USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 637 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: S 471 THR OG1 : rot 101:sc= 1.18 USER MOD Set 1.2: S 472 GLN : amide:sc= 0.279 K(o=1.5,f=-8.6!) USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -1.37 X(o=-1.4,f=-0.99) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= -0.157 K(o=-0.16,f=-0.94) USER MOD Single : P 378 CYS SG : rot 20:sc= -7.69 USER MOD Single : P 379 SER OG : rot 180:sc= 0 USER MOD Single : P 381 SER OG : rot 160:sc= -0.871 USER MOD Single : P 382 THR OG1 : rot 138:sc= -6.58! USER MOD Single : P 383 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.329) USER MOD Single : P 385 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 460 SER OG : rot 31:sc= 0.0279 USER MOD Single : S 461 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : S 467 SER OG : rot 109:sc= -0.841 USER MOD Single : S 468 TYR OH : rot -103:sc= 0.949 USER MOD Single : S 479 GLN : amide:sc= 0 X(o=0,f=-0.12) 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= -12.2! C(o=-12!,f=-5!) USER MOD Single : S 499 SER OG : rot 180:sc= 0 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 508 LYS NZ :NH3+ 163:sc= -0.107 (180deg=-0.501) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -3.404 -10.012 2.239 1.00 0.00 N ATOM 91 CA SER S 460 -4.725 -9.963 1.621 1.00 0.00 C ATOM 92 C SER S 460 -4.604 -9.411 0.204 1.00 0.00 C ATOM 93 O SER S 460 -3.495 -9.209 -0.287 1.00 0.00 O ATOM 94 CB SER S 460 -5.671 -9.089 2.447 1.00 0.00 C ATOM 95 OG SER S 460 -5.884 -9.642 3.735 1.00 0.00 O ATOM 0 HA SER S 460 -5.136 -10.972 1.582 1.00 0.00 H new ATOM 0 HB2 SER S 460 -5.254 -8.086 2.543 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.625 -8.989 1.929 1.00 0.00 H new ATOM 0 HG SER S 460 -5.083 -10.130 4.018 1.00 0.00 H new ATOM 101 N GLN S 461 -5.733 -9.166 -0.458 1.00 0.00 N ATOM 102 CA GLN S 461 -5.691 -8.638 -1.820 1.00 0.00 C ATOM 103 C GLN S 461 -6.977 -7.906 -2.199 1.00 0.00 C ATOM 104 O GLN S 461 -8.053 -8.189 -1.673 1.00 0.00 O ATOM 105 CB GLN S 461 -5.436 -9.766 -2.824 1.00 0.00 C ATOM 106 CG GLN S 461 -4.224 -10.622 -2.498 1.00 0.00 C ATOM 107 CD GLN S 461 -3.931 -11.652 -3.571 1.00 0.00 C ATOM 108 OE1 GLN S 461 -4.140 -12.849 -3.370 1.00 0.00 O ATOM 109 NE2 GLN S 461 -3.445 -11.193 -4.716 1.00 0.00 N ATOM 0 H GLN S 461 -6.669 -9.320 -0.084 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.873 -7.919 -1.853 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.318 -10.405 -2.868 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -5.306 -9.333 -3.816 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.353 -9.979 -2.370 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -4.388 -11.130 -1.547 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -3.288 -10.193 -4.839 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -3.229 -11.840 -5.474 1.00 0.00 H new ATOM 118 N VAL S 462 -6.838 -6.967 -3.132 1.00 0.00 N ATOM 119 CA VAL S 462 -7.961 -6.174 -3.626 1.00 0.00 C ATOM 120 C VAL S 462 -7.624 -5.551 -4.975 1.00 0.00 C ATOM 121 O VAL S 462 -6.524 -5.033 -5.168 1.00 0.00 O ATOM 122 CB VAL S 462 -8.359 -5.046 -2.652 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.419 -5.525 -1.669 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.132 -4.511 -1.922 1.00 0.00 C ATOM 0 H VAL S 462 -5.945 -6.735 -3.566 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.802 -6.860 -3.723 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.790 -4.229 -3.231 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.683 -4.711 -0.993 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.306 -5.843 -2.217 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -9.028 -6.363 -1.092 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.433 -3.716 -1.239 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.665 -5.317 -1.357 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.420 -4.117 -2.647 1.00 0.00 H new ATOM 134 N GLU S 463 -8.573 -5.590 -5.901 1.00 0.00 N ATOM 135 CA GLU S 463 -8.360 -5.011 -7.219 1.00 0.00 C ATOM 136 C GLU S 463 -8.237 -3.494 -7.109 1.00 0.00 C ATOM 137 O GLU S 463 -8.809 -2.883 -6.206 1.00 0.00 O ATOM 138 CB GLU S 463 -9.502 -5.399 -8.169 1.00 0.00 C ATOM 139 CG GLU S 463 -10.667 -4.420 -8.176 1.00 0.00 C ATOM 140 CD GLU S 463 -11.955 -5.048 -8.668 1.00 0.00 C ATOM 141 OE1 GLU S 463 -12.131 -6.270 -8.474 1.00 0.00 O ATOM 142 OE2 GLU S 463 -12.787 -4.320 -9.248 1.00 0.00 O ATOM 0 H GLU S 463 -9.491 -6.013 -5.765 1.00 0.00 H new ATOM 0 HA GLU S 463 -7.431 -5.405 -7.631 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -9.106 -5.482 -9.181 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -9.873 -6.385 -7.890 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -10.818 -4.034 -7.168 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -10.417 -3.569 -8.810 1.00 0.00 H new ATOM 149 N ALA S 464 -7.493 -2.888 -8.027 1.00 0.00 N ATOM 150 CA ALA S 464 -7.311 -1.445 -8.014 1.00 0.00 C ATOM 151 C ALA S 464 -8.389 -0.764 -8.846 1.00 0.00 C ATOM 152 O ALA S 464 -9.080 -1.410 -9.630 1.00 0.00 O ATOM 153 CB ALA S 464 -5.928 -1.077 -8.528 1.00 0.00 C ATOM 0 H ALA S 464 -7.010 -3.371 -8.784 1.00 0.00 H new ATOM 0 HA ALA S 464 -7.399 -1.096 -6.985 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.810 0.006 -8.511 