USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=16 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 Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.898 X(o=-0.9,f=-0.71) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= -0.317 K(o=-0.32,f=-2.8!) USER MOD Single : P 378 CYS SG : rot -113:sc= -9.31! USER MOD Single : P 379 SER OG : rot 180:sc= 0 USER MOD Single : P 381 SER OG : rot -140:sc= -0.255 USER MOD Single : P 382 THR OG1 : rot 178:sc= -3.93! USER MOD Single : P 383 LYS NZ :NH3+ -148:sc= 0 (180deg=-0.449) USER MOD Single : P 385 LYS NZ :NH3+ 141:sc= 0.37 (180deg=-1.43!) USER MOD Single : S 460 SER OG : rot 30:sc= 0.25 USER MOD Single : S 461 GLN : amide:sc= -0.0104 K(o=-0.01,f=-1.3!) USER MOD Single : S 467 SER OG : rot 180:sc= 0.602 USER MOD Single : S 468 TYR OH : rot -87:sc= 0.691 USER MOD Single : S 471 THR OG1 : rot 180:sc= 0.0297 USER MOD Single : S 472 GLN : amide:sc= -3.06 K(o=-3.1,f=-4.6!) USER MOD Single : S 479 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 488 SER OG : rot 180:sc= 0.0319 USER MOD Single : S 489 LYS NZ :NH3+ -144:sc= 0.116 (180deg=-0.0478) USER MOD Single : S 491 ASN : amide:sc= -6.79! C(o=-6.8!,f=-21!) USER MOD Single : S 499 SER OG : rot 180:sc= -0.268 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ -129:sc= 0 (180deg=-0.598) USER MOD Single : S 508 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0381) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.405 -10.423 2.005 1.00 0.00 N ATOM 91 CA SER S 460 -4.745 -10.371 1.437 1.00 0.00 C ATOM 92 C SER S 460 -4.675 -9.793 0.028 1.00 0.00 C ATOM 93 O SER S 460 -3.594 -9.717 -0.556 1.00 0.00 O ATOM 94 CB SER S 460 -5.666 -9.524 2.313 1.00 0.00 C ATOM 95 OG SER S 460 -5.503 -9.840 3.684 1.00 0.00 O ATOM 0 HA SER S 460 -5.153 -11.381 1.393 1.00 0.00 H new ATOM 0 HB2 SER S 460 -5.453 -8.467 2.153 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.703 -9.688 2.020 1.00 0.00 H new ATOM 0 HG SER S 460 -4.582 -10.135 3.844 1.00 0.00 H new ATOM 101 N GLN S 461 -5.811 -9.378 -0.522 1.00 0.00 N ATOM 102 CA GLN S 461 -5.813 -8.809 -1.867 1.00 0.00 C ATOM 103 C GLN S 461 -6.956 -7.826 -2.073 1.00 0.00 C ATOM 104 O GLN S 461 -7.998 -7.912 -1.421 1.00 0.00 O ATOM 105 CB GLN S 461 -5.894 -9.909 -2.931 1.00 0.00 C ATOM 106 CG GLN S 461 -5.259 -11.226 -2.511 1.00 0.00 C ATOM 107 CD GLN S 461 -5.566 -12.353 -3.475 1.00 0.00 C ATOM 108 OE1 GLN S 461 -6.520 -12.282 -4.251 1.00 0.00 O ATOM 109 NE2 GLN S 461 -4.755 -13.406 -3.433 1.00 0.00 N ATOM 0 H GLN S 461 -6.724 -9.422 -0.070 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.873 -8.268 -1.974 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.941 -10.085 -3.178 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.407 -9.557 -3.840 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -4.179 -11.098 -2.439 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -5.615 -11.496 -1.517 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -3.976 -13.424 -2.775 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -4.912 -14.196 -4.059 1.00 0.00 H new ATOM 118 N VAL S 462 -6.741 -6.894 -2.995 1.00 0.00 N ATOM 119 CA VAL S 462 -7.731 -5.878 -3.322 1.00 0.00 C ATOM 120 C VAL S 462 -7.445 -5.273 -4.690 1.00 0.00 C ATOM 121 O VAL S 462 -6.526 -4.465 -4.839 1.00 0.00 O ATOM 122 CB VAL S 462 -7.736 -4.750 -2.277 1.00 0.00 C ATOM 123 CG1 VAL S 462 -8.266 -5.252 -0.943 1.00 0.00 C ATOM 124 CG2 VAL S 462 -6.338 -4.175 -2.125 1.00 0.00 C ATOM 0 H VAL S 462 -5.878 -6.823 -3.534 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.706 -6.366 -3.329 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.401 -3.958 -2.621 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -8.260 -4.437 -0.219 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -9.285 -5.617 -1.070 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -7.633 -6.062 -0.582 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -6.352 -3.377 -1.383 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -5.655 -4.960 -1.801 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.003 -3.775 -3.082 1.00 0.00 H new ATOM 134 N GLU S 463 -8.229 -5.662 -5.693 1.00 0.00 N ATOM 135 CA GLU S 463 -8.050 -5.149 -7.048 1.00 0.00 C ATOM 136 C GLU S 463 -7.855 -3.636 -7.042 1.00 0.00 C ATOM 137 O GLU S 463 -8.363 -2.940 -6.162 1.00 0.00 O ATOM 138 CB GLU S 463 -9.256 -5.515 -7.914 1.00 0.00 C ATOM 139 CG GLU S 463 -9.008 -6.710 -8.815 1.00 0.00 C ATOM 140 CD GLU S 463 -10.282 -7.244 -9.442 1.00 0.00 C ATOM 141 OE1 GLU S 463 -11.233 -7.546 -8.690 1.00 0.00 O ATOM 142 OE2 GLU S 463 -10.329 -7.360 -10.686 1.00 0.00 O ATOM 0 H GLU S 463 -8.993 -6.330 -5.593 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.154 -5.608 -7.466 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -10.108 -5.727 -7.268 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.528 -4.656 -8.528 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -8.311 -6.427 -9.603 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -8.532 -7.503 -8.238 1.00 0.00 H new ATOM 149 N ALA S 464 -7.121 -3.132 -8.027 1.00 0.00 N ATOM 150 CA ALA S 464 -6.872 -1.703 -8.126 1.00 0.00 C ATOM 151 C ALA S 464 -7.952 -1.039 -8.964 1.00 0.00 C ATOM 152 O ALA S 464 -8.636 -1.699 -9.744 1.00 0.00 O ATOM 153 CB ALA S 464 -5.498 -1.435 -8.725 1.00 0.00 C ATOM 0 H ALA S 464 -6.691 -3.690 -8.764 1.00 0.00 H new ATOM 0 HA ALA S 464 -6.895 -1.279 -7.122 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.333 -0.360 -8.790 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -4.732 -1.882 -8.092 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.445 -1.871 -9.723 1.00 0.00 H new ATOM 159 N LEU S 465 -8.115 0.260 -8.787 1.00 0.00 N ATOM 160 CA LEU S 465 -9.129 1.000 -9.524 1.00 0.00 C ATOM 161 C LEU S 465 -8.618 2.361 -9.989 1.00 0.00 C ATOM 162 O LEU S 465 -9.332 3.099 -10.668 1.00 0.00 O ATOM 163 CB LEU S 465 -10.360 1.181 -8.647 1.00 0.00 C ATOM 164 CG LEU S 465 -11.002 -0.123 -8.174 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.378 -0.585 -6.868 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.506 0.048 -8.019 1.00 0.00 C ATOM 0 H LEU S 465 -7.562 0.824 -8.142 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.384 0.425 -10.414 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.084 1.772 -7.774 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.102 1.756 -9.200 1.00 0.00 H new ATOM 0 HG LEU S 465 -10.820 -0.888 -8.928 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.849 -1.515 -6.549 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.310 -0.750 -7.013 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.526 0.178 -6.104 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -12.946 -0.890 -7.682 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.710 0.829 -7.286 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -12.941 0.329 -8.978 1.00 0.00 H new ATOM 178 N PHE S 466 -7.388 2.699 -9.615 1.00 0.00 N ATOM 179 CA PHE S 466 -6.806 3.976 -9.996 1.00 0.00 C ATOM 180 C PHE S 466 -5.305 3.871 -10.215 1.00 0.00 C ATOM 181 O PHE S 466 -4.615 3.110 -9.536 1.00 0.00 O ATOM 182 CB PHE S 466 -7.072 5.016 -8.916 1.00 0.00 C ATOM 183 CG PHE S 466 -8.516 5.144 -8.543 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.426 5.659 -9.447 1.00 0.00 C ATOM 185 CD2 PHE S 466 -8.959 4.761 -7.288 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.755 5.790 -9.108 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.288 4.895 -6.942 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.185 5.411 -7.856 1.00 0.00 C ATOM 0 H PHE S 466 -6.779 2.107 -9.050 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.273 4.276 -10.934 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.498 4.757 -8.026 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.708 5.984 -9.260 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.092 5.962 -10.428 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.258 4.354 -6.574 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.459 6.189 -9.823 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.625 4.597 -5.960 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.226 5.518 -7.588 1.00 0.00 H new ATOM 198 N SER S 467 -4.804 4.671 -11.145 1.00 0.00 N ATOM 199 CA SER S 467 -3.379 4.705 -11.435 1.00 0.00 C ATOM 200 C SER S 467 -2.701 5.689 -10.490 1.00 0.00 C ATOM 201 O SER S 467 -2.569 6.874 -10.796 1.00 0.00 O ATOM 202 CB SER S 467 -3.133 5.111 -12.889 1.00 0.00 C ATOM 203 OG SER S 467 -3.519 4.079 -13.780 1.00 0.00 O ATOM 0 H SER S 467 -5.365 5.306 -11.712 1.00 0.00 H new ATOM 0 HA SER S 467 -2.960 3.710 -11.288 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.692 6.019 -13.116 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.077 5.342 -13.031 1.00 0.00 H new ATOM 0 HG SER S 467 -3.353 4.364 -14.703 1.00 0.00 H new ATOM 209 N TYR S 468 -2.303 5.193 -9.324 1.00 0.00 N ATOM 210 CA TYR S 468 -1.673 6.029 -8.310 1.00 0.00 C ATOM 211 C TYR S 468 -0.204 6.281 -8.607 1.00 0.00 C ATOM 212 O TYR S 468 0.667 5.559 -8.120 1.00 0.00 O ATOM 213 CB TYR S 468 -1.806 5.369 -6.934 1.00 0.00 C ATOM 214 CG TYR S 468 -1.182 6.160 -5.798 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.831 7.499 -5.955 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.934 5.561 -4.568 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.255 8.212 -4.919 1.00 0.00 C ATOM 218 CE2 TYR S 468 -0.358 6.270 -3.530 1.00 0.00 C ATOM 219 CZ TYR S 468 -0.021 7.594 -3.712 1.00 0.00 C ATOM 220 OH TYR S 468 0.556 8.302 -2.682 1.00 0.00 O ATOM 0 H TYR S 468 -2.406 4.214 -9.057 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.186 6.991 -8.318 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.863 5.217 -6.718 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.344 4.383 -6.971 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.012 7.988 -6.901 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -1.196 4.524 -4.421 1.00 0.00 H new ATOM 0 HE1 TYR S 468 0.010 9.250 -5.057 1.00 0.00 H new ATOM 0 HE2 TYR S 468 -0.173 5.789 -2.581 1.00 0.00 H new ATOM 0 HH TYR S 468 1.532 8.253 -2.758 1.00 0.00 H new ATOM 230 N GLU S 469 0.077 7.327 -9.376 1.00 0.00 N ATOM 231 CA GLU S 469 1.454 7.673 -9.684 1.00 0.00 C ATOM 232 C GLU S 469 2.152 8.102 -8.406 1.00 0.00 C ATOM 233 O GLU S 469 2.010 9.235 -7.947 1.00 0.00 O ATOM 234 CB GLU S 469 1.530 8.784 -10.720 1.00 0.00 C ATOM 235 CG GLU S 469 2.954 9.154 -11.095 1.00 0.00 C ATOM 236 CD GLU S 469 3.016 10.220 -12.172 1.00 0.00 C ATOM 237 OE1 GLU S 469 2.109 10.251 -13.030 1.00 0.00 O ATOM 238 OE2 GLU S 469 3.971 11.025 -12.157 1.00 0.00 O ATOM 0 H GLU S 469 -0.623 7.942 -9.792 1.00 0.00 H new ATOM 0 HA GLU S 469 1.949 6.798 -10.105 1.00 0.00 H new ATOM 0 HB2 GLU S 469 0.994 8.473 -11.617 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.021 9.667 -10.334 1.00 0.00 H new ATOM 0 HG2 GLU S 469 3.479 9.508 -10.208 1.00 0.00 H new ATOM 0 HG3 GLU S 469 3.478 8.263 -11.441 1.00 0.00 H new ATOM 245 N ALA S 470 2.879 7.169 -7.831 1.00 0.00 N ATOM 246 CA ALA S 470 3.590 7.398 -6.584 1.00 0.00 C ATOM 247 C ALA S 470 4.874 8.188 -6.801 1.00 0.00 C ATOM 248 O ALA S 470 5.702 7.837 -7.640 1.00 0.00 O ATOM 249 CB ALA S 470 3.881 6.065 -5.914 1.00 0.00 C ATOM 0 H ALA S 470 2.996 6.230 -8.211 1.00 0.00 H new ATOM 0 HA ALA S 470 2.955 7.999 -5.933 1.00 0.00 H new ATOM 0 HB1 ALA S 470 4.414 6.237 -4.979 1.00 0.00 H new ATOM 0 HB2 ALA S 470 2.943 5.549 -5.708 1.00 0.00 H new ATOM 0 HB3 ALA S 470 4.495 5.452 -6.574 1.00 0.00 H new ATOM 255 N THR S 471 5.029 9.260 -6.028 1.00 0.00 N ATOM 256 CA THR S 471 6.210 10.107 -6.123 1.00 0.00 C ATOM 257 C THR S 471 7.200 9.773 -5.013 1.00 0.00 C ATOM 258 O THR S 471 8.412 9.875 -5.198 1.00 0.00 O ATOM 259 CB THR S 471 5.814 11.583 -6.042 1.00 0.00 C ATOM 260 OG1 THR S 471 4.647 11.748 -5.257 1.00 0.00 O ATOM 261 CG2 THR S 471 5.548 12.206 -7.397 1.00 0.00 C ATOM 0 H THR S 471 4.350 9.561 -5.329 1.00 0.00 H new ATOM 0 HA THR S 471 6.688 9.921 -7.085 1.00 0.00 H new ATOM 0 HB THR S 471 6.668 12.086 -5.589 1.00 0.00 H new ATOM 0 HG1 THR S 471 4.412 12.698 -5.216 1.00 0.00 H new ATOM 0 HG21 THR S 471 5.272 13.253 -7.268 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.447 12.140 -8.010 1.00 0.00 H new ATOM 0 HG23 THR S 471 4.733 11.674 -7.888 1.00 0.00 H new ATOM 269 N GLN S 472 6.675 9.364 -3.862 1.00 0.00 N ATOM 270 CA GLN S 472 7.517 9.006 -2.728 1.00 0.00 C ATOM 271 C GLN S 472 7.857 7.516 -2.761 1.00 0.00 C ATOM 272 O GLN S 472 7.132 6.719 -3.356 1.00 0.00 O ATOM 273 CB GLN S 472 6.839 9.377 -1.407 1.00 0.00 C ATOM 274 CG GLN S 472 5.528 8.653 -1.162 1.00 0.00 C ATOM 275 CD GLN S 472 4.779 9.201 0.037 1.00 0.00 C ATOM 276 OE1 GLN S 472 3.751 9.861 -0.106 1.00 0.00 O ATOM 277 NE2 GLN S 472 5.296 8.928 1.229 1.00 0.00 N ATOM 0 H GLN S 472 5.674 9.273 -3.691 1.00 0.00 H new ATOM 0 HA GLN S 472 8.446 9.572 -2.802 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.522 9.159 -0.586 1.00 0.00 H new ATOM 0 HB3 GLN S 472 6.657 10.452 -1.393 1.00 0.00 H new ATOM 0 HG2 GLN S 472 4.899 8.736 -2.048 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.725 7.592 -1.010 1.00 0.00 H new ATOM 0 HE21 GLN S 472 6.151 8.376 1.300 1.00 0.00 H new ATOM 0 HE22 GLN S 472 4.838 9.270 2.074 1.00 0.00 H new ATOM 286 N PRO S 473 8.982 7.129 -2.142 1.00 0.00 N ATOM 287 CA PRO S 473 9.445 5.736 -2.117 1.00 0.00 C ATOM 288 C PRO S 473 8.410 4.739 -1.590 1.00 0.00 C ATOM 289 O PRO S 473 7.851 3.954 -2.355 1.00 0.00 O ATOM 290 CB PRO S 473 10.670 5.772 -1.184 1.00 0.00 C ATOM 291 CG PRO S 473 10.603 7.089 -0.488 1.00 0.00 C ATOM 292 CD PRO S 473 9.913 8.022 -1.436 1.00 0.00 C ATOM 0 HA PRO S 473 9.658 5.388 -3.128 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.643 4.949 -0.470 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.597 5.674 -1.749 1.00 0.00 H new ATOM 0 HG2 PRO S 473 10.053 7.008 0.449 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.601 7.451 -0.241 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.389 8.820 -0.910 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.616 8.498 -2.120 1.00 0.00 H new ATOM 300 N GLU S 474 8.192 4.744 -0.277 1.00 0.00 N ATOM 301 CA GLU S 474 7.261 3.807 0.355 1.00 0.00 C ATOM 302 C GLU S 474 5.923 3.699 -0.391 1.00 0.00 C ATOM 303 O GLU S 474 5.287 2.647 -0.373 1.00 0.00 O ATOM 304 CB GLU S 474 7.031 4.182 1.825 1.00 0.00 C ATOM 305 CG GLU S 474 5.998 5.277 2.048 1.00 0.00 C ATOM 306 CD GLU S 474 6.563 6.473 2.787 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.637 6.967 2.385 1.00 0.00 O ATOM 308 OE2 GLU S 474 5.932 6.915 3.771 1.00 0.00 O ATOM 0 H GLU S 474 8.647 5.386 0.372 1.00 0.00 H new ATOM 0 HA GLU S 474 7.727 2.823 0.306 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.718 3.290 2.369 1.00 0.00 H new ATOM 0 HB3 GLU S 474 7.979 4.503 2.257 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.606 5.603 1.084 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.159 4.870 2.612 1.00 0.00 H new ATOM 315 N ASP S 475 5.497 4.779 -1.040 1.00 0.00 N ATOM 316 CA ASP S 475 4.236 4.773 -1.772 1.00 0.00 C ATOM 317 C ASP S 475 4.281 3.795 -2.941 1.00 0.00 C ATOM 318 O ASP S 475 4.974 4.025 -3.933 1.00 0.00 O ATOM 319 CB ASP S 475 3.915 6.173 -2.283 1.00 0.00 C ATOM 320 CG ASP S 475 3.101 6.981 -1.290 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.786 6.448 -0.206 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.777 8.147 -1.599 1.00 0.00 O ATOM 0 H ASP S 475 6.003 5.664 -1.074 1.00 0.00 H new ATOM 0 HA ASP S 475 3.453 4.451 -1.085 1.00 0.00 H new ATOM 0 HB2 ASP S 475 4.845 6.699 -2.500 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.366 6.097 -3.221 1.00 0.00 H new ATOM 327 N LEU S 476 3.523 2.714 -2.821 1.00 0.00 N ATOM 328 CA LEU S 476 3.453 1.705 -3.866 1.00 0.00 C ATOM 329 C LEU S 476 2.515 2.175 -4.969 1.00 0.00 C ATOM 330 O LEU S 476 1.299 2.199 -4.786 1.00 0.00 O ATOM 331 CB LEU S 476 2.958 0.367 -3.294 1.00 0.00 C ATOM 332 CG LEU S 476 2.388 -0.613 -4.327 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.490 -1.136 -5.227 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.658 -1.759 -3.651 1.00 0.00 C ATOM 0 H LEU S 476 2.945 2.514 -2.005 1.00 0.00 H new ATOM 0 HA LEU S 476 4.452 1.557 -4.277 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.786 -0.117 -2.776 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.190 0.571 -2.548 1.00 0.00 H new ATOM 0 HG LEU S 476 1.666 -0.074 -4.941 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.068 -1.830 -5.954 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.958 -0.303 -5.751 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.238 -1.652 -4.625 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.265 -2.437 -4.408 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.349 -2.299 -3.004 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.835 -1.365 -3.055 1.00 0.00 H new ATOM 346 N GLU S 477 3.077 2.547 -6.111 1.00 0.00 N ATOM 347 CA GLU S 477 2.257 3.011 -7.218 1.00 0.00 C ATOM 348 C GLU S 477 1.648 1.850 -7.965 1.00 0.00 C ATOM 349 O GLU S 477 2.123 0.716 -7.890 1.00 0.00 O ATOM 350 CB GLU S 477 3.055 3.872 -8.199 1.00 0.00 C ATOM 351 CG GLU S 477 4.037 3.099 -9.066 1.00 0.00 C ATOM 352 CD GLU S 477 5.285 2.681 -8.313 1.00 0.00 C ATOM 353 OE1 GLU S 477 5.237 1.653 -7.607 1.00 0.00 O ATOM 354 OE2 GLU S 477 6.312 3.384 -8.430 1.00 0.00 O ATOM 0 H GLU S 477 4.081 2.537 -6.293 1.00 0.00 H new ATOM 0 HA GLU S 477 1.465 3.621 -6.783 1.00 0.00 H new ATOM 0 HB2 GLU S 477 2.357 4.402 -8.847 1.00 0.00 H new ATOM 0 HB3 GLU S 477 3.604 4.627 -7.636 1.00 0.00 H new ATOM 0 HG2 GLU S 477 3.544 2.212 -9.463 1.00 0.00 H new ATOM 0 HG3 GLU S 477 4.322 3.714 -9.920 1.00 0.00 H new ATOM 361 N PHE S 478 0.604 2.153 -8.702 1.00 0.00 N ATOM 362 CA PHE S 478 -0.079 1.136 -9.498 1.00 0.00 C ATOM 363 C PHE S 478 -0.923 1.770 -10.596 1.00 0.00 C ATOM 364 O PHE S 478 -1.022 2.994 -10.689 1.00 0.00 O ATOM 365 CB PHE S 478 -0.942 0.230 -8.613 1.00 0.00 C ATOM 366 CG PHE S 478 -1.416 0.882 -7.346 1.00 0.00 C ATOM 367 CD1 PHE S 478 -2.486 1.756 -7.371 1.00 0.00 C ATOM 368 CD2 PHE S 478 -0.795 0.617 -6.135 1.00 0.00 C ATOM 369 CE1 PHE S 478 -2.933 2.360 -6.213 1.00 0.00 C ATOM 370 CE2 PHE S 478 -1.237 1.219 -4.973 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.308 2.092 -5.013 1.00 0.00 C ATOM 0 H PHE S 478 0.204 3.089 -8.773 1.00 0.00 H new ATOM 0 HA PHE S 478 0.687 0.522 -9.971 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.809 -0.100 -9.185 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.370 -0.662 -8.358 1.00 0.00 H new ATOM 0 HD1 PHE S 478 -2.979 1.969 -8.308 1.00 0.00 H new ATOM 0 HD2 PHE S 478 0.041 -0.066 -6.100 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -3.770 3.041 -6.247 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -0.746 1.008 -4.034 1.00 0.00 H new ATOM 0 HZ PHE S 478 -2.655 2.564 -4.106 1.00 0.00 H new ATOM 381 N GLN S 479 -1.521 0.927 -11.433 1.00 0.00 N ATOM 382 CA GLN S 479 -2.350 1.402 -12.536 1.00 0.00 C ATOM 383 C GLN S 479 -3.806 0.996 -12.344 1.00 0.00 C ATOM 384 O GLN S 479 -4.106 0.008 -11.675 1.00 0.00 O ATOM 385 CB GLN S 479 -1.829 0.847 -13.863 1.00 0.00 C ATOM 386 CG GLN S 479 -1.891 -0.670 -13.954 1.00 0.00 C ATOM 387 CD GLN S 479 -0.721 -1.256 -14.721 1.00 0.00 C ATOM 388 OE1 GLN S 479 -0.822 -1.530 -15.916 1.00 0.00 O ATOM 389 NE2 GLN S 479 0.397 -1.453 -14.033 1.00 0.00 N ATOM 0 H GLN S 479 -1.447 -0.088 -11.368 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.297 2.491 -12.552 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.410 1.276 -14.680 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.797 1.169 -14.002 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -1.909 -1.090 -12.948 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.822 -0.964 -14.439 1.00 0.00 H new ATOM 0 HE21 GLN S 479 0.436 -1.211 -13.043 1.00 0.00 H new ATOM 0 HE22 GLN S 479 1.217 -1.846 -14.494 1.00 0.00 H new ATOM 398 N GLU S 480 -4.711 1.771 -12.940 