6.296 1.00 0.00 C ATOM 1137 CD PRO P 369 0.398 6.524 5.346 1.00 0.00 C ATOM 0 HA PRO P 369 -0.056 7.519 8.281 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.136 5.595 7.354 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.763 5.237 8.382 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.674 4.464 5.858 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.759 5.191 6.557 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.256 6.412 4.684 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.484 6.612 4.712 1.00 0.00 H new ATOM 1145 N SER P 370 2.189 7.745 9.547 1.00 0.00 N ATOM 1146 CA SER P 370 3.281 8.376 10.275 1.00 0.00 C ATOM 1147 C SER P 370 4.561 7.549 10.185 1.00 0.00 C ATOM 1148 O SER P 370 5.436 7.655 11.044 1.00 0.00 O ATOM 1149 CB SER P 370 2.893 8.573 11.742 1.00 0.00 C ATOM 1150 OG SER P 370 3.748 9.510 12.375 1.00 0.00 O ATOM 0 H SER P 370 1.629 7.099 10.103 1.00 0.00 H new ATOM 0 HA SER P 370 3.470 9.347 9.816 1.00 0.00 H new ATOM 0 HB2 SER P 370 1.861 8.917 11.805 1.00 0.00 H new ATOM 0 HB3 SER P 370 2.943 7.618 12.266 1.00 0.00 H new ATOM 0 HG SER P 370 4.682 9.276 12.192 1.00 0.00 H new ATOM 1156 N ALA P 371 4.668 6.730 9.139 1.00 0.00 N ATOM 1157 CA ALA P 371 5.844 5.890 8.933 1.00 0.00 C ATOM 1158 C ALA P 371 5.946 4.798 9.994 1.00 0.00 C ATOM 1159 O ALA P 371 5.911 3.612 9.684 1.00 0.00 O ATOM 1160 CB ALA P 371 7.108 6.740 8.918 1.00 0.00 C ATOM 0 H ALA P 371 3.951 6.631 8.420 1.00 0.00 H new ATOM 0 HA ALA P 371 5.737 5.401 7.965 1.00 0.00 H new ATOM 0 HB1 ALA P 371 7.976 6.099 8.764 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.047 7.469 8.110 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.207 7.261 9.870 1.00 0.00 H new ATOM 1166 N ASP P 372 6.086 5.199 11.248 1.00 0.00 N ATOM 1167 CA ASP P 372 6.204 4.239 12.343 1.00 0.00 C ATOM 1168 C ASP P 372 5.068 3.221 12.321 1.00 0.00 C ATOM 1169 O ASP P 372 5.328 2.020 12.273 1.00 0.00 O ATOM 1170 CB ASP P 372 6.243 4.959 13.690 1.00 0.00 C ATOM 1171 CG ASP P 372 7.175 4.286 14.679 1.00 0.00 C ATOM 1172 OD1 ASP P 372 7.425 3.071 14.526 1.00 0.00 O ATOM 1173 OD2 ASP P 372 7.654 4.971 15.606 1.00 0.00 O ATOM 0 H ASP P 372 6.121 6.177 11.536 1.00 0.00 H new ATOM 0 HA ASP P 372 7.141 3.699 12.205 1.00 0.00 H new ATOM 0 HB2 ASP P 372 6.562 5.990 13.538 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.237 4.995 14.109 1.00 0.00 H new ATOM 1178 N LEU P 373 3.807 3.672 12.344 1.00 0.00 N ATOM 1179 CA LEU P 373 2.705 2.714 12.308 1.00 0.00 C ATOM 1180 C LEU P 373 2.874 1.812 11.095 1.00 0.00 C ATOM 1181 O LEU P 373 2.482 0.645 11.113 1.00 0.00 O ATOM 1182 CB LEU P 373 1.317 3.384 12.350 1.00 0.00 C ATOM 1183 CG LEU P 373 0.856 4.176 11.119 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.898 3.340 9.852 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.560 4.673 11.343 1.00 0.00 C ATOM 0 H LEU P 373 3.535 4.654 12.386 1.00 0.00 H new ATOM 0 HA LEU P 373 2.747 2.110 13.214 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.578 2.606 12.541 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.299 4.059 13.206 1.00 0.00 H new ATOM 0 HG LEU P 373 1.542 5.013 10.988 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.563 3.942 9.007 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.918 3.000 9.674 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.243 2.476 9.964 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.890 5.236 10.470 