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -5.170 -1.535 -7.892 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.811 -1.439 -9.550 1.00 0.00 H new ATOM 159 N LEU S 465 -8.537 0.541 -8.664 1.00 0.00 N ATOM 160 CA LEU S 465 -9.544 1.299 -9.397 1.00 0.00 C ATOM 161 C LEU S 465 -8.966 2.578 -9.998 1.00 0.00 C ATOM 162 O LEU S 465 -9.649 3.283 -10.742 1.00 0.00 O ATOM 163 CB LEU S 465 -10.711 1.636 -8.472 1.00 0.00 C ATOM 164 CG LEU S 465 -11.395 0.425 -7.833 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.548 -0.133 -6.703 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.783 0.798 -7.336 1.00 0.00 C ATOM 0 H LEU S 465 -7.976 1.096 -8.018 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.895 0.678 -10.221 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.350 2.292 -7.680 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.454 2.198 -9.038 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.502 -0.351 -8.591 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -11.051 -0.993 -6.262 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.578 -0.441 -7.093 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.406 0.634 -5.942 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -13.255 -0.075 -6.885 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.702 1.592 -6.593 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.388 1.145 -8.173 1.00 0.00 H new ATOM 178 N PHE S 466 -7.710 2.878 -9.677 1.00 0.00 N ATOM 179 CA PHE S 466 -7.062 4.076 -10.196 1.00 0.00 C ATOM 180 C PHE S 466 -5.567 3.868 -10.377 1.00 0.00 C ATOM 181 O PHE S 466 -5.008 2.856 -9.955 1.00 0.00 O ATOM 182 CB PHE S 466 -7.272 5.253 -9.247 1.00 0.00 C ATOM 183 CG PHE S 466 -8.683 5.428 -8.781 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.630 5.987 -9.618 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.056 5.051 -7.501 1.00 0.00 C ATOM 186 CE1 PHE S 466 -10.928 6.166 -9.191 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.353 5.232 -7.067 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.289 5.792 -7.914 1.00 0.00 C ATOM 0 H PHE S 466 -7.125 2.311 -9.064 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.515 4.288 -11.165 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.629 5.122 -8.377 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -6.951 6.168 -9.746 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.350 6.287 -10.617 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.326 4.612 -6.838 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.661 6.599 -9.856 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.636 4.936 -6.067 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.304 5.937 -7.576 1.00 0.00 H new ATOM 198 N SER S 467 -4.923 4.862 -10.978 1.00 0.00 N ATOM 199 CA SER S 467 -3.485 4.829 -11.191 1.00 0.00 C ATOM 200 C SER S 467 -2.825 5.857 -10.283 1.00 0.00 C ATOM 201 O SER S 467 -2.845 7.056 -10.564 1.00 0.00 O ATOM 202 CB SER S 467 -3.147 5.116 -12.655 1.00 0.00 C ATOM 203 OG SER S 467 -4.163 4.634 -13.517 1.00 0.00 O ATOM 0 H SER S 467 -5.379 5.705 -11.327 1.00 0.00 H new ATOM 0 HA SER S 467 -3.109 3.834 -10.951 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.022 6.189 -12.799 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.196 4.648 -12.911 1.00 0.00 H new ATOM 0 HG SER S 467 -4.657 5.391 -13.896 1.00 0.00 H new ATOM 209 N TYR S 468 -2.270 5.381 -9.178 1.00 0.00 N ATOM 210 CA TYR S 468 -1.637 6.255 -8.203 1.00 0.00 C ATOM 211 C TYR S 468 -0.236 6.667 -8.634 1.00 0.00 C ATOM 212 O TYR S 468 0.654 5.830 -8.778 1.00 0.00 O ATOM 213 CB TYR S 468 -1.578 5.551 -6.843 1.00 0.00 C ATOM 214 CG TYR S 468 -0.832 6.325 -5.774 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.642 7.698 -5.878 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.314 5.674 -4.660 1.00 0.00 C ATOM 217 CE1 TYR S 468 0.042 8.399 -4.904 1.00 0.00 C ATOM 218 CE2 TYR S 468 0.370 6.370 -3.682 1.00 0.00 C ATOM 219 CZ TYR S 468 0.546 7.731 -3.809 1.00 0.00 C ATOM 220 OH TYR S 468 1.226 8.429 -2.838 1.00 0.00 O ATOM 0 H TYR S 468 -2.246 4.391 -8.934 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.238 7.161 -8.127 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.595 5.366 -6.498 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.102 4.579 -6.970 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.036 8.225 -6.734 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.448 4.607 -4.558 1.00 0.00 H new ATOM 0 HE1 TYR S 468 0.181 9.466 -5.000 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.765 5.850 -2.822 1.00 0.00 H new ATOM 0 HH TYR S 468 2.188 8.273 -2.936 1.00 0.00 H new ATOM 230 N GLU S 469 -0.039 7.972 -8.809 1.00 0.00 N ATOM 231 CA GLU S 469 1.262 8.501 -9.189 1.00 0.00 C ATOM 232 C GLU S 469 2.201 8.441 -7.992 1.00 0.00 C ATOM 233 O GLU S 469 2.029 9.171 -7.017 1.00 0.00 O ATOM 234 CB GLU S 469 1.137 9.941 -9.688 1.00 0.00 C ATOM 235 CG GLU S 469 2.091 10.273 -10.822 1.00 0.00 C ATOM 236 CD GLU S 469 1.678 11.513 -11.589 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.458 11.734 -11.745 1.00 0.00 O ATOM 238 OE2 GLU S 469 2.572 12.266 -12.032 1.00 0.00 O ATOM 0 H GLU S 469 -0.765 8.679 -8.693 1.00 0.00 H new ATOM 0 HA GLU S 469 1.666 7.895 -10.000 1.00 0.00 H new ATOM 0 HB2 GLU S 469 0.114 10.114 -10.022 1.00 0.00 H new ATOM 0 HB3 GLU S 469 1.321 10.622 -8.857 1.00 0.00 H new ATOM 0 HG2 GLU S 469 3.093 10.418 -10.418 1.00 0.00 H new ATOM 0 HG3 GLU S 469 2.143 9.427 -11.507 1.00 0.00 H new ATOM 245 N ALA S 470 3.174 7.550 -8.064 1.00 0.00 N ATOM 246 CA ALA S 470 4.125 7.368 -6.977 1.00 0.00 C ATOM 247 C ALA S 470 5.345 8.268 -7.137 1.00 0.00 C ATOM 248 O ALA S 470 6.114 8.132 -8.089 1.00 0.00 O ATOM 249 CB ALA S 470 4.543 5.907 -6.892 1.00 0.00 C ATOM 0 H ALA S 470 3.328 6.938 -8.866 1.00 0.00 H new ATOM 0 HA ALA S 470 3.633 7.654 -6.047 1.00 0.00 H new ATOM 0 HB1 ALA S 470 5.255 5.779 -6.076 1.00 0.00 H new ATOM 0 HB2 ALA S 470 3.665 5.288 -6.708 1.00 0.00 H new ATOM 0 HB3 ALA S 470 5.009 5.607 -7.830 1.00 0.00 H new ATOM 255 N THR S 471 5.515 9.187 -6.190 1.00 0.00 N ATOM 256 CA THR S 471 6.641 10.113 -6.210 1.00 0.00 C ATOM 257 C THR S 471 7.663 9.736 -5.143 1.00 0.00 C ATOM 258 O THR S 471 8.858 9.986 -5.298 1.00 0.00 O ATOM 259 CB THR S 471 6.156 11.545 -5.988 1.00 0.00 C ATOM 260 OG1 THR S 471 4.991 11.561 -5.182 1.00 0.00 O ATOM 261 CG2 THR S 471 5.833 12.273 -7.274 1.00 0.00 C ATOM 0 H THR S 471 4.885 9.309 -5.398 1.00 0.00 H new ATOM 0 HA THR S 471 7.119 10.051 -7.188 1.00 0.00 H new ATOM 0 HB THR S 471 6.983 12.057 -5.497 1.00 0.00 H new ATOM 0 HG1 THR S 471 5.233 11.794 -4.261 1.00 0.00 H new ATOM 0 HG21 THR S 471 5.495 13.284 -7.045 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.725 12.322 -7.898 1.00 0.00 H new ATOM 0 HG23 THR S 471 5.046 11.739 -7.807 1.00 0.00 H new ATOM 269 N GLN S 472 7.183 9.128 -4.061 1.00 0.00 N ATOM 270 CA GLN S 472 8.057 8.711 -2.968 1.00 0.00 C ATOM 271 C GLN S 472 8.343 7.211 -3.042 1.00 0.00 C ATOM 272 O GLN S 472 7.709 6.484 -3.809 1.00 0.00 O ATOM 273 CB GLN S 472 7.453 9.076 -1.605 1.00 0.00 C ATOM 274 CG GLN S 472 5.933 9.097 -1.580 1.00 0.00 C ATOM 275 CD GLN S 472 5.364 10.460 -1.920 1.00 0.00 C ATOM 276 OE1 GLN S 472 5.824 11.124 -2.850 1.00 0.00 O ATOM 277 NE2 GLN S 472 4.356 10.885 -1.166 1.00 0.00 N ATOM 0 H GLN S 472 6.196 8.914 -3.918 1.00 0.00 H new ATOM 0 HA GLN S 472 9.000 9.247 -3.075 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.807 8.363 -0.861 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.823 10.057 -1.308 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.551 8.361 -2.288 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.585 8.798 -0.591 1.00 0.00 H new ATOM 0 HE21 GLN S 472 4.007 10.302 -0.406 1.00 0.00 H new ATOM 0 HE22 GLN S 472 3.932 11.795 -1.347 1.00 0.00 H new ATOM 286 N PRO S 473 9.325 6.733 -2.260 1.00 0.00 N ATOM 287 CA PRO S 473 9.728 5.320 -2.249 1.00 0.00 C ATOM 288 C PRO S 473 8.678 4.381 -1.649 1.00 0.00 C ATOM 289 O PRO S 473 8.066 3.590 -2.366 1.00 0.00 O ATOM 290 CB PRO S 473 11.007 5.312 -1.393 1.00 0.00 C ATOM 291 CG PRO S 473 11.414 6.741 -1.265 1.00 0.00 C ATOM 292 CD PRO S 473 10.147 7.536 -1.345 1.00 0.00 C ATOM 0 HA PRO S 473 9.867 4.949 -3.265 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.821 4.868 -0.415 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.792 4.722 -1.867 1.00 0.00 H new ATOM 0 HG2 PRO S 473 11.927 6.918 -0.320 1.00 0.00 H new ATOM 0 HG3 PRO S 473 12.104 7.024 -2.060 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.676 7.648 -0.368 1.00 0.00 H new ATOM 0 HD3 PRO S 473 10.322 8.540 -1.732 1.00 0.00 H new ATOM 300 N GLU S 474 8.487 4.454 -0.331 1.00 0.00 N ATOM 301 CA GLU S 474 7.525 3.587 0.357 1.00 0.00 C ATOM 302 C GLU S 474 6.180 3.540 -0.372 1.00 0.00 C ATOM 303 O GLU S 474 5.483 2.528 -0.338 1.00 0.00 O ATOM 304 CB GLU S 474 7.323 4.043 1.804 1.00 0.00 C ATOM 305 CG GLU S 474 6.450 5.275 1.949 1.00 0.00 C ATOM 306 CD GLU S 474 7.079 6.510 1.330 1.00 0.00 C ATOM 307 OE1 GLU S 474 8.320 6.537 1.190 1.00 0.00 O ATOM 308 OE2 GLU S 474 6.330 7.448 0.988 1.00 0.00 O ATOM 0 H GLU S 474 8.983 5.102 0.281 1.00 0.00 H new ATOM 0 HA GLU S 474 7.941 2.580 0.357 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.878 3.226 2.372 1.00 0.00 H new ATOM 0 HB3 GLU S 474 8.297 4.247 2.249 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.484 5.089 1.479 1.00 0.00 H new ATOM 0 HG3 GLU S 474 6.260 5.459 3.006 1.00 0.00 H new ATOM 315 N ASP S 475 5.820 4.642 -1.026 1.00 0.00 N ATOM 316 CA ASP S 475 4.565 4.722 -1.755 1.00 0.00 C ATOM 317 C ASP S 475 4.527 3.712 -2.896 1.00 0.00 C ATOM 318 O ASP S 475 5.290 3.814 -3.857 1.00 0.00 O ATOM 319 CB ASP S 475 4.373 6.131 -2.304 1.00 0.00 C ATOM 320 CG ASP S 475 3.697 7.055 -1.309 1.00 0.00 C ATOM 321 OD1 ASP S 475 3.491 6.633 -0.151 1.00 0.00 O ATOM 322 OD2 ASP S 475 3.373 8.199 -1.687 1.00 0.00 O ATOM 0 H ASP S 475 6.384 5.491 -1.064 1.00 0.00 H new ATOM 0 HA ASP S 475 3.755 4.487 -1.065 1.00 0.00 H new ATOM 0 HB2 ASP S 475 5.343 6.546 -2.579 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.776 6.084 -3.215 1.00 0.00 H new ATOM 327 N LEU S 476 3.628 2.743 -2.784 1.00 0.00 N ATOM 328 CA LEU S 476 3.477 1.716 -3.806 1.00 0.00 C ATOM 329 C LEU S 476 2.662 2.257 -4.975 1.00 0.00 C ATOM 330 O LEU S 476 1.509 2.657 -4.808 1.00 0.00 O ATOM 331 CB LEU S 476 2.803 0.468 -3.218 1.00 0.00 C ATOM 332 CG LEU S 476 2.153 -0.472 -4.241 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.142 -0.841 -5.336 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.619 -1.720 -3.563 1.00 0.00 C ATOM 0 H LEU S 476 2.991 2.647 -1.993 1.00 0.00 H new ATOM 0 HA LEU S 476 4.466 