1.00 0.00 N ATOM 399 CA GLU S 480 -6.140 1.503 -12.844 1.00 0.00 C ATOM 400 C GLU S 480 -6.453 0.035 -13.112 1.00 0.00 C ATOM 401 O GLU S 480 -5.802 -0.610 -13.934 1.00 0.00 O ATOM 402 CB GLU S 480 -6.898 2.383 -13.836 1.00 0.00 C ATOM 403 CG GLU S 480 -7.377 3.689 -13.237 1.00 0.00 C ATOM 404 CD GLU S 480 -7.981 4.620 -14.271 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.472 4.653 -15.411 1.00 0.00 O ATOM 406 OE2 GLU S 480 -8.963 5.317 -13.940 1.00 0.00 O ATOM 0 H GLU S 480 -4.475 2.593 -13.496 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.458 1.734 -11.828 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -6.252 2.598 -14.687 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -7.756 1.831 -14.218 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -8.118 3.480 -12.465 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -6.540 4.189 -12.749 1.00 0.00 H new ATOM 413 N GLY S 481 -7.458 -0.483 -12.415 1.00 0.00 N ATOM 414 CA GLY S 481 -7.848 -1.873 -12.590 1.00 0.00 C ATOM 415 C GLY S 481 -6.664 -2.820 -12.557 1.00 0.00 C ATOM 416 O GLY S 481 -6.179 -3.247 -13.605 1.00 0.00 O ATOM 0 H GLY S 481 -8.011 0.034 -11.731 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.552 -2.150 -11.806 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.370 -1.983 -13.541 1.00 0.00 H new ATOM 420 N ASP S 482 -6.188 -3.145 -11.358 1.00 0.00 N ATOM 421 CA ASP S 482 -5.048 -4.042 -11.221 1.00 0.00 C ATOM 422 C ASP S 482 -5.280 -5.099 -10.151 1.00 0.00 C ATOM 423 O ASP S 482 -6.312 -5.117 -9.481 1.00 0.00 O ATOM 424 CB ASP S 482 -3.777 -3.254 -10.906 1.00 0.00 C ATOM 425 CG ASP S 482 -2.544 -3.861 -11.545 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.698 -4.643 -12.507 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.425 -3.557 -11.083 1.00 0.00 O ATOM 0 H ASP S 482 -6.571 -2.804 -10.476 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.927 -4.554 -12.176 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.894 -2.228 -11.254 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.639 -3.211 -9.826 1.00 0.00 H new ATOM 432 N ILE S 483 -4.300 -5.982 -10.008 1.00 0.00 N ATOM 433 CA ILE S 483 -4.366 -7.058 -9.038 1.00 0.00 C ATOM 434 C ILE S 483 -3.184 -6.999 -8.075 1.00 0.00 C ATOM 435 O ILE S 483 -2.286 -7.841 -8.127 1.00 0.00 O ATOM 436 CB ILE S 483 -4.375 -8.427 -9.738 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.422 -8.454 -10.851 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.639 -9.526 -8.728 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.835 -8.230 -10.360 1.00 0.00 C ATOM 0 H ILE S 483 -3.442 -5.970 -10.560 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.292 -6.933 -8.477 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.397 -8.596 -10.189 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.177 -7.689 -11.587 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.372 -9.416 -11.362 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.643 -10.492 -9.234 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.857 -9.518 -7.969 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.607 -9.360 -8.254 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.523 -8.263 -11.205 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.100 -9.010 -9.646 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.902 -7.256 -9.875 1.00 0.00 H new ATOM 451 N ILE S 484 -3.190 -6.006 -7.196 1.00 0.00 N ATOM 452 CA ILE S 484 -2.120 -5.848 -6.222 1.00 0.00 C ATOM 453 C ILE S 484 -2.316 -6.803 -5.054 1.00 0.00 C ATOM 454 O ILE S 484 -3.443 -7.176 -4.727 1.00 0.00 O ATOM 455 CB ILE S 484 -2.053 -4.404 -5.689 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.009 -3.411 -6.850 1.00 0.00 C ATOM 457 CG2 ILE S 484 -0.841 -4.227 -4.786 1.00 0.00 C ATOM 458 CD1 ILE S 484 -2.462 -2.019 -6.470 1.00 0.00 C ATOM 0 H ILE S 484 -3.923 -5.299 -7.138 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.183 -6.078 -6.730 1.00 0.00 H new ATOM 0 HB ILE S 484 -2.950 -4.208 -5.101 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -0.991 -3.361 -7.236 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -2.639 -3.781 -7.659 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -0.808 -3.202 -4.418 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -0.913 -4.913 -3.942 1.00 0.00 H new ATOM 0 HG23 ILE S 484 0.067 -4.439 -5.350 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.405 -1.367 -7.342 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -3.491 -2.056 -6.111 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -1.817 -1.629 -5.682 1.00 0.00 H new ATOM 470 N LEU S 485 -1.217 -7.199 -4.424 1.00 0.00 N ATOM 471 CA LEU S 485 -1.282 -8.114 -3.295 1.00 0.00 C ATOM 472 C LEU S 485 -1.167 -7.348 -1.984 1.00 0.00 C ATOM 473 O LEU S 485 -0.143 -6.723 -1.704 1.00 0.00 O ATOM 474 CB LEU S 485 -0.174 -9.173 -3.404 1.00 0.00 C ATOM 475 CG LEU S 485 0.224 -9.879 -2.097 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.218 -9.035 -1.312 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.001 -10.190 -1.248 1.00 0.00 C ATOM 0 H LEU S 485 -0.274 -6.902 -4.675 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.246 -8.622 -3.311 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.494 -9.931 -4.119 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.714 -8.698 -3.820 1.00 0.00 H new ATOM 0 HG LEU S 485 0.703 -10.823 -2.358 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.487 -9.552 -0.391 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.113 -8.875 -1.913 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.767 -8.073 -1.069 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.690 -10.689 -0.330 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.517 -9.262 -1.000 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.674 -10.842 -1.805 1.00 0.00 H new ATOM 489 N VAL S 486 -2.220 -7.407 -1.178 1.00 0.00 N ATOM 490 CA VAL S 486 -2.221 -6.726 0.106 1.00 0.00 C ATOM 491 C VAL S 486 -1.440 -7.536 1.116 1.00 0.00 C ATOM 492 O VAL S 486 -1.885 -8.595 1.543 1.00 0.00 O ATOM 493 CB VAL S 486 -3.636 -6.509 0.678 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.653 -5.295 1.576 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.685 -6.372 -0.416 1.00 0.00 C ATOM 0 H VAL S 486 -3.078 -7.916 -1.391 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.768 -5.750 -0.070 1.00 0.00 H new ATOM 0 HB VAL S 486 -3.891 -7.394 1.260 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.657 -5.151 1.974 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.954 -5.441 2.399 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.360 -4.415 1.004 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.665 -6.221 0.037 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.442 -5.518 -1.048 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.701 -7.279 -1.021 1.00 0.00 H new ATOM 505 N LEU S 487 -0.280 -7.050 1.498 1.00 0.00 N ATOM 506 CA LEU S 487 0.533 -7.766 2.461 1.00 0.00 C ATOM 507 C LEU S 487 0.053 -7.544 3.890 1.00 0.00 C ATOM 508 O LEU S 487 0.419 -8.293 4.794 1.00 0.00 O ATOM 509 CB LEU S 487 1.988 -7.342 2.336 1.00 0.00 C ATOM 510 CG LEU S 487 2.843 -8.179 1.381 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.317 -7.946 1.656 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.507 -9.660 1.500 1.00 0.00 C ATOM 0 H LEU S 487 0.120 -6.173 1.163 1.00 0.00 H new ATOM 0 HA LEU S 487 0.439 -8.829 2.240 1.00 0.00 H new ATOM 0 HB2 LEU S 487 2.018 -6.304 2.006 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.443 -7.375 3.326 1.00 0.00 H new ATOM 0 HG LEU S 487 2.621 -7.865 0.361 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.914 -8.547 0.970 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.552 -6.891 1.513 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.545 -8.232 2.683 1.00 0.00 H new ATOM 0 HD21 LEU S 487 3.129 -10.231 0.811 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.695 -9.995 2.520 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.456 -9.816 1.255 1.00 0.00 H new ATOM 524 N SER S 488 -0.760 -6.516 4.092 1.00 0.00 N ATOM 525 CA SER S 488 -1.273 -6.213 5.429 1.00 0.00 C ATOM 526 C SER S 488 -2.100 -4.935 5.447 1.00 0.00 C ATOM 527 O SER S 488 -2.314 -4.295 4.419 1.00 0.00 O ATOM 528 CB SER S 488 -0.113 -6.036 6.416 1.00 0.00 C ATOM 529 OG SER S 488 -0.487 -6.439 7.722 1.00 0.00 O ATOM 0 H SER S 488 -1.078 -5.882 3.359 1.00 0.00 H new ATOM 0 HA SER S 488 -1.906 -7.052 5.718 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.744 -6.621 6.083 1.00 0.00 H new ATOM 0 HB3 SER S 488 0.200 -4.992 6.430 1.00 0.00 H new ATOM 0 HG SER S 488 0.271 -6.318 8.331 1.00 0.00 H new ATOM 535 N LYS S 489 -2.517 -4.557 6.650 1.00 0.00 N ATOM 536 CA LYS S 489 -3.273 -3.336 6.872 1.00 0.00 C ATOM 537 C LYS S 489 -2.396 -2.371 7.656 1.00 0.00 C ATOM 538 O LYS S 489 -1.742 -2.774 8.620 1.00 0.00 O ATOM 539 CB LYS S 489 -4.565 -3.628 7.638 1.00 0.00 C ATOM 540 CG LYS S 489 -5.665 -2.607 7.388 1.00 0.00 C ATOM 541 CD LYS S 489 -6.546 -2.427 8.613 1.00 0.00 C ATOM 542 CE LYS S 489 -6.138 -1.203 9.417 1.00 0.00 C ATOM 543 NZ LYS S 489 -4.878 -1.431 10.176 1.00 0.00 N ATOM 0 H LYS S 489 -2.338 -5.092 7.500 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.553 -2.896 5.915 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -4.928 -4.617 7.358 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.346 -3.659 8.705 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.220 -1.650 7.115 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.275 -2.927 6.543 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.587 -2.330 8.303 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.482 -3.315 9.242 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -6.008 -0.354 8.745 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -6.937 -0.942 10.111 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -4.930 -0.940 11.091 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -4.749 -2.450 10.337 