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.224 3.823 11.499 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.585 5.318 12.221 1.00 0.00 H new ATOM 1197 N ILE P 374 3.527 2.347 10.062 1.00 0.00 N ATOM 1198 CA ILE P 374 3.823 1.570 8.874 1.00 0.00 C ATOM 1199 C ILE P 374 4.834 0.517 9.277 1.00 0.00 C ATOM 1200 O ILE P 374 4.675 -0.672 9.005 1.00 0.00 O ATOM 1201 CB ILE P 374 4.415 2.438 7.743 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.437 3.544 7.341 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.784 1.578 6.548 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.928 4.402 6.195 1.00 0.00 C ATOM 0 H ILE P 374 3.857 3.312 10.031 1.00 0.00 H new ATOM 0 HA ILE P 374 2.902 1.132 8.490 1.00 0.00 H new ATOM 0 HB ILE P 374 5.324 2.912 8.113 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.485 3.092 7.063 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.247 4.181 8.205 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.200 2.208 5.761 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.524 0.836 6.848 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.894 1.072 6.175 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.183 5.164 5.966 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.865 4.883 6.476 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.091 3.777 5.317 1.00 0.00 H new ATOM 1216 N LEU P 375 5.854 0.986 9.986 1.00 0.00 N ATOM 1217 CA LEU P 375 6.894 0.125 10.508 1.00 0.00 C ATOM 1218 C LEU P 375 6.282 -0.878 11.477 1.00 0.00 C ATOM 1219 O LEU P 375 6.840 -1.942 11.737 1.00 0.00 O ATOM 1220 CB LEU P 375 7.957 0.987 11.196 1.00 0.00 C ATOM 1221 CG LEU P 375 8.712 1.916 10.246 1.00 0.00 C ATOM 1222 CD1 LEU P 375 8.974 3.266 10.896 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.025 1.286 9.801 1.00 0.00 C ATOM 0 H LEU P 375 5.978 1.973 10.212 1.00 0.00 H new ATOM 0 HA LEU P 375 7.369 -0.431 9.700 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.479 1.586 11.971 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.673 0.334 11.695 1.00 0.00 H new ATOM 0 HG LEU P 375 8.085 2.072 9.368 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.512 3.907 10.198 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.025 3.733 11.160 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.572 3.126 11.796 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.544 1.966 9.126 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.650 1.093 10.673 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.822 0.347 9.285 1.00 0.00 H new ATOM 1235 N ASN P 376 5.107 -0.521 11.982 1.00 0.00 N ATOM 1236 CA ASN P 376 4.361 -1.360 12.898 1.00 0.00 C ATOM 1237 C ASN P 376 3.420 -2.284 12.127 1.00 0.00 C ATOM 1238 O ASN P 376 2.950 -3.291 12.658 1.00 0.00 O ATOM 1239 CB ASN P 376 3.547 -0.478 13.848 1.00 0.00 C ATOM 1240 CG ASN P 376 3.663 -0.920 15.294 1.00 0.00 C ATOM 1241 OD1 ASN P 376 3.667 -2.114 15.592 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.757 0.045 16.202 1.00 0.00 N ATOM 0 H ASN P 376 4.647 0.363 11.764 1.00 0.00 H new ATOM 0 HA ASN P 376 5.061 -1.969 13.469 1.00 0.00 H new ATOM 0 HB2 ASN P 376 3.885 0.555 13.759 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.499 -0.498 13.548 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.837 -0.191 17.191 1.00 0.00 H new ATOM 0 HD22 ASN P 376 3.750 1.022 15.910 1.00 0.00 H new ATOM 1249 N ARG P 377 3.122 -1.915 10.878 1.00 0.00 N ATOM 1250 CA ARG P 377 2.210 -2.693 10.052 1.00 