1.435 -4.167 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.547 -0.095 -2.654 1.00 0.00 H new ATOM 0 HB3 LEU S 476 2.040 0.788 -2.508 1.00 0.00 H new ATOM 0 HG LEU S 476 1.314 0.053 -4.698 1.00 0.00 H new ATOM 0 HD11 LEU S 476 2.661 -1.508 -6.051 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.472 0.063 -5.848 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.003 -1.343 -4.895 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.163 -2.372 -4.308 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.438 -2.247 -3.073 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.872 -1.439 -2.820 1.00 0.00 H new ATOM 346 N GLU S 477 3.266 2.267 -6.155 1.00 0.00 N ATOM 347 CA GLU S 477 2.598 2.758 -7.352 1.00 0.00 C ATOM 348 C GLU S 477 1.810 1.643 -8.023 1.00 0.00 C ATOM 349 O GLU S 477 2.283 0.512 -8.123 1.00 0.00 O ATOM 350 CB GLU S 477 3.619 3.315 -8.340 1.00 0.00 C ATOM 351 CG GLU S 477 3.095 4.479 -9.163 1.00 0.00 C ATOM 352 CD GLU S 477 4.146 5.056 -10.090 1.00 0.00 C ATOM 353 OE1 GLU S 477 4.728 4.286 -10.881 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.388 6.281 -10.026 1.00 0.00 O ATOM 0 H GLU S 477 4.220 1.940 -6.309 1.00 0.00 H new ATOM 0 HA GLU S 477 1.912 3.551 -7.053 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.504 3.638 -7.792 1.00 0.00 H new ATOM 0 HB3 GLU S 477 3.934 2.517 -9.013 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.239 4.147 -9.751 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.737 5.261 -8.493 1.00 0.00 H new ATOM 361 N PHE S 478 0.612 1.966 -8.491 1.00 0.00 N ATOM 362 CA PHE S 478 -0.221 0.972 -9.164 1.00 0.00 C ATOM 363 C PHE S 478 -1.265 1.631 -10.056 1.00 0.00 C ATOM 364 O PHE S 478 -1.839 2.658 -9.702 1.00 0.00 O ATOM 365 CB PHE S 478 -0.906 0.065 -8.141 1.00 0.00 C ATOM 366 CG PHE S 478 -1.598 0.814 -7.042 1.00 0.00 C ATOM 367 CD1 PHE S 478 -0.865 1.496 -6.085 1.00 0.00 C ATOM 368 CD2 PHE S 478 -2.980 0.833 -6.963 1.00 0.00 C ATOM 369 CE1 PHE S 478 -1.499 2.184 -5.069 1.00 0.00 C ATOM 370 CE2 PHE S 478 -3.620 1.518 -5.949 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.878 2.196 -5.001 1.00 0.00 C ATOM 0 H PHE S 478 0.197 2.895 -8.420 1.00 0.00 H new ATOM 0 HA PHE S 478 0.432 0.369 -9.795 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.633 -0.563 -8.655 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.162 -0.601 -7.703 1.00 0.00 H new ATOM 0 HD1 PHE S 478 0.214 1.490 -6.134 1.00 0.00 H new ATOM 0 HD2 PHE S 478 -3.564 0.306 -7.703 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -0.917 2.712 -4.328 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -4.699 1.524 -5.897 1.00 0.00 H new ATOM 0 HZ PHE S 478 -3.376 2.734 -4.208 1.00 0.00 H new ATOM 381 N GLN S 479 -1.505 1.023 -11.216 1.00 0.00 N ATOM 382 CA GLN S 479 -2.481 1.538 -12.169 1.00 0.00 C ATOM 383 C GLN S 479 -3.897 1.144 -11.761 1.00 0.00 C ATOM 384 O GLN S 479 -4.091 0.394 -10.804 1.00 0.00 O ATOM 385 CB GLN S 479 -2.178 1.013 -13.572 1.00 0.00 C ATOM 386 CG GLN S 479 -1.981 -0.494 -13.630 1.00 0.00 C ATOM 387 CD GLN S 479 -2.079 -1.042 -15.039 1.00 0.00 C ATOM 388 OE1 GLN S 479 -1.658 -0.396 -15.999 1.00 0.00 O ATOM 389 NE2 GLN S 479 -2.638 -2.239 -15.171 1.00 0.00 N ATOM 0 H GLN S 479 -1.034 0.170 -11.518 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.412 2.626 -12.173 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.995 1.290 -14.239 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -1.280 1.503 -13.948 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -1.005 -0.745 -13.214 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -2.729 -0.979 -13.003 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -2.973 -2.739 -14.348 1.00 0.00 H new ATOM 0 HE22 GLN S 479 -2.732 -2.659 -16.096 1.00 0.00 H new ATOM 398 N GLU S 480 -4.884 1.651 -12.492 1.00 0.00 N ATOM 399 CA GLU S 480 -6.281 1.349 -12.203 1.00 0.00 C ATOM 400 C GLU S 480 -6.621 -0.082 -12.612 1.00 0.00 C ATOM 401 O GLU S 480 -5.962 -0.664 -13.472 1.00 0.00 O ATOM 402 CB GLU S 480 -7.201 2.337 -12.926 1.00 0.00 C ATOM 403 CG GLU S 480 -7.272 2.122 -14.430 1.00 0.00 C ATOM 404 CD GLU S 480 -7.059 3.403 -15.215 1.00 0.00 C ATOM 405 OE1 GLU S 480 -5.953 3.976 -15.127 1.00 0.00 O ATOM 406 OE2 GLU S 480 -7.998 3.830 -15.919 1.00 0.00 O ATOM 0 H GLU S 480 -4.743 2.272 -13.288 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.435 1.446 -11.128 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -8.205 2.256 -12.509 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -6.855 3.352 -12.729 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -6.519 1.391 -14.724 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -8.244 1.700 -14.687 1.00 0.00 H new ATOM 413 N GLY S 481 -7.656 -0.643 -11.991 1.00 0.00 N ATOM 414 CA GLY S 481 -8.065 -2.003 -12.305 1.00 0.00 C ATOM 415 C GLY S 481 -6.901 -2.974 -12.314 1.00 0.00 C ATOM 416 O GLY S 481 -6.618 -3.602 -13.335 1.00 0.00 O ATOM 0 H GLY S 481 -8.219 -0.181 -11.277 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.804 -2.334 -11.575 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -8.552 -2.016 -13.280 1.00 0.00 H new ATOM 420 N ASP S 482 -6.218 -3.095 -11.178 1.00 0.00 N ATOM 421 CA ASP S 482 -5.076 -3.996 -11.075 1.00 0.00 C ATOM 422 C ASP S 482 -5.228 -4.967 -9.913 1.00 0.00 C ATOM 423 O ASP S 482 -5.991 -4.727 -8.982 