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -4.073 -1.062 9.631 1.00 0.00 H new ATOM 557 N VAL S 490 -2.341 -1.115 7.237 1.00 0.00 N ATOM 558 CA VAL S 490 -1.487 -0.148 7.917 1.00 0.00 C ATOM 559 C VAL S 490 -2.293 0.843 8.765 1.00 0.00 C ATOM 560 O VAL S 490 -2.635 0.531 9.905 1.00 0.00 O ATOM 561 CB VAL S 490 -0.562 0.577 6.913 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.288 1.637 7.604 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.332 -0.444 6.211 1.00 0.00 C ATOM 0 H VAL S 490 -2.866 -0.745 6.445 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.856 -0.705 8.610 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.185 1.083 6.176 1.00 0.00 H new ATOM 0 HG11 VAL S 490 0.927 2.127 6.869 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.362 2.377 8.071 1.00 0.00 H new ATOM 0 HG13 VAL S 490 0.908 1.166 8.367 1.00 0.00 H new ATOM 0 HG21 VAL S 490 0.984 0.069 5.503 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.939 -0.966 6.951 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.288 -1.164 5.677 1.00 0.00 H new ATOM 573 N ASN S 491 -2.598 2.028 8.235 1.00 0.00 N ATOM 574 CA ASN S 491 -3.358 3.007 9.011 1.00 0.00 C ATOM 575 C ASN S 491 -4.840 2.998 8.627 1.00 0.00 C ATOM 576 O ASN S 491 -5.319 2.064 7.984 1.00 0.00 O ATOM 577 CB ASN S 491 -2.743 4.410 8.869 1.00 0.00 C ATOM 578 CG ASN S 491 -3.314 5.210 7.718 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.814 4.648 6.746 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.246 6.531 7.827 1.00 0.00 N ATOM 0 H ASN S 491 -2.338 2.328 7.295 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.300 2.723 10.062 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -2.899 4.961 9.796 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.666 4.313 8.734 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.618 7.124 7.085 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.822 6.953 8.653 1.00 0.00 H new ATOM 587 N GLU S 492 -5.563 4.031 9.050 1.00 0.00 N ATOM 588 CA GLU S 492 -6.998 4.136 8.780 1.00 0.00 C ATOM 589 C GLU S 492 -7.308 4.210 7.284 1.00 0.00 C ATOM 590 O GLU S 492 -8.408 3.862 6.858 1.00 0.00 O ATOM 591 CB GLU S 492 -7.575 5.367 9.483 1.00 0.00 C ATOM 592 CG GLU S 492 -9.031 5.211 9.886 1.00 0.00 C ATOM 593 CD GLU S 492 -9.200 4.910 11.363 1.00 0.00 C ATOM 594 OE1 GLU S 492 -8.223 4.447 11.989 1.00 0.00 O ATOM 595 OE2 GLU S 492 -10.308 5.135 11.893 1.00 0.00 O ATOM 0 H GLU S 492 -5.179 4.811 9.583 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.463 3.230 9.168 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -6.981 5.579 10.372 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -7.480 6.230 8.823 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -9.571 6.125 9.641 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.482 4.409 9.302 1.00 0.00 H new ATOM 602 N GLU S 493 -6.346 4.667 6.493 1.00 0.00 N ATOM 603 CA GLU S 493 -6.541 4.785 5.050 1.00 0.00 C ATOM 604 C GLU S 493 -5.269 4.423 4.292 1.00 0.00 C ATOM 605 O GLU S 493 -4.899 5.087 3.326 1.00 0.00 O ATOM 606 CB GLU S 493 -6.977 6.207 4.690 1.00 0.00 C ATOM 607 CG GLU S 493 -6.170 7.287 5.392 1.00 0.00 C ATOM 608 CD GLU S 493 -6.924 7.922 6.544 1.00 0.00 C ATOM 609 OE1 GLU S 493 -8.147 8.134 6.408 1.00 0.00 O ATOM 610 OE2 GLU S 493 -6.291 8.205 7.584 1.00 0.00 O ATOM 0 H GLU S 493 -5.426 4.961 6.822 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.324 4.085 4.758 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.890 6.343 3.612 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -8.030 6.330 4.943 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -5.240 6.857 5.764 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -5.898 8.058 4.671 1.00 0.00 H new ATOM 617 N TRP S 494 -4.611 3.359 4.739 1.00 0.00 N ATOM 618 CA TRP S 494 -3.381 2.889 4.111 1.00 0.00 C ATOM 619 C TRP S 494 -3.110 1.443 4.498 1.00 0.00 C ATOM 620 O TRP S 494 -3.653 0.940 5.481 1.00 0.00 O ATOM 621 CB TRP S 494 -2.185 3.750 4.526 1.00 0.00 C ATOM 622 CG TRP S 494 -2.195 5.143 3.967 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.817 6.233 4.502 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.539 5.601 2.778 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.582 7.339 3.726 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.806 6.978 2.660 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.749 4.986 1.800 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.315 7.748 1.611 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.263 5.754 0.757 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.547 7.122 0.672 1.00 0.00 C ATOM 0 H TRP S 494 -4.911 2.802 5.539 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.512 2.964 3.031 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.157 3.809 5.614 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.268 3.252 4.210 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.409 6.226 5.406 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -2.930 8.279 3.914 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.523 3.932 1.858 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.534 8.803 1.542 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.346 5.290 -0.005 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.150 7.694 -0.154 1.00 0.00 H new ATOM 641 N LEU S 495 -2.268 0.784 3.720 1.00 0.00 N ATOM 642 CA LEU S 495 -1.918 -0.599 3.976 1.00 0.00 C ATOM 643 C LEU S 495 -0.618 -0.966 3.283 1.00 0.00 C ATOM 644 O LEU S 495 -0.055 -0.169 2.533 1.00 0.00 O ATOM 645 CB LEU S 495 -3.045 -1.524 3.524 1.00 0.00 C ATOM 646 CG LEU S 495 -3.894 -1.009 2.360 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.592 -1.781 1.086 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.371 -1.104 2.708 1.00 0.00 C ATOM 0 H LEU S 495 -1.813 1.189 2.902 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.775 -0.722 5.050 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.612 -2.483 3.239 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.701 -1.711 4.374 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.643 0.037 2.185 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.208 -1.397 0.273 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.539 -1.664 0.830 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.812 -2.837 1.240 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.966 -0.735 1.873 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.632 -2.143 2.908 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.576 -0.502 3.593 1.00 0.00 H new ATOM 660 N GLU S 496 -0.141 -2.176 3.540 1.00 0.00 N ATOM 661 CA GLU S 496 1.099 -2.635 2.940 1.00 0.00 C ATOM 662 C GLU S 496 0.862 -3.090 1.508 1.00 0.00 C ATOM 663 O GLU S 496 -0.197 -3.625 1.180 1.00 0.00 O ATOM 664 CB GLU S 496 1.717 -3.759 3.776 1.00 0.00 C ATOM 665 CG GLU S 496 2.931 -4.409 3.130 1.00 0.00 C ATOM 666 CD GLU S 496 4.176 -3.552 3.229 1.00 0.00 C ATOM 667 OE1 GLU S 496 4.725 -3.429 4.340 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.604 -3.005 2.190 1.00 0.00 O ATOM 0 H GLU S 496 -0.592 -2.852 4.156 1.00 0.00 H new ATOM 0 HA GLU S 496 1.803 -1.803 2.919 1.00 0.00 H new ATOM 0 HB2 GLU S 496 2.005 -3.360 4.748 1.00 0.00 H new ATOM 0 HB3 GLU S 496 0.961 -4.523 3.956 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.119 -5.371 3.606 1.00 0.00 H new ATOM 0 HG3 GLU S 496 2.715 -4.609 2.080 1.00 0.00 H new ATOM 675 N GLY S 497 1.847 -2.846 0.656 1.00 0.00 N ATOM 676 CA GLY S 497 1.721 -3.207 -0.738 1.00 0.00 C ATOM 677 C GLY S 497 2.929 -3.951 -1.283 1.00 0.00 C ATOM 678 O GLY S 497 4.049 -3.444 -1.237 1.00 0.00 O ATOM 0 H GLY S 497 2.731 -2.404 0.907 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.834 -3.828 -0.866 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.565 -2.303 -1.327 1.00 0.00 H new ATOM 682 N GLU S 498 2.701 -5.151 -1.813 1.00 0.00 N ATOM 683 CA GLU S 498 3.780 -5.954 -2.382 1.00 0.00 C ATOM 684 C GLU S 498 3.341 -6.580 -3.702 1.00 0.00 C ATOM 685 O GLU S 498 2.570 -7.538 -3.717 1.00 0.00 O ATOM 686 CB GLU S 498 4.205 -7.046 -1.400 1.00 0.00 C ATOM 687 CG GLU S 498 5.577 -7.629 -1.695 1.00 0.00 C ATOM 688 CD GLU S 498 5.600 -9.143 -1.611 1.00 0.00 C ATOM 689 OE1 GLU S 498 4.629 -9.778 -2.077 1.00 0.00 O ATOM 690 OE2 GLU S 498 6.585 -9.695 -1.080 1.00 0.00 O ATOM 0 H GLU S 498 1.780 -5.588 -1.860 1.00 0.00 H new ATOM 0 HA GLU S 498 4.631 -5.300 -2.571 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.203 -6.636 -0.390 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.467 -7.848 -1.419 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.892 -7.320 -2.692 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.301 -7.219 -0.990 1.00 0.00 H new ATOM 697 N SER S 499 3.826 -6.029 -4.812 1.00 0.00 N ATOM 698 CA SER S 499 3.467 -6.536 -6.131 1.00 0.00 C ATOM 699 C SER S 499 4.677 -7.132 -6.846 1.00 0.00 C ATOM 700 O SER S 499 5.569 -6.413 -7.293 1.00 0.00 O ATOM 701 CB SER S 499 2.844 -5.419 -6.976 1.00 0.00 C ATOM 702 OG SER S 499 3.070 -5.631 -8.360 1.00 0.00 O ATOM 0 H SER S 499 4.466 -5.235 -4.823 1.00 0.00 H new ATOM 0 HA SER S 499 2.734 -7.331 -5.998 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.772 -5.370 -6.784 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.265 -4.458 -6.680 1.00 0.00 H new ATOM 0 HG SER S 499 2.660 -4.904 -8.874 1.00 0.00 H new ATOM 708 N LYS S 500 4.681 -8.456 -6.953 1.00 0.00 N ATOM 709 CA LYS S 500 5.757 -9.188 -7.619 1.00 0.00 C ATOM 710 C LYS S 500 7.077 -9.079 -6.850 1.00 0.00 C ATOM 711 O LYS S 500 7.326 -9.853 -5.926 1.00 0.00 O ATOM 712 CB LYS S 500 5.929 -8.694 -9.060 1.00 0.00 C ATOM 713 CG LYS S 500 4.871 -9.225 -10.013 1.00 0.00 C ATOM 714 CD LYS S 500 3.573 -8.440 -9.899 1.00 0.00 C ATOM 715 CE LYS S 500 2.360 -9.351 -9.996 1.00 0.00 C ATOM 716 NZ LYS S 500 1.805 -9.391 -11.378 1.00 0.00 N ATOM 0 H LYS S 500 3.941 -9.053 -6.582 1.00 0.00 H new ATOM 0 HA LYS S 500 5.477 -10.241 -7.640 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.900 -7.604 -9.068 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.914 -8.989 -9.422 1.00 0.00 H new ATOM 0 HG2 LYS S 500 5.242 -9.170 -11.037 1.00 0.00 H new ATOM 0 HG3 LYS S 500 4.681 -10.277 -9.798 1.00 0.00 H new ATOM 0 HD2 LYS S 500 3.552 -7.905 -8.950 1.00 0.00 H new ATOM 0 HD3 LYS S 500 3.530 -7.690 -10.689 1.00 0.00 H new ATOM 0 HE2 LYS S 500 2.637 -10.359 -9.687 1.00 0.00 H new ATOM 0 HE3 LYS S 500 1.590 -9.006 -9.305 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 0.979 -10.023 -11.402 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 1.517 -8.434 -11.664 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 2.531 -9.745 -12.034 1.00 0.00 H new ATOM 730 N GLY S 501 7.927 -8.127 -7.237 1.00 0.00 N ATOM 731 CA GLY S 501 9.206 -7.963 -6.569 1.00 0.00 C ATOM 732 C GLY S 501 9.456 -6.538 -6.120 1.00 0.00 C ATOM 733 O GLY S 501 10.541 -5.997 -6.328 1.00 0.00 O ATOM 0 H GLY S 501 7.752 -7.470 -7.998 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.246 -8.624 -5.703 1.00 0.00 H new ATOM 0 HA3 GLY S 501 10.005 -8.272 -7.243 1.00 0.00 H new ATOM 737 N LYS S 502 8.452 -5.934 -5.499 1.00 0.00 N ATOM 738 CA LYS S 502 8.562 -4.567 -5.010 1.00 0.00 C ATOM 739 C LYS S 502 7.618 -4.339 -3.840 1.00 0.00 C ATOM 740 O LYS S 502 6.427 -4.641 -3.923 1.00 0.00 O ATOM 741 CB LYS S 502 8.258 -3.567 -6.129 1.00 0.00 C ATOM 742 CG LYS S 502 9.485 -3.148 -6.917 1.00 0.00 C ATOM 743 CD LYS S 502 9.105 -2.399 -8.184 1.00 0.00 C ATOM 744 CE LYS S 502 8.926 -0.913 -7.919 1.00 0.00 C ATOM 745 NZ LYS S 502 7.539 -0.587 -7.490 1.00 0.00 N ATOM 0 H LYS S 502 7.548 -6.372 -5.321 1.00 0.00 H new ATOM 0 HA LYS S 502 9.586 -4.412 -4.670 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.531 -4.007 -6.811 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.793 -2.681 -5.697 1.00 0.00 H new ATOM 0 HG2 LYS S 502 10.119 -2.516 -6.296 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.071 -4.030 -7.176 1.00 0.00 H new ATOM 0 HD2 LYS S 502 9.877 -2.545 -8.940 1.00 0.00 H new ATOM 0 HD3 LYS S 502 8.181 -2.812 -8.589 1.00 0.00 H new ATOM 0 HE2 LYS S 502 9.628 -0.595 -7.148 1.00 0.00 H new ATOM 0 HE3 LYS S 502 9.168 -0.352 -8.822 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 7.169 0.190 -8.073 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 6.934 -1.425 -7.606 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 7.543 -0.298 -6.491 1.00 0.00 H new ATOM 759 N VAL S 503 8.156 -3.812 -2.749 1.00 0.00 N ATOM 760 CA VAL S 503 7.352 -3.552 -1.564 1.00 0.00 C ATOM 761 C VAL S 503 7.109 -2.062 -1.373 1.00 0.00 C ATOM 762 O VAL S 503 7.989 -1.236 -1.611 1.00 0.00 O ATOM 763 CB VAL S 503 8.002 -4.128 -0.292 1.00 0.00 C ATOM 764 CG1 VAL S 503 6.999 -4.149 0.853 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.548 -5.524 -0.552 1.00 0.00 C ATOM 0 H VAL S 503 9.140 -3.558 -2.660 1.00 0.00 H new ATOM 0 HA VAL S 503 6.397 -4.052 -1.725 1.00 0.00 H new ATOM 0 HB VAL S 503 8.835 -3.485 -0.010 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.473 -4.559 1.745 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.658 -3.134 1.057 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.146 -4.770 0.578 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.003 -5.912 0.359 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.735 -6.181 -0.860 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.298 -5.480 -1.342 1.00 0.00 H new ATOM 775 N GLY S 504 5.900 -1.739 -0.940 1.00 0.00 N ATOM 776 CA GLY S 504 5.513 -0.363 -0.707 1.00 0.00 C ATOM 777 C GLY S 504 4.187 -0.299 0.012 1.00 0.00 C ATOM 778 O GLY S 504 3.786 -1.277 0.636 1.00 0.00 O ATOM 0 H GLY S 504 5.167 -2.420 -0.743 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.278 0.141 -0.116 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.444 0.167 -1.657 1.00 0.00 H new ATOM 782 N ILE S 505 3.496 0.830 -0.072 1.00 0.00 N ATOM 783 CA ILE S 505 2.205 0.963 0.590 1.00 0.00 C ATOM 784 C ILE S 505 1.271 1.891 -0.166 1.00 0.00 C ATOM 785 O ILE S 505 1.692 2.622 -1.059 1.00 0.00 O ATOM 786 CB ILE S 505 2.357 1.465 2.034 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.401 2.583 2.112 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.736 0.307 2.938 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.053 3.664 3.113 1.00 0.00 C ATOM 0 H ILE S 505 3.802 1.657 -0.585 1.00 0.00 H new ATOM 0 HA ILE S 505 1.769 -0.036 0.605 1.00 0.00 H new ATOM 0 HB ILE S 505 1.405 1.877 2.369 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.366 2.151 2.377 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.513 3.034 1.126 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.843 0.665 3.962 1.00 0.00 H new ATOM 0 HG22 ILE S 505 1.957 -0.455 2.900 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.680 -0.122 2.603 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.835 4.423 3.116 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.103 4.123 2.838 1.00 0.00 H new ATOM 0 HD13 ILE S 505 2.969 3.226 4.107 1.00 0.00 H new ATOM 801 N PHE S 506 -0.005 1.845 0.190 1.00 0.00 N ATOM 802 CA PHE S 506 -1.001 2.676 -0.473 1.00 0.00 C ATOM 803 C PHE S 506 -2.302 2.741 0.320 1.00 0.00 C ATOM 804 O PHE S 506 -2.527 1.948 1.234 1.00 0.00 O ATOM 805 CB PHE S 506 -1.290 2.122 -1.863 1.00 0.00 C ATOM 806 CG PHE S 506 -1.782 0.705 -1.835 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.890 -0.346 -1.705 1.00 0.00 C ATOM 808 CD2 PHE S 506 -3.135 0.423 -1.931 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.337 -1.653 -1.674 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.587 -0.881 -1.898 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.687 -1.920 -1.770 1.00 0.00 C ATOM 0 H PHE S 506 -0.374 1.246 0.929 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.595 3.685 -0.544 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -2.035 2.750 -2.352 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.383 2.175 -2.466 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.168 -0.142 -1.627 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.844 1.232 -2.033 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.631 -2.464 -1.575 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.644 -1.088 -1.972 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.039 -2.941 -1.745 1.00 0.00 H new ATOM 821 N PRO S 507 -3.183 3.695 -0.033 1.00 0.00 N ATOM 822 CA PRO S 507 -4.472 3.876 0.622 1.00 0.00 C ATOM 823 C PRO S 507 -5.529 2.916 0.082 1.00 0.00 C ATOM 824 O PRO S 507 -5.752 2.841 -1.126 1.00 0.00 O ATOM 825 CB PRO S 507 -4.846 5.332 0.292 1.00 0.00 C ATOM 826 CG PRO S 507 -3.742 5.866 -0.572 1.00 0.00 C ATOM 827 CD PRO S 507 -3.000 4.673 -1.104 1.00 0.00 C ATOM 0 HA PRO S 507 -4.419 3.673 1.692 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.803 5.379 -0.227 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.948 5.923 1.202 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.144 6.468 -1.387 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.078 6.511 0.003 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -3.414 4.324 -2.050 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.947 4.893 -1.279 1.00 0.00 H new ATOM 835 N LYS S 508 -6.171 2.180 0.984 1.00 0.00 N ATOM 836 CA LYS S 508 -7.201 1.219 0.608 1.00 0.00 C ATOM 837 C LYS S 508 -8.226 1.837 -0.342 1.00 0.00 C ATOM 838 O LYS S 508 -8.813 1.145 -1.172 1.00 0.00 O ATOM 839 CB LYS S 508 -7.897 0.697 1.865 1.00 0.00 C ATOM 840 CG LYS S 508 -8.410 -0.722 1.727 1.00 0.00 C ATOM 841 CD LYS S 508 -9.920 -0.759 1.553 1.00 0.00 C ATOM 842 CE LYS S 508 -10.466 -2.168 1.716 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.491 -2.594 3.142 1.00 0.00 N ATOM 0 H LYS S 508 -5.994 2.232 1.987 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.721 0.393 0.083 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -7.200 0.743 2.702 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.732 1.355 2.108 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -7.933 -1.200 0.871 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -8.131 -1.297 2.610 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.388 -0.100 2.284 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.183 -0.378 0.566 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -11.475 -2.216 1.305 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -9.854 -2.863 1.141 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -10.978 -3.510 3.222 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -9.517 -2.688 3.493 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -10.996 -1.883 3.708 1.00 0.00 H new ATOM 857 N VAL S 509 -8.432 3.143 -0.222 1.00 0.00 N ATOM 858 CA VAL S 509 -9.381 3.842 -1.085 1.00 0.00 C ATOM 859 C VAL S 509 -8.960 3.732 -2.549 1.00 0.00 C ATOM 860 O VAL S 509 -9.764 3.956 -3.454 1.00 0.00 O ATOM 861 CB VAL S 509 -9.512 5.341 -0.707 1.00 0.00 C ATOM 862 CG1 VAL S 509 -8.163 5.929 -0.328 1.00 0.00 C ATOM 863 CG2 VAL S 509 -10.128 6.138 -1.851 1.00 0.00 C ATOM 0 H VAL S 509 -7.959 3.737 0.459 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.350 3.363 -0.942 1.00 0.00 H new ATOM 0 HB VAL S 509 -10.172 5.406 0.158 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -8.285 6.980 -0.068 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.758 5.388 0.527 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.478 5.841 -1.171 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -10.210 7.186 -1.562 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.496 6.054 -2.735 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -11.120 5.745 -2.075 1.00 0.00 H new ATOM 873 N PHE S 510 -7.693 3.407 -2.776 1.00 0.00 N ATOM 874 CA PHE S 510 -7.166 3.294 -4.127 1.00 0.00 C ATOM 875 C PHE S 510 -7.260 1.877 -4.671 1.00 0.00 C ATOM 876 O PHE S 510 -6.587 1.536 -5.642 1.00 0.00 O ATOM 877 CB PHE S 510 -5.715 3.755 -4.152 1.00 0.00 C ATOM 878 CG PHE S 510 -5.586 5.218 -4.412 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.642 6.125 -3.370 