0.00 C ATOM 1251 C ARG P 377 2.731 -2.875 8.618 1.00 0.00 C ATOM 1252 O ARG P 377 1.957 -2.803 7.664 1.00 0.00 O ATOM 1253 CB ARG P 377 0.832 -2.011 10.020 1.00 0.00 C ATOM 1254 CG ARG P 377 0.430 -1.350 11.337 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.363 -0.070 11.107 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.803 -0.318 11.093 1.00 0.00 N ATOM 1257 CZ ARG P 377 -2.560 -0.364 12.189 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -2.017 -0.189 13.389 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -3.862 -0.591 12.084 1.00 0.00 N ATOM 0 H ARG P 377 3.500 -1.084 10.423 1.00 0.00 H new ATOM 0 HA ARG P 377 2.130 -3.684 10.498 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.830 -1.257 9.233 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.078 -2.752 9.753 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.166 -2.046 11.926 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.324 -1.125 11.919 1.00 0.00 H new ATOM 0 HD2 ARG P 377 -0.126 0.650 11.890 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -0.062 0.379 10.160 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.256 -0.465 10.191 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -1.015 -0.018 13.475 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.602 -0.225 14.224 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -4.283 -0.730 11.165 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -4.443 -0.627 12.922 1.00 0.00 H new ATOM 1273 N CYS P 378 4.032 -3.130 8.466 1.00 0.00 N ATOM 1274 CA CYS P 378 4.616 -3.338 7.136 1.00 0.00 C ATOM 1275 C CYS P 378 5.890 -4.176 7.206 1.00 0.00 C ATOM 1276 O CYS P 378 6.329 -4.574 8.286 1.00 0.00 O ATOM 1277 CB CYS P 378 4.923 -2.006 6.442 1.00 0.00 C ATOM 1278 SG CYS P 378 3.471 -1.179 5.763 1.00 0.00 S ATOM 0 H CYS P 378 4.696 -3.197 9.237 1.00 0.00 H new ATOM 0 HA CYS P 378 3.871 -3.878 6.552 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.407 -1.340 7.156 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.636 -2.184 5.637 1.00 0.00 H new ATOM 0 HG CYS P 378 2.396 -1.788 6.168 1.00 0.00 H new ATOM 1284 N SER P 379 6.478 -4.434 6.040 1.00 0.00 N ATOM 1285 CA SER P 379 7.704 -5.219 5.949 1.00 0.00 C ATOM 1286 C SER P 379 8.931 -4.332 6.125 1.00 0.00 C ATOM 1287 O SER P 379 8.816 -3.111 6.233 1.00 0.00 O ATOM 1288 CB SER P 379 7.778 -5.938 4.600 1.00 0.00 C ATOM 1289 OG SER P 379 9.024 -6.594 4.440 1.00 0.00 O ATOM 0 H SER P 379 6.122 -4.108 5.141 1.00 0.00 H new ATOM 0 HA SER P 379 7.689 -5.959 6.749 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.969 -6.665 4.527 1.00 0.00 H new ATOM 0 HB3 SER P 379 7.635 -5.219 3.793 1.00 0.00 H new ATOM 0 HG SER P 379 9.046 -7.047 3.571 1.00 0.00 H new ATOM 1295 N GLU P 380 10.106 -4.954 6.148 1.00 0.00 N ATOM 1296 CA GLU P 380 11.356 -4.219 6.303 1.00 0.00 C ATOM 1297 C GLU P 380 11.653 -3.383 5.064 1.00 0.00 C ATOM 1298 O GLU P 380 12.261 -2.317 5.154 1.00 0.00 O ATOM 1299 CB GLU P 380 12.511 -5.187 6.570 1.00 0.00 C ATOM 1300 CG GLU P 380 12.726 -5.487 8.044 1.00 0.00 C ATOM 1301 CD GLU P 380 13.769 -4.585 8.675 1.00 0.00 C ATOM 1302 OE1 GLU P 380 13.723 -3.362 8.431 1.00 0.00 O ATOM 1303 OE2 GLU P 380 14.633 -5.103 9.414 1.00 0.00 O ATOM 0 H GLU P 380 10.218 -5.964 6.061 1.00 0.00 H new ATOM 0 HA GLU P 380 11.250 -3.547 7.155 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.320 -6.121 6.042 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.428 -4.768 