1.00 0.00 O ATOM 424 CB ASP S 482 -3.775 -3.198 -10.933 1.00 0.00 C ATOM 425 CG ASP S 482 -2.571 -4.082 -10.672 1.00 0.00 C ATOM 426 OD1 ASP S 482 -2.458 -5.141 -11.326 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.740 -3.715 -9.815 1.00 0.00 O ATOM 0 H ASP S 482 -6.434 -2.584 -10.322 1.00 0.00 H new ATOM 0 HA ASP S 482 -5.036 -4.581 -11.994 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.607 -2.621 -11.842 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.879 -2.483 -10.117 1.00 0.00 H new ATOM 432 N ILE S 483 -4.489 -6.069 -9.985 1.00 0.00 N ATOM 433 CA ILE S 483 -4.528 -7.093 -8.951 1.00 0.00 C ATOM 434 C ILE S 483 -3.352 -6.953 -7.992 1.00 0.00 C ATOM 435 O ILE S 483 -2.348 -7.657 -8.113 1.00 0.00 O ATOM 436 CB ILE S 483 -4.514 -8.505 -9.565 1.00 0.00 C ATOM 437 CG1 ILE S 483 -5.563 -8.614 -10.672 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.756 -9.552 -8.492 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.967 -8.281 -10.210 1.00 0.00 C ATOM 0 H ILE S 483 -3.852 -6.275 -10.755 1.00 0.00 H new ATOM 0 HA ILE S 483 -5.457 -6.953 -8.399 1.00 0.00 H new ATOM 0 HB ILE S 483 -3.532 -8.685 -10.003 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -5.289 -7.945 -11.488 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -5.552 -9.627 -11.073 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -4.743 -10.544 -8.943 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.973 -9.486 -7.736 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.726 -9.378 -8.026 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -7.658 -8.379 -11.047 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -7.260 -8.966 -9.415 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.994 -7.258 -9.836 1.00 0.00 H new ATOM 451 N ILE S 484 -3.486 -6.043 -7.034 1.00 0.00 N ATOM 452 CA ILE S 484 -2.443 -5.803 -6.046 1.00 0.00 C ATOM 453 C ILE S 484 -2.489 -6.853 -4.942 1.00 0.00 C ATOM 454 O ILE S 484 -3.532 -7.456 -4.688 1.00 0.00 O ATOM 455 CB ILE S 484 -2.599 -4.409 -5.404 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.522 -3.317 -6.469 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.544 -4.184 -4.331 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.079 -1.990 -6.004 1.00 0.00 C ATOM 0 H ILE S 484 -4.313 -5.456 -6.921 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.487 -5.859 -6.567 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.580 -4.362 -4.930 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.482 -3.183 -6.768 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -3.068 -3.643 -7.354 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.675 -3.194 -3.894 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.648 -4.941 -3.554 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.552 -4.255 -4.776 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.994 -1.258 -6.807 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.128 -2.111 -5.732 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.517 -1.643 -5.137 1.00 0.00 H new ATOM 470 N LEU S 485 -1.360 -7.051 -4.274 1.00 0.00 N ATOM 471 CA LEU S 485 -1.280 -8.007 -3.182 1.00 0.00 C ATOM 472 C LEU S 485 -1.113 -7.266 -1.866 1.00 0.00 C ATOM 473 O LEU S 485 -0.020 -6.821 -1.524 1.00 0.00 O ATOM 474 CB LEU S 485 -0.120 -8.991 -3.394 1.00 0.00 C ATOM 475 CG LEU S 485 0.354 -9.785 -2.156 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.464 -9.037 -1.432 1.00 0.00 C ATOM 477 CD2 LEU S 485 -0.794 -10.088 -1.196 1.00 0.00 C ATOM 0 H LEU S 485 -0.487 -6.561 -4.471 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.205 -8.583 -3.155 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.416 -9.705 -4.163 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.731 -8.434 -3.787 1.00 0.00 H new ATOM 0 HG LEU S 485 0.743 -10.738 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.784 -9.612 -0.563 1.00 0.00 H new ATOM 0 HD12 LEU S 485 2.309 -8.898 -2.106 1.00 0.00 H new ATOM 0 HD13 LEU S 485 1.095 -8.064 -1.107 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.415 -10.647 -0.341 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.236 -9.153 -0.851 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.551 -10.680 -1.710 1.00 0.00 H new ATOM 489 N VAL S 486 -2.203 -7.147 -1.128 1.00 0.00 N ATOM 490 CA VAL S 486 -2.160 -6.470 0.158 1.00 0.00 C ATOM 491 C VAL S 486 -1.406 -7.333 1.142 1.00 0.00 C ATOM 492 O VAL S 486 -1.713 -8.510 1.302 1.00 0.00 O ATOM 493 CB VAL S 486 -3.556 -6.180 0.748 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.511 -4.931 1.597 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.618 -6.043 -0.333 1.00 0.00 C ATOM 0 H VAL S 486 -3.120 -7.506 -1.393 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.669 -5.512 -0.011 1.00 0.00 H new ATOM 0 HB VAL S 486 -3.833 -7.032 1.369 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.501 -4.735 2.009 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -2.800 -5.070 2.412 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.199 -4.085 0.984 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.584 -5.839 0.129 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.355 -5.222 -1.000 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.677 -6.969 -0.904 1.00 0.00 H new ATOM 505 N LEU S 487 -0.418 -6.764 1.797 1.00 0.00 N ATOM 506 CA