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.427 5.686 -5.701 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.538 7.476 -3.611 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.329 7.036 -5.951 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.384 7.932 -4.903 1.00 0.00 C ATOM 0 H PHE S 510 -7.012 3.217 -2.040 1.00 0.00 H new ATOM 0 HA PHE S 510 -7.777 3.931 -4.767 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.244 3.516 -3.198 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.175 3.203 -4.921 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -5.768 5.770 -2.358 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.379 4.986 -6.522 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.577 8.177 -2.790 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.210 7.393 -6.963 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.306 8.992 -5.095 1.00 0.00 H new ATOM 893 N VAL S 511 -8.086 1.050 -4.047 1.00 0.00 N ATOM 894 CA VAL S 511 -8.233 -0.327 -4.495 1.00 0.00 C ATOM 895 C VAL S 511 -9.600 -0.909 -4.150 1.00 0.00 C ATOM 896 O VAL S 511 -9.815 -2.106 -4.331 1.00 0.00 O ATOM 897 CB VAL S 511 -7.142 -1.222 -3.879 1.00 0.00 C ATOM 898 CG1 VAL S 511 -5.761 -0.648 -4.148 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.365 -1.380 -2.386 1.00 0.00 C ATOM 0 H VAL S 511 -8.657 1.303 -3.241 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.132 -0.308 -5.580 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.203 -2.205 -4.346 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.005 -1.296 -3.704 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -5.597 -0.583 -5.224 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -5.689 0.347 -3.709 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.585 -2.015 -1.967 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -7.332 -0.401 -1.908 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -8.339 -1.837 -2.210 1.00 0.00 H new ATOM 909 N GLU S 512 -10.527 -0.071 -3.665 1.00 0.00 N ATOM 910 CA GLU S 512 -11.866 -0.534 -3.312 1.00 0.00 C ATOM 911 C GLU S 512 -11.812 -1.980 -2.814 1.00 0.00 C ATOM 912 O GLU S 512 -10.837 -2.369 -2.169 1.00 0.00 O ATOM 913 CB GLU S 512 -12.796 -0.380 -4.520 1.00 0.00 C ATOM 914 CG GLU S 512 -13.822 0.720 -4.335 1.00 0.00 C ATOM 915 CD GLU S 512 -15.087 0.483 -5.137 1.00 0.00 C ATOM 916 OE1 GLU S 512 -15.993 -0.206 -4.624 1.00 0.00 O ATOM 917 OE2 GLU S 512 -15.171 0.987 -6.277 1.00 0.00 O ATOM 0 H GLU S 512 -10.370 0.925 -3.511 1.00 0.00 H new ATOM 0 HA GLU S 512 -12.264 0.074 -2.500 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -12.199 -0.169 -5.407 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -13.311 -1.324 -4.699 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -14.077 0.799 -3.278 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -13.383 1.673 -4.630 1.00 0.00 H new ATOM 986 N LYS P 360 -11.615 7.428 -15.060 1.00 0.00 N ATOM 987 CA LYS P 360 -12.046 7.740 -13.702 1.00 0.00 C ATOM 988 C LYS P 360 -11.020 8.615 -12.989 1.00 0.00 C ATOM 989 O LYS P 360 -9.816 8.377 -13.080 1.00 0.00 O ATOM 990 CB LYS P 360 -12.273 6.455 -12.903 1.00 0.00 C ATOM 991 CG LYS P 360 -13.691 5.919 -12.994 1.00 0.00 C ATOM 992 CD LYS P 360 -14.120 5.261 -11.692 1.00 0.00 C ATOM 993 CE LYS P 360 -15.433 4.511 -11.852 1.00 0.00 C ATOM 994 NZ LYS P 360 -15.448 3.245 -11.068 1.00 0.00 N ATOM 0 HA LYS P 360 -12.985 8.290 -13.769 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.582 5.690 -13.258 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.031 6.641 -11.857 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.375 6.733 -13.234 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.757 5.197 -13.808 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.344 4.571 -11.359 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.226 6.020 -10.917 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.257 5.148 -11.529 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -15.597 4.287 -12.906 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -16.360 2.763 -11.204 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -14.678 2.626 -11.393 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -15.317 3.460 -10.059 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.492 9.643 -12.267 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.634 10.566 -11.528 1.00 0.00 C ATOM 1010 C PRO P 361 -10.234 9.999 -10.172 1.00 0.00 C ATOM 1011 O PRO P 361 -11.015 10.031 -9.220 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.523 11.813 -11.354 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.818 11.493 -12.042 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.898 10.003 -12.102 1.00 0.00 C ATOM 0 HA PRO P 361 -9.696 10.769 -12.045 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.685 12.033 -10.299 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -11.053 12.692 -11.795 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.664 11.907 -11.493 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.845 11.925 -13.042 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.327 9.578 -11.194 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.510 9.658 -12.935 1.00 0.00 H new ATOM 1022 N GLN P 362 -9.018 9.466 -10.089 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.523 8.879 -8.848 1.00 0.00 C ATOM 1024 C GLN P 362 -8.766 9.797 -7.657 1.00 0.00 C ATOM 1025 O GLN P 362 -8.874 11.015 -7.801 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.024 8.580 -8.940 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.176 9.801 -9.256 1.00 0.00 C ATOM 1028 CD GLN P 362 -6.021 10.036 -10.745 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -6.358 11.105 -11.255 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -5.510 9.035 -11.451 1.00 0.00 N ATOM 0 H GLN P 362 -8.358 9.429 -10.866 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.074 7.950 -8.700 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.689 8.151 -7.996 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.860 7.825 -9.709 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.629 10.681 -8.799 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.190 9.680 -8.807 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -5.245 8.167 -10.986 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -5.383 9.134 -12.458 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.847 9.206 -6.461 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.069 9.951 -5.227 1.00 0.00 C ATOM 1041 C PRO P 363 -7.876 10.812 -4.844 1.00 0.00 C ATOM 1042 O PRO P 363 -6.731 10.429 -5.065 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.269 8.869 -4.163 1.00 0.00 C ATOM 1044 CG PRO P 363 -8.780 7.588 -4.752 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.723 7.757 -6.241 1.00 0.00 C ATOM 0 HA PRO P 363 -9.913 10.633 -5.333 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.717 9.113 -3.256 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.320 8.790 -3.885 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -7.795 7.339 -4.358 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.446 6.767 -4.486 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.787 7.374 -6.647 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.529 7.212 -6.732 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.143 11.956 -4.230 1.00 0.00 N ATOM 1054 CA ALA P 364 -7.068 12.823 -3.779 1.00 0.00 C ATOM 1055 C ALA P 364 -6.342 12.125 -2.640 1.00 0.00 C ATOM 1056 O ALA P 364 -6.860 12.048 -1.525 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.611 14.171 -3.332 1.00 0.00 C ATOM 0 H ALA P 364 -9.083 12.301 -4.035 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.375 13.012 -4.599 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.788 14.803 -2.999 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -8.123 14.652 -4.166 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.313 14.026 -2.511 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.169 11.571 -2.926 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.423 10.834 -1.909 1.00 0.00 C ATOM 1065 C VAL P 365 -4.318 11.643 -0.617 1.00 0.00 C ATOM 1066 O VAL P 365 -4.088 12.851 -0.644 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.008 10.419 -2.373 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.607 9.118 -1.704 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.932 10.261 -3.879 1.00 0.00 C ATOM 0 H VAL P 365 -4.718 11.616 -3.840 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.988 9.920 -1.729 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.320 11.213 -2.084 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.609 8.831 -2.035 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.606 9.250 -0.622 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.317 8.336 -1.973 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.921 9.969 -4.164 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.636 9.493 -4.200 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.184 11.207 -4.357 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.521 10.980 0.533 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.485 11.622 1.848 1.00 0.00 C ATOM 1081 C PRO P 366 -3.085 11.691 2.447 1.00 0.00 C ATOM 1082 O PRO P 366 -2.141 11.111 1.909 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.369 10.696 2.679 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.121 9.339 2.109 1.00 0.00 C ATOM 1085 CD PRO P 366 -4.827 9.539 0.641 1.00 0.00 C ATOM 0 HA PRO P 366 -4.812 12.661 1.807 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.106 10.738 3.736 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.420 10.974 2.601 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.283 8.855 2.610 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -5.990 8.695 2.247 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -3.986 8.927 0.315 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.681 9.264 0.022 1.00 0.00 H new