6.156 1.00 0.00 H new ATOM 0 HG2 GLU P 380 11.782 -5.372 8.576 1.00 0.00 H new ATOM 0 HG3 GLU P 380 13.032 -6.527 8.159 1.00 0.00 H new ATOM 1310 N SER P 381 11.217 -3.873 3.907 1.00 0.00 N ATOM 1311 CA SER P 381 11.434 -3.169 2.647 1.00 0.00 C ATOM 1312 C SER P 381 10.816 -1.776 2.693 1.00 0.00 C ATOM 1313 O SER P 381 11.525 -0.770 2.658 1.00 0.00 O ATOM 1314 CB SER P 381 10.842 -3.966 1.484 1.00 0.00 C ATOM 1315 OG SER P 381 11.225 -3.410 0.238 1.00 0.00 O ATOM 0 H SER P 381 10.712 -4.754 3.816 1.00 0.00 H new ATOM 0 HA SER P 381 12.509 -3.066 2.495 1.00 0.00 H new ATOM 0 HB2 SER P 381 11.176 -5.002 1.542 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.755 -3.977 1.562 1.00 0.00 H new ATOM 0 HG SER P 381 11.274 -4.120 -0.436 1.00 0.00 H new ATOM 1321 N THR P 382 9.490 -1.725 2.778 1.00 0.00 N ATOM 1322 CA THR P 382 8.777 -0.453 2.835 1.00 0.00 C ATOM 1323 C THR P 382 9.232 0.362 4.039 1.00 0.00 C ATOM 1324 O THR P 382 9.275 1.589 3.993 1.00 0.00 O ATOM 1325 CB THR P 382 7.266 -0.695 2.909 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.803 -1.340 1.736 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.460 0.576 3.081 1.00 0.00 C ATOM 0 H THR P 382 8.888 -2.548 2.809 1.00 0.00 H new ATOM 0 HA THR P 382 9.003 0.108 1.928 1.00 0.00 H new ATOM 0 HB THR P 382 7.119 -1.320 3.790 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.893 -1.672 1.883 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.399 0.331 3.126 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.757 1.073 4.005 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.643 1.240 2.236 1.00 0.00 H new ATOM 1335 N LYS P 383 9.563 -0.336 5.118 1.00 0.00 N ATOM 1336 CA LYS P 383 10.010 0.311 6.344 1.00 0.00 C ATOM 1337 C LYS P 383 11.270 1.138 6.103 1.00 0.00 C ATOM 1338 O LYS P 383 11.449 2.202 6.698 1.00 0.00 O ATOM 1339 CB LYS P 383 10.272 -0.738 7.422 1.00 0.00 C ATOM 1340 CG LYS P 383 9.017 -1.161 8.160 1.00 0.00 C ATOM 1341 CD LYS P 383 9.229 -2.452 8.935 1.00 0.00 C ATOM 1342 CE LYS P 383 10.148 -2.243 10.129 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.515 -3.529 10.781 1.00 0.00 N ATOM 0 H LYS P 383 9.530 -1.354 5.168 1.00 0.00 H new ATOM 0 HA LYS P 383 9.221 0.984 6.679 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.729 -1.615 6.963 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.991 -0.342 8.139 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.714 -0.370 8.846 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.203 -1.294 7.447 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.267 -2.834 9.278 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.655 -3.208 8.275 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.053 -1.730 9.804 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.657 -1.595 10.855 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.937 -3.338 11.712 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.663 -4.113 10.900 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.202 -4.036 10.187 1.00 0.00 H new ATOM 1357 N ARG P 384 12.141 0.643 5.232 1.00 0.00 N ATOM 1358 CA ARG P 384 13.383 1.338 4.915 1.00 0.00 C ATOM 1359 C ARG P 384 13.112 2.665 4.208 1.00 0.00 C ATOM 1360 O ARG P 384 14.002 3.508 4.093 1.00 0.00 O ATOM 1361 CB ARG P 384 14.277 0.455 4.042 1.00 0.00 C ATOM 1362 CG ARG P 384 15.179 -0.474 4.836 1.00 0.00 C ATOM 1363 CD ARG P 384 15.434 -1.777 4.093 1.00 0.00 C ATOM 1364 NE ARG P 384 16.813 -1.874 3.618 1.00 