LEU S 487 0.355 -7.526 2.756 1.00 0.00 C ATOM 507 C LEU S 487 -0.222 -7.401 4.162 1.00 0.00 C ATOM 508 O LEU S 487 0.011 -8.260 5.012 1.00 0.00 O ATOM 509 CB LEU S 487 1.811 -7.077 2.743 1.00 0.00 C ATOM 510 CG LEU S 487 2.716 -7.841 1.773 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.173 -7.513 2.041 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.477 -9.342 1.879 1.00 0.00 C ATOM 0 H LEU S 487 -0.133 -5.791 1.687 1.00 0.00 H new ATOM 0 HA LEU S 487 0.304 -8.575 2.464 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.846 -6.017 2.491 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.216 -7.179 3.750 1.00 0.00 H new ATOM 0 HG LEU S 487 2.471 -7.529 0.758 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.804 -8.064 1.344 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.335 -6.443 1.910 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.428 -7.796 3.062 1.00 0.00 H new ATOM 0 HD21 LEU S 487 3.131 -9.865 1.181 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.692 -9.674 2.895 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.437 -9.563 1.637 1.00 0.00 H new ATOM 524 N SER S 488 -0.977 -6.329 4.400 1.00 0.00 N ATOM 525 CA SER S 488 -1.588 -6.093 5.711 1.00 0.00 C ATOM 526 C SER S 488 -2.195 -4.699 5.796 1.00 0.00 C ATOM 527 O SER S 488 -1.899 -3.829 4.978 1.00 0.00 O ATOM 528 CB SER S 488 -0.545 -6.223 6.826 1.00 0.00 C ATOM 529 OG SER S 488 -1.133 -6.694 8.026 1.00 0.00 O ATOM 0 H SER S 488 -1.181 -5.611 3.705 1.00 0.00 H new ATOM 0 HA SER S 488 -2.370 -6.842 5.835 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.244 -6.907 6.512 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.076 -5.255 7.003 1.00 0.00 H new ATOM 0 HG SER S 488 -0.445 -6.769 8.720 1.00 0.00 H new ATOM 535 N LYS S 489 -3.014 -4.480 6.822 1.00 0.00 N ATOM 536 CA LYS S 489 -3.621 -3.177 7.047 1.00 0.00 C ATOM 537 C LYS S 489 -2.603 -2.280 7.739 1.00 0.00 C ATOM 538 O LYS S 489 -1.951 -2.705 8.692 1.00 0.00 O ATOM 539 CB LYS S 489 -4.882 -3.306 7.903 1.00 0.00 C ATOM 540 CG LYS S 489 -5.919 -2.229 7.626 1.00 0.00 C ATOM 541 CD LYS S 489 -6.810 -1.990 8.834 1.00 0.00 C ATOM 542 CE LYS S 489 -7.723 -0.793 8.624 1.00 0.00 C ATOM 543 NZ LYS S 489 -8.645 -0.588 9.774 1.00 0.00 N ATOM 0 H LYS S 489 -3.270 -5.189 7.508 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.912 -2.742 6.091 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.331 -4.284 7.729 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.602 -3.267 8.956 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.417 -1.301 7.353 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.531 -2.523 6.773 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.411 -2.879 9.025 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -6.192 -1.827 9.717 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -7.119 0.103 8.479 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -8.305 -0.936 7.713 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -9.250 0.238 9.591 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -9.239 -1.432 9.897 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -8.091 -0.426 10.639 1.00 0.00 H new ATOM 557 N VAL S 490 -2.435 -1.058 7.247 1.00 0.00 N ATOM 558 CA VAL S 490 -1.446 -0.156 7.834 1.00 0.00 C ATOM 559 C VAL S 490 -2.086 0.981 8.639 1.00 0.00 C ATOM 560 O VAL S 490 -1.500 1.454 9.612 1.00 0.00 O ATOM 561 CB VAL S 490 -0.483 0.392 6.754 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.441 1.459 7.323 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.334 -0.754 6.164 1.00 0.00 C ATOM 0 H VAL S 490 -2.957 -0.673 6.460 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.864 -0.746 8.542 1.00 0.00 H new ATOM 0 HB VAL S 490 -1.080 0.855 5.968 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.104 1.822 6.538 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.154 2.287 7.708 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.035 1.032 8.131 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.011 -0.364 5.404 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.912 -1.233 6.954 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.337 -1.484 5.712 1.00 0.00 H new ATOM 573 N ASN S 491 -3.292 1.410 8.272 1.00 0.00 N ATOM 574 CA ASN S 491 -3.964 2.469 9.023 1.00 0.00 C ATOM 575 C ASN S 491 -5.379 2.727 8.491 1.00 0.00 C ATOM 576 O ASN S 491 -5.958 1.887 7.803 1.00 0.00 O ATOM 577 CB ASN S 491 -3.116 3.753 9.037 1.00 0.00 C ATOM 578 CG ASN S 491 -3.408 4.673 7.879 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.508 5.890 8.041 1.00 0.00 O ATOM 580 ND2 ASN S 491 -3.547 4.094 6.702 1.00 0.00 N ATOM 0 H ASN S 491 -3.816 1.049 7.475 1.00 0.00 H new ATOM 0 HA ASN S 491 -4.071 2.132 10.054 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.294 4.287 9.970 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -2.060 3.483 9.020 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.746 4.659 5.876 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -3.455 3.082 6.618 1.00 0.00 H new ATOM 587 N GLU S 492 -5.940 3.879 8.852 1.00 0.00 N ATOM 588 CA GLU S 492 -7.301 4.244 8.455 1.00 0.00 C ATOM 589 C GLU S 492 -7.501 4.302 6.938 1.00 0.00 C ATOM 590 O GLU S 492 -8.622 4.141 6.457 1.00 0.00 O ATOM 591 CB GLU S 492 -7.674 5.595 9.069 1.00 0.00 C ATOM 592 CG GLU S 492 -8.217 5.489 10.484 