ATOM 1093 N PRO P 367 -2.939 12.387 3.589 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.653 12.510 4.281 1.00 0.00 C ATOM 1095 C PRO P 367 -1.199 11.167 4.825 1.00 0.00 C ATOM 1096 O PRO P 367 -1.617 10.741 5.902 1.00 0.00 O ATOM 1097 CB PRO P 367 -1.953 13.475 5.424 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.398 13.274 5.675 1.00 0.00 C ATOM 1099 CD PRO P 367 -4.010 13.087 4.318 1.00 0.00 C ATOM 0 HA PRO P 367 -0.854 12.856 3.626 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.357 13.248 6.308 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.733 14.506 5.147 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.570 12.404 6.308 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -3.832 14.132 6.188 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.926 12.497 4.362 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.266 14.039 3.852 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.366 10.505 4.050 1.00 0.00 N ATOM 1108 CA ARG P 368 0.151 9.181 4.399 1.00 0.00 C ATOM 1109 C ARG P 368 0.481 9.055 5.880 1.00 0.00 C ATOM 1110 O ARG P 368 0.672 10.043 6.591 1.00 0.00 O ATOM 1111 CB ARG P 368 1.387 8.819 3.555 1.00 0.00 C ATOM 1112 CG ARG P 368 2.002 9.981 2.788 1.00 0.00 C ATOM 1113 CD ARG P 368 2.363 11.137 3.709 1.00 0.00 C ATOM 1114 NE ARG P 368 3.757 11.545 3.554 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.423 12.261 4.455 1.00 0.00 C ATOM 1116 NH1 ARG P 368 3.828 12.652 5.576 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.690 12.589 4.238 1.00 0.00 N ATOM 0 H ARG P 368 -0.023 10.862 3.158 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.650 8.476 4.175 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.146 8.394 4.212 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.109 8.041 2.845 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.896 9.640 2.266 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.301 10.327 2.028 1.00 0.00 H new ATOM 0 HD2 ARG P 368 1.711 11.985 3.499 1.00 0.00 H new ATOM 0 HD3 ARG P 368 2.183 10.846 4.744 1.00 0.00 H new ATOM 0 HE ARG P 368 4.248 11.264 2.705 1.00 0.00 H new ATOM 0 HH11 ARG P 368 2.854 12.403 5.750 1.00 0.00 H new ATOM 0 HH12 ARG P 368 4.345 13.201 6.263 1.00 0.00 H new ATOM 0 HH21 ARG P 368 6.154 12.292 3.380 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.200 13.138 4.930 1.00 0.00 H new ATOM 1131 N PRO P 369 0.537 7.803 6.344 1.00 0.00 N ATOM 1132 CA PRO P 369 0.828 7.451 7.738 1.00 0.00 C ATOM 1133 C PRO P 369 2.044 8.183 8.287 1.00 0.00 C ATOM 1134 O PRO P 369 2.708 8.931 7.569 1.00 0.00 O ATOM 1135 CB PRO P 369 1.086 5.951 7.648 1.00 0.00 C ATOM 1136 CG PRO P 369 0.226 5.512 6.514 1.00 0.00 C ATOM 1137 CD PRO P 369 0.312 6.612 5.511 1.00 0.00 C ATOM 0 HA PRO P 369 0.021 7.726 8.417 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.138 5.736 7.459 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.818 5.442 8.574 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.577 4.569 6.095 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.803 5.354 6.838 1.00 0.00 H new ATOM 0 HD2 PRO P 369 1.128 6.453 4.806 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -0.603 6.696 4.925 1.00 0.00 H new ATOM 1145 N SER P 370 2.331 7.965 9.565 1.00 0.00 N ATOM 1146 CA SER P 370 3.469 8.606 10.212 1.00 0.00 C ATOM 1147 C SER P 370 4.728 7.754 10.086 1.00 0.00 C ATOM 1148 O SER P 370 5.642 7.861 10.904 1.00 0.00 O ATOM 1149 CB SER P 370 3.162 8.865 11.688 1.00 0.00 C ATOM 1150 OG SER P 370 3.707 10.101 12.115 1.00 0.00 O ATOM 0 H SER P 370 1.791 7.349 10.173 1.00 0.00 H new ATOM 0 HA SER P 370 3.648 9.556 9.709 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.083 8.867 11.843 1.00 0.00 H new ATOM 0 HB3 SER P 370 3.569 8.056 12.294 1.00 0.00 H new ATOM 0 HG SER P 370 3.495 10.243 13.061 1.00 0.00 H new ATOM 1156 N ALA P 371 4.772 6.907 9.057 1.00 0.00 N ATOM 1157 CA ALA P 371 5.918 6.037 8.822 1.00 0.00 C ATOM 1158 C ALA P 371 6.048 4.985 9.919 1.00 0.00 C ATOM 1159 O ALA P 371 5.920 3.791 9.664 1.00 0.00 O ATOM 1160 CB ALA P 371 7.195 6.859 8.716 1.00 0.00 C ATOM 0 H ALA P 371 4.023 6.807 8.372 1.00 0.00 H new ATOM 0 HA ALA P 371 5.757 5.516 7.878 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.042 6.195 8.541 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.107 7.562 7.888 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.352 7.409 9.644 1.00 0.00 H new ATOM 1166 N ASP P 372 6.306 5.428 11.140 1.00 0.00 N ATOM 1167 CA ASP P 372 6.452 4.508 12.264 1.00 0.00 C ATOM 1168 C ASP P 372 5.286 3.530 12.330 1.00 0.00 C ATOM 1169 O ASP P 372 5.500 2.319 12.324 1.00 0.00 O ATOM 1170 CB ASP P 372 6.578 5.276 13.580 1.00 0.00 C ATOM 1171 CG ASP P 372 7.962 5.860 13.780 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.334 6.781 13.022 1.00 0.00 O ATOM 1173 OD2 ASP P 372 8.676 5.396 14.694 1.00 0.00 O ATOM 0 H ASP P 372 6.419 6.413 11.380 1.00 0.00 H new ATOM 0 HA ASP P 372 7.366 3.935 12.107 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.842 6.079 13.600 1.00 0.00 H new ATOM 0 HB3 ASP P 372 6.345 4.609 14.410 1.00 0.00 H new ATOM 1178 N LEU P 373 4.048 4.034 12.374 1.00 0.00 N ATOM 1179 CA LEU P 373 2.904 3.128 12.414 1.00 0.00 C ATOM 1180 C LEU P 373 2.999 2.166 11.241 1.00 0.00 C ATOM 1181 O LEU P 373 2.596 1.007 11.340 1.00 0.00 O ATOM 1182 CB LEU P 373 1.555 3.871 12.447 1.00 0.00 C ATOM 1183 CG LEU P 373 1.084 4.556 11.156 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.947 3.571 10.009 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.252 5.232 11.400 1.00 0.00 C ATOM 0 H LEU P 373 3.820 5.028 12.383 1.00 0.00 H new ATOM 0 HA LEU P 373 2.939 2.564 13.346 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.787 3.158 12.747 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.609 4.629 13.228 1.00 0.00 H new ATOM 0 HG LEU P 373 1.837 5.293 10.877 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.612 4.097 9.115 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.912 3.103 9.814 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.219 2.804 10.273 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -0.586 5.718 10.484 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -0.987 4.487 11.704 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.144 5.978 12.188 1.00 0.00 H new ATOM 1197 N ILE P 374 3.597 2.641 10.147 1.00 0.00 N ATOM 1198 CA ILE P 374 3.810 1.800 8.984 1.00 0.00 C ATOM 1199 C ILE P 374 4.821 0.747 9.378 1.00 0.00 C ATOM 1200 O ILE P 374 4.610 -0.450 9.198 1.00 0.00 O ATOM 1201 CB ILE P 374 4.345 2.595 7.775 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.341 3.659 7.343 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.667 1.660 6.625 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.825 4.516 6.194 1.00 0.00 C ATOM 0 H ILE P 374 3.938 3.597 10.049 1.00 0.00 H new ATOM 0 HA ILE P 374 2.859 1.364 8.679 1.00 0.00 H new ATOM 0 HB ILE P 374 5.264 3.099 8.074 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.409 3.172 7.055 1.00 0.00 H new ATOM 0 HG13 ILE P 374 3.115 4.301 8.194 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.043 2.238 5.781 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.425 0.943 6.940 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.765 1.126 6.326 1.00 0.00 H new ATOM 0 HD11 ILE P 374 3.060 5.250 5.940 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.740 5.031 6.485 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.023 3.885 5.328 1.00 0.00 H new ATOM 1216 N LEU P 375 5.905 1.220 9.981 1.00 0.00 N ATOM 1217 CA LEU P 375 6.950 0.349 10.475 1.00 0.00 C ATOM 1218 C LEU P 375 6.356 -0.619 11.491 1.00 0.00 C ATOM 1219 O LEU P 375 6.883 -1.706 11.727 1.00 0.00 O ATOM 1220 CB LEU P 375 8.067 1.202 11.092 1.00 0.00 C ATOM 1221 CG LEU P 375 8.781 2.111 10.090 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.088 3.469 10.704 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.067 1.467 9.590 1.00 0.00 C ATOM 0 H LEU P 375 6.079 2.213 10.138 1.00 0.00 H new ATOM 0 HA LEU P 375 7.380 -0.235 9.661 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.644 1.816 11.887 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.801 0.542 11.555 1.00 0.00 H new ATOM 0 HG LEU P 375 8.109 2.256 9.244 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.595 4.094 9.969 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.158 3.949 11.009 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.731 3.338 11.575 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.555 2.134 8.879 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.734 1.284 10.433 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.834 0.522 9.100 1.00 0.00 H new ATOM 1235 N ASN P 376 5.228 -0.209 12.063 1.00 0.00 N ATOM 1236 CA ASN P 376 4.502 -1.008 13.030 1.00 0.00 C ATOM 1237 C ASN P 376 3.469 -1.890 12.326 1.00 0.00 C ATOM 1238 O ASN P 376 3.004 -2.885 12.885 1.00 0.00 O ATOM 1239 CB ASN P 376 3.790 -0.084 14.023 1.00 0.00 C ATOM 1240 CG ASN P 376 4.055 -0.466 15.466 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.934 -1.278 15.754 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.294 0.119 16.382 1.00 0.00 N ATOM 0 H ASN P 376 4.794 0.692 11.864 1.00 0.00 H new ATOM 0 HA ASN P 376 5.209 -1.647 13.560 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.116 0.943 13.857 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.717 -0.112 13.835 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.426 -0.099 17.370 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.577 0.787 16.099 1.00 0.00 H new ATOM 1249 N ARG P 377 3.089 -1.495 11.110 1.00 0.00 N ATOM 1250 CA ARG P 377 2.084 -2.226 10.346 1.00 0.00 C ATOM 1251 C ARG P 377 2.541 -2.530 8.912 1.00 0.00 C ATOM 1252 O ARG P 377 1.731 -2.504 7.987 1.00 0.00 O ATOM 1253 CB ARG P 377 0.780 -1.414 10.314 1.00 0.00 C ATOM 1254 CG ARG P 377 0.411 -0.783 11.656 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.205 0.605 11.491 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.489 