0.00 N ATOM 1365 CZ ARG P 384 17.263 -1.274 2.520 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.450 -0.532 1.778 1.00 0.00 N ATOM 1367 NH2 ARG P 384 18.532 -1.414 2.162 1.00 0.00 N ATOM 0 H ARG P 384 12.010 -0.237 4.733 1.00 0.00 H new ATOM 0 HA ARG P 384 13.895 1.551 5.854 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.649 -0.141 3.380 1.00 0.00 H new ATOM 0 HB3 ARG P 384 14.894 1.092 3.408 1.00 0.00 H new ATOM 0 HG2 ARG P 384 16.128 0.023 5.036 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.721 -0.689 5.802 1.00 0.00 H new ATOM 0 HD2 ARG P 384 15.217 -2.618 4.751 1.00 0.00 H new ATOM 0 HD3 ARG P 384 14.752 -1.851 3.246 1.00 0.00 H new ATOM 0 HE ARG P 384 17.469 -2.435 4.161 1.00 0.00 H new ATOM 0 HH11 ARG P 384 15.473 -0.419 2.049 1.00 0.00 H new ATOM 0 HH12 ARG P 384 16.802 -0.075 0.937 1.00 0.00 H new ATOM 0 HH21 ARG P 384 19.162 -1.982 2.729 1.00 0.00 H new ATOM 0 HH22 ARG P 384 18.878 -0.954 1.320 1.00 0.00 H new ATOM 1381 N LYS P 385 11.883 2.842 3.730 1.00 0.00 N ATOM 1382 CA LYS P 385 11.505 4.065 3.031 1.00 0.00 C ATOM 1383 C LYS P 385 10.851 5.070 3.978 1.00 0.00 C ATOM 1384 O LYS P 385 10.123 5.963 3.543 1.00 0.00 O ATOM 1385 CB LYS P 385 10.551 3.736 1.881 1.00 0.00 C ATOM 1386 CG LYS P 385 11.194 2.905 0.780 1.00 0.00 C ATOM 1387 CD LYS P 385 10.478 1.578 0.587 1.00 0.00 C ATOM 1388 CE LYS P 385 10.527 1.125 -0.863 1.00 0.00 C ATOM 1389 NZ LYS P 385 11.820 0.466 -1.196 1.00 0.00 N ATOM 0 H LYS P 385 11.134 2.155 3.814 1.00 0.00 H new ATOM 0 HA LYS P 385 12.413 4.518 2.633 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.690 3.197 2.276 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.176 4.666 1.452 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.180 3.466 -0.155 1.00 0.00 H new ATOM 0 HG3 LYS P 385 12.240 2.722 1.026 1.00 0.00 H new ATOM 0 HD2 LYS P 385 10.937 0.820 1.222 1.00 0.00 H new ATOM 0 HD3 LYS P 385 9.440 1.674 0.905 1.00 0.00 H new ATOM 0 HE2 LYS P 385 9.707 0.433 -1.055 1.00 0.00 H new ATOM 0 HE3 LYS P 385 10.379 1.984 -1.517 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 11.813 0.172 -2.194 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 12.601 1.134 -1.037 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 11.950 -0.369 -0.590 1.00 0.00 H new ATOM 1403 N LEU P 386 11.115 4.921 5.273 1.00 0.00 N ATOM 1404 CA LEU P 386 10.555 5.819 6.281 1.00 0.00 C ATOM 1405 C LEU P 386 11.363 5.766 7.572 1.00 0.00 C ATOM 1406 O LEU P 386 12.030 6.735 7.936 1.00 0.00 O ATOM 1407 CB LEU P 386 9.086 5.473 6.560 1.00 0.00 C ATOM 1408 CG LEU P 386 8.706 4.004 6.354 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.791 3.526 7.468 1.00 0.00 C ATOM 1410 CD2 LEU P 386 8.034 3.813 5.000 1.00 0.00 C ATOM 0 H LEU P 386 11.714 4.186 5.650 1.00 0.00 H new ATOM 0 HA LEU P 386 10.606 6.834 5.887 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.854 5.750 7.589 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.457 6.087 5.915 1.00 0.00 H new ATOM 0 HG LEU P 386 9.618 3.408 6.378 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.533 2.480 7.303 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.301 3.627 8.426 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.882 4.127 7.475 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.770 2.763 4.869 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.132 4.422 4.952 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.719 4.116 4.208 1.00 0.00 H new