1.00 0.00 C ATOM 593 CD GLU S 492 -9.312 6.501 10.765 1.00 0.00 C ATOM 594 OE1 GLU S 492 -10.165 6.712 9.880 1.00 0.00 O ATOM 595 OE2 GLU S 492 -9.313 7.082 11.872 1.00 0.00 O ATOM 0 H GLU S 492 -5.470 4.581 9.423 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.953 3.455 8.829 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -6.794 6.238 9.073 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -8.419 6.079 8.438 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -8.606 4.484 10.646 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -7.403 5.634 11.194 1.00 0.00 H new ATOM 602 N GLU S 493 -6.436 4.547 6.182 1.00 0.00 N ATOM 603 CA GLU S 493 -6.559 4.639 4.726 1.00 0.00 C ATOM 604 C GLU S 493 -5.274 4.234 4.005 1.00 0.00 C ATOM 605 O GLU S 493 -4.906 4.828 2.991 1.00 0.00 O ATOM 606 CB GLU S 493 -6.948 6.062 4.321 1.00 0.00 C ATOM 607 CG GLU S 493 -8.444 6.326 4.384 1.00 0.00 C ATOM 608 CD GLU S 493 -8.812 7.370 5.420 1.00 0.00 C ATOM 609 OE1 GLU S 493 -8.315 7.273 6.563 1.00 0.00 O ATOM 610 OE2 GLU S 493 -9.596 8.285 5.090 1.00 0.00 O ATOM 0 H GLU S 493 -5.492 4.684 6.542 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.339 3.939 4.426 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -6.435 6.769 4.973 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.597 6.251 3.307 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -8.792 6.654 3.405 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.964 5.395 4.612 1.00 0.00 H new ATOM 617 N TRP S 494 -4.610 3.207 4.519 1.00 0.00 N ATOM 618 CA TRP S 494 -3.379 2.707 3.914 1.00 0.00 C ATOM 619 C TRP S 494 -3.107 1.289 4.377 1.00 0.00 C ATOM 620 O TRP S 494 -3.682 0.820 5.360 1.00 0.00 O ATOM 621 CB TRP S 494 -2.170 3.587 4.254 1.00 0.00 C ATOM 622 CG TRP S 494 -2.206 4.952 3.635 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.850 6.054 4.116 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.554 5.365 2.429 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.643 7.125 3.283 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.854 6.727 2.239 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.750 4.715 1.490 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.378 7.451 1.152 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.275 5.436 0.410 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.592 6.792 0.249 1.00 0.00 C ATOM 0 H TRP S 494 -4.903 2.702 5.355 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.522 2.729 2.834 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.106 3.694 5.337 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.262 3.078 3.930 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.438 6.080 5.022 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -3.016 8.064 3.420 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.504 3.670 1.605 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.620 8.496 1.026 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.351 4.946 -0.322 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.207 7.327 -0.607 1.00 0.00 H new ATOM 641 N LEU S 495 -2.236 0.608 3.657 1.00 0.00 N ATOM 642 CA LEU S 495 -1.887 -0.759 3.974 1.00 0.00 C ATOM 643 C LEU S 495 -0.564 -1.148 3.340 1.00 0.00 C ATOM 644 O LEU S 495 0.024 -0.377 2.582 1.00 0.00 O ATOM 645 CB LEU S 495 -3.003 -1.697 3.529 1.00 0.00 C ATOM 646 CG LEU S 495 -3.834 -1.210 2.339 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.418 -1.911 1.057 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.311 -1.424 2.624 1.00 0.00 C ATOM 0 H LEU S 495 -1.754 0.986 2.841 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.769 -0.845 5.054 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.564 -2.661 3.274 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.672 -1.865 4.373 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.654 -0.144 2.199 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -4.025 -1.545 0.229 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.367 -1.706 0.855 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.563 -2.986 1.166 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.899 -1.076 1.775 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.500 -2.485 2.786 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.594 -0.864 3.515 1.00 0.00 H new ATOM 660 N GLU S 496 -0.094 -2.347 3.657 1.00 0.00 N ATOM 661 CA GLU S 496 1.166 -2.827 3.118 1.00 0.00 C ATOM 662 C GLU S 496 0.969 -3.319 1.695 1.00 0.00 C ATOM 663 O GLU S 496 0.088 -4.137 1.424 1.00 0.00 O ATOM 664 CB GLU S 496 1.736 -3.936 4.000 1.00 0.00 C ATOM 665 CG GLU S 496 3.173 -4.305 3.667 1.00 0.00 C ATOM 666 CD GLU S 496 3.720 -5.386 4.577 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.117 -5.627 5.644 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.754 -5.990 4.225 1.00 0.00 O ATOM 0 H GLU S 496 -0.566 -3.001 4.282 1.00 0.00 H new ATOM 0 HA GLU S 496 1.880 -2.004 3.105 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.683 -3.622 5.042 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.111 -4.823 3.902 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.227 -4.644 2.632 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.800 -3.417 3.745 1.00 0.00 H new ATOM 675 N GLY S 497 1.768 -2.783 0.784 1.00 0.00 N ATOM 676 CA GLY S 497 1.642 -3.147 -0.608 1.00 0.00 C ATOM 677 C GLY S 