0.714 12.177 1.00 0.00 N ATOM 1257 CZ ARG P 377 -1.634 0.641 13.499 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -0.576 0.457 14.279 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -2.838 0.751 14.041 1.00 0.00 N ATOM 0 H ARG P 377 3.463 -0.673 10.636 1.00 0.00 H new ATOM 0 HA ARG P 377 1.925 -3.183 10.842 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.872 -0.626 9.566 1.00 0.00 H new ATOM 0 HB3 ARG P 377 -0.034 -2.064 9.993 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.292 -1.431 12.179 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.302 -0.711 12.279 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.481 1.356 11.883 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -0.340 0.819 10.431 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.325 0.854 11.610 1.00 0.00 H new ATOM 0 HH11 ARG P 377 0.353 0.371 13.867 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -0.692 0.402 15.291 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -3.654 0.892 13.446 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -2.949 0.695 15.053 1.00 0.00 H new ATOM 1273 N CYS P 378 3.828 -2.835 8.725 1.00 0.00 N ATOM 1274 CA CYS P 378 4.346 -3.155 7.390 1.00 0.00 C ATOM 1275 C CYS P 378 5.567 -4.069 7.456 1.00 0.00 C ATOM 1276 O CYS P 378 5.999 -4.477 8.534 1.00 0.00 O ATOM 1277 CB CYS P 378 4.705 -1.886 6.609 1.00 0.00 C ATOM 1278 SG CYS P 378 3.349 -1.220 5.621 1.00 0.00 S ATOM 0 H CYS P 378 4.524 -2.867 9.470 1.00 0.00 H new ATOM 0 HA CYS P 378 3.546 -3.681 6.869 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.038 -1.122 7.312 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.547 -2.103 5.952 1.00 0.00 H new ATOM 0 HG CYS P 378 3.635 -1.335 4.358 1.00 0.00 H new ATOM 1284 N SER P 379 6.116 -4.380 6.282 1.00 0.00 N ATOM 1285 CA SER P 379 7.287 -5.240 6.173 1.00 0.00 C ATOM 1286 C SER P 379 8.572 -4.422 6.267 1.00 0.00 C ATOM 1287 O SER P 379 8.538 -3.191 6.236 1.00 0.00 O ATOM 1288 CB SER P 379 7.256 -6.011 4.850 1.00 0.00 C ATOM 1289 OG SER P 379 6.893 -7.365 5.057 1.00 0.00 O ATOM 0 H SER P 379 5.762 -4.044 5.387 1.00 0.00 H new ATOM 0 HA SER P 379 7.267 -5.949 7.001 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.547 -5.541 4.168 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.235 -5.963 4.374 1.00 0.00 H new ATOM 0 HG SER P 379 6.879 -7.835 4.197 1.00 0.00 H new ATOM 1295 N GLU P 380 9.701 -5.111 6.379 1.00 0.00 N ATOM 1296 CA GLU P 380 10.997 -4.448 6.478 1.00 0.00 C ATOM 1297 C GLU P 380 11.308 -3.663 5.207 1.00 0.00 C ATOM 1298 O GLU P 380 11.960 -2.620 5.256 1.00 0.00 O ATOM 1299 CB GLU P 380 12.101 -5.475 6.739 1.00 0.00 C ATOM 1300 CG GLU P 380 12.009 -6.132 8.105 1.00 0.00 C ATOM 1301 CD GLU P 380 12.323 -7.614 8.061 1.00 0.00 C ATOM 1302 OE1 GLU P 380 11.455 -8.391 7.607 1.00 0.00 O ATOM 1303 OE2 GLU P 380 13.434 -8.000 8.480 1.00 0.00 O ATOM 0 H GLU P 380 9.746 -6.130 6.404 1.00 0.00 H new ATOM 0 HA GLU P 380 10.955 -3.749 7.313 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.057 -6.247 5.970 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.071 -4.986 6.645 1.00 0.00 H new ATOM 0 HG2 GLU P 380 12.699 -5.638 8.789 1.00 0.00 H new ATOM 0 HG3 GLU P 380 11.006 -5.989 8.506 1.00 0.00 H new ATOM 1310 N SER P 381 10.841 -4.172 4.071 1.00 0.00 N ATOM 1311 CA SER P 381 11.074 -3.515 2.789 1.00 0.00 C ATOM 1312 C SER P 381 10.505 -2.099 2.788 1.00 0.00 C ATOM 1313 O SER P 381 11.252 -1.122 2.735 1.00 0.00 O ATOM 1314 CB SER P 381 10.451 -4.332 1.655 1.00 0.00 C ATOM 1315 OG SER P 381 11.013 -5.631 1.595 1.00 0.00 O ATOM 0 H SER P 381 10.300 -5.035 4.012 1.00 0.00 H new ATOM 0 HA SER P 381 12.151 -3.451 2.632 1.00 0.00 H new ATOM 0 HB2 SER P 381 9.374 -4.405 1.804 1.00 0.00 H new ATOM 0 HB3 SER P 381 10.607 -3.820 0.705 1.00 0.00 H new ATOM 0 HG SER P 381 11.142 -5.889 0.658 1.00 0.00 H new ATOM 1321 N THR P 382 9.180 -1.991 2.854 1.00 0.00 N ATOM 1322 CA THR P 382 8.520 -0.689 2.869 1.00 0.00 C ATOM 1323 C THR P 382 9.010 0.141 4.049 1.00 0.00 C ATOM 1324 O THR P 382 9.068 1.370 3.978 1.00 0.00 O ATOM 1325 CB THR P 382 6.999 -0.858 2.939 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.512 -1.484 1.765 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.252 0.452 3.105 1.00 0.00 C ATOM 0 H THR P 382 8.544 -2.787 2.898 1.00 0.00 H new ATOM 0 HA THR P 382 8.770 -0.167 1.945 1.00 0.00 H new ATOM 0 HB THR P 382 6.818 -1.472 3.821 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.545 -1.619 1.844 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.180 0.257 3.147 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.569 0.937 4.028 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.469 1.104 2.259 1.00 0.00 H new ATOM 1335 N LYS P 383 9.366 -0.539 5.133 1.00 0.00 N ATOM 1336 CA LYS P 383 9.855 0.129 6.331 1.00 0.00 C ATOM 1337 C LYS P 383 11.101 0.951 6.021 1.00 0.00 C ATOM 1338 O LYS P 383 11.259 2.068 6.513 1.00 0.00 O ATOM 1339 CB LYS P 383 10.163 -0.897 7.421 1.00 0.00 C ATOM 1340 CG LYS P 383 8.980 -1.182 8.326 1.00 0.00 C ATOM 1341 CD LYS P 383 9.124 -2.514 9.043 1.00 0.00 C ATOM 1342 CE LYS P 383 10.262 -2.482 10.052 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.655 -3.850 10.487 1.00 0.00 N ATOM 0 H LYS P 383 9.324 -1.556 5.206 1.00 0.00 H new ATOM 0 HA LYS P 383 9.076 0.803 6.688 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.487 -1.827 6.954 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.996 -0.537 8.025 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.884 -0.383 9.061 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.064 -1.184 7.736 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.191 -2.757 9.552 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.305 -3.304 8.314 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.123 -1.979 9.612 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.961 -1.897 10.921 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.984 -3.820 11.473 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.835 -4.486 10.415 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.421 -4.202 9.877 1.00 0.00 H new ATOM 1357 N ARG P 384 11.981 0.392 5.196 1.00 0.00 N ATOM 1358 CA ARG P 384 13.211 1.075 4.814 1.00 0.00 C ATOM 1359 C ARG P 384 12.906 2.376 4.073 1.00 0.00 C ATOM 1360 O ARG P 384 13.772 3.241 3.939 1.00 0.00 O ATOM 1361 CB ARG P 384 14.073 0.166 3.936 1.00 0.00 C ATOM 1362 CG ARG P 384 14.358 -1.191 4.562 1.00 0.00 C ATOM 1363 CD ARG P 384 15.819 -1.585 4.407 1.00 0.00 C ATOM 1364 NE ARG P 384 16.588 -1.328 5.622 1.00 0.00 N ATOM 1365 CZ ARG P 384 17.773 -1.876 5.880 1.00 0.00 C ATOM 1366 NH1 ARG P 384 18.327 -2.714 5.011 1.00 0.00 N ATOM 1367 NH2 ARG P 384 18.405 -1.588 7.009 1.00 0.00 N ATOM 0 H ARG P 384 11.865 -0.532 4.780 1.00 0.00 H new ATOM 0 HA ARG P 384 13.759 1.316 5.725 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.573 0.018 2.979 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.018 0.667 3.727 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.098 -1.166 5.620 1.00 0.00 H new ATOM 0 HG3 ARG P 384 13.726 -1.947 4.096 1.00 0.00 H new ATOM 0 HD2 ARG P 384 15.884 -2.643 4.154 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.257 -1.031 3.577 1.00 0.00 H new ATOM 0 HE ARG P 384 16.193 -0.691 6.314 1.00 0.00 H new ATOM 0 HH11 ARG P 384 17.844 -2.940 4.141 1.00 0.00 H new ATOM 0 HH12 ARG P 384 19.235 -3.131 5.213 1.00 0.00 H new ATOM 0 HH21 ARG P 384 17.983 -0.946 7.680 1.00 0.00 H new ATOM 0 HH22 ARG P 384 19.313 -2.008 7.207 1.00 0.00 H new ATOM 1381 N LYS P 385 11.671 2.507 3.593 1.00 0.00 N ATOM 1382 CA LYS P 385 11.256 3.702 2.868 1.00 0.00 C ATOM 1383 C LYS P 385 10.622 4.727 3.808 1.00 0.00 C ATOM 1384 O LYS P 385 9.787 5.532 3.393 1.00 0.00 O ATOM 1385 CB LYS P 385 10.270 3.324 1.760 1.00 0.00 C ATOM 1386 CG LYS P 385 10.895 2.484 0.658 1.00 0.00 C ATOM 1387 CD LYS P 385 9.929 1.435 0.126 1.00 0.00 C ATOM 1388 CE LYS P 385 9.623 1.655 -1.347 1.00 0.00 C ATOM 1389 NZ LYS P 385 8.214 1.319 -1.684 1.00 0.00 N ATOM 0 H LYS P 385 10.942 1.800 3.694 1.00 0.00 H new ATOM 0 HA LYS P 385 12.142 4.155 2.424 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.436 2.775 2.197 1.00 0.00 H new ATOM 0 HB3 LYS P 385 9.858 4.234 1.324 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.211 3.133 -0.158 1.00 0.00 H new ATOM 0 HG3 LYS P 385 11.790 1.993 1.039 1.00 0.00 H new ATOM 0 HD2 LYS P 385 10.356 0.442 0.266 1.00 0.00 H new ATOM 0 HD3 LYS P 385 9.003 1.467 0.700 1.00 0.00 H new ATOM 0 HE2 LYS P 385 9.818 2.696 -1.605 1.00 0.00 H new ATOM 0 HE3 LYS P 385 10.295 1.045 -1.951 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 7.846 2.011 -2.368 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 8.174 0.367 -2.100 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 7.635 1.344 -0.820 1.00 0.00 H new ATOM 1403 N LEU P 386 11.029 4.695 5.075 1.00 0.00 N ATOM 1404 CA LEU P 386 10.509 5.622 6.076 1.00 0.00 C ATOM 1405 C LEU P 386 11.258 5.469 7.397 1.00 0.00 C ATOM 1406 O LEU P 386 10.669 5.578 8.472 1.00 0.00 O ATOM 1407 CB LEU P 386 9.010 5.402 6.298 1.00 0.00 C ATOM 1408 CG LEU P 386 8.513 3.971 6.073 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.619 3.533 7.220 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.768 3.863 4.752 1.00 0.00 C ATOM 0 H LEU P 386 11.719 4.035 5.433 1.00 0.00 H new ATOM 0 HA LEU P 386 10.661 6.634 5.702 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.764 5.697 7.318 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.460 6.068 5.633 1.00 0.00 H new ATOM 0 HG LEU P 386 9.379 3.311 6.035 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.275 2.514 7.044 1.00 0.00 H new ATOM 0 HD12 LEU P 386 8.180 3.570 8.154 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.760 4.200 7.287 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.423 2.839 4.611 1.00 0.00 H new ATOM 0 HD22 LEU P 386 6.911 4.536 4.762 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.435 4.137 3.935 1.00 0.00 H new