497 2.879 -3.800 -1.194 1.00 0.00 C ATOM 678 O GLY S 497 3.961 -3.219 -1.184 1.00 0.00 O ATOM 0 H GLY S 497 2.501 -2.103 0.986 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.798 -3.828 -0.719 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.408 -2.253 -1.186 1.00 0.00 H new ATOM 682 N GLU S 498 2.706 -5.003 -1.735 1.00 0.00 N ATOM 683 CA GLU S 498 3.799 -5.739 -2.363 1.00 0.00 C ATOM 684 C GLU S 498 3.339 -6.272 -3.718 1.00 0.00 C ATOM 685 O GLU S 498 2.597 -7.251 -3.786 1.00 0.00 O ATOM 686 CB GLU S 498 4.259 -6.890 -1.465 1.00 0.00 C ATOM 687 CG GLU S 498 5.356 -7.745 -2.083 1.00 0.00 C ATOM 688 CD GLU S 498 5.062 -9.230 -1.989 1.00 0.00 C ATOM 689 OE1 GLU S 498 4.366 -9.755 -2.884 1.00 0.00 O ATOM 690 OE2 GLU S 498 5.526 -9.866 -1.020 1.00 0.00 O ATOM 0 H GLU S 498 1.811 -5.492 -1.751 1.00 0.00 H new ATOM 0 HA GLU S 498 4.644 -5.066 -2.509 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.617 -6.481 -0.520 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.403 -7.524 -1.234 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.480 -7.469 -3.130 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.301 -7.533 -1.583 1.00 0.00 H new ATOM 697 N SER S 499 3.757 -5.610 -4.795 1.00 0.00 N ATOM 698 CA SER S 499 3.353 -6.015 -6.137 1.00 0.00 C ATOM 699 C SER S 499 4.552 -6.178 -7.070 1.00 0.00 C ATOM 700 O SER S 499 5.208 -5.203 -7.433 1.00 0.00 O ATOM 701 CB SER S 499 2.381 -4.989 -6.722 1.00 0.00 C ATOM 702 OG SER S 499 1.954 -5.374 -8.019 1.00 0.00 O ATOM 0 H SER S 499 4.371 -4.796 -4.764 1.00 0.00 H new ATOM 0 HA SER S 499 2.862 -6.985 -6.053 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.516 -4.887 -6.066 1.00 0.00 H new ATOM 0 HB3 SER S 499 2.863 -4.012 -6.769 1.00 0.00 H new ATOM 0 HG SER S 499 1.332 -4.703 -8.371 1.00 0.00 H new ATOM 708 N LYS S 500 4.811 -7.418 -7.469 1.00 0.00 N ATOM 709 CA LYS S 500 5.911 -7.728 -8.381 1.00 0.00 C ATOM 710 C LYS S 500 7.269 -7.384 -7.776 1.00 0.00 C ATOM 711 O LYS S 500 7.783 -6.283 -7.972 1.00 0.00 O ATOM 712 CB LYS S 500 5.729 -6.974 -9.699 1.00 0.00 C ATOM 713 CG LYS S 500 4.376 -7.206 -10.351 1.00 0.00 C ATOM 714 CD LYS S 500 4.483 -8.152 -11.537 1.00 0.00 C ATOM 715 CE LYS S 500 4.206 -9.589 -11.129 1.00 0.00 C ATOM 716 NZ LYS S 500 2.764 -9.935 -11.251 1.00 0.00 N ATOM 0 H LYS S 500 4.271 -8.232 -7.174 1.00 0.00 H new ATOM 0 HA LYS S 500 5.890 -8.802 -8.564 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.858 -5.907 -9.518 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.514 -7.277 -10.392 1.00 0.00 H new ATOM 0 HG2 LYS S 500 3.683 -7.618 -9.617 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.962 -6.253 -10.681 1.00 0.00 H new ATOM 0 HD2 LYS S 500 3.777 -7.849 -12.310 1.00 0.00 H new ATOM 0 HD3 LYS S 500 5.480 -8.082 -11.971 1.00 0.00 H new ATOM 0 HE2 LYS S 500 4.794 -10.263 -11.752 1.00 0.00 H new ATOM 0 HE3 LYS S 500 4.530 -9.742 -10.100 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 2.619 -10.924 -10.963 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 2.204 -9.310 -10.637 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 2.460 -9.814 -12.238 1.00 0.00 H new ATOM 730 N GLY S 501 7.849 -8.346 -7.055 1.00 0.00 N ATOM 731 CA GLY S 501 9.157 -8.155 -6.437 1.00 0.00 C ATOM 732 C GLY S 501 9.418 -6.727 -5.994 1.00 0.00 C ATOM 733 O GLY S 501 10.508 -6.195 -6.206 1.00 0.00 O ATOM 0 H GLY S 501 7.433 -9.262 -6.887 1.00 0.00 H new ATOM 0 HA2 GLY S 501 9.241 -8.815 -5.574 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.931 -8.454 -7.144 1.00 0.00 H new ATOM 737 N LYS S 502 8.421 -6.109 -5.376 1.00 0.00 N ATOM 738 CA LYS S 502 8.548 -4.740 -4.902 1.00 0.00 C ATOM 739 C LYS S 502 7.653 -4.516 -3.695 1.00 0.00 C ATOM 740 O LYS S 502 6.449 -4.766 -3.749 1.00 0.00 O ATOM 741 CB LYS S 502 8.196 -3.748 -6.009 1.00 0.00 C ATOM 742 CG LYS S 502 9.392 -3.334 -6.851 1.00 0.00 C ATOM 743 CD LYS S 502 9.056 -3.319 -8.334 1.00 0.00 C ATOM 744 CE LYS S 502 8.018 -2.258 -8.659 1.00 0.00 C ATOM 745 NZ LYS S 502 7.296 -2.557 -9.925 1.00 0.00 N ATOM 0 H LYS S 502 7.513 -6.536 -5.191 1.00 0.00 H new ATOM 0 HA LYS S 502 9.585 -4.575 -4.609 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.441 -4.192 -6.658 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.750 -2.859 -5.562 1.00 0.00 H new ATOM 0 HG2 LYS S 502 9.728 -2.344 -6.544 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.219 -4.021 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS S 502 9.961 -3.133 -8.911 1.00 0.00 H new ATOM 0 HD3 LYS S 502 8.683 -4.298 -8.634 1.00 0.00 H new ATOM 0 HE2 LYS S 502 7.302 -2.188 -7.840 1.00 0.00 H new ATOM 0 HE3 LYS S 502 8.505 -1.286 -8.740 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 6.597 -1.810 -10.111 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 7.976 -2.598 -10.711 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 6.810 -3.472 -9.839 1.00 0.00 H new ATOM 759 N VAL S 503 8.249 -4.059 -2.604 1.00 0.00 N ATOM 760 CA VAL S 503 7.498 -3.821 -1.382 1.00 0.00 C ATOM 761 C VAL S 503 7.309 -2.332 -1.118 1.00 0.00 C ATOM 762 O VAL S 503 8.235 -1.534 -1.259 1.00 0.00 O ATOM 763 CB VAL S 503 8.178 -4.480 -0.169 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.323 -4.322 1.080 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.448 -5.952 -0.453 1.00 0.00 C ATOM 0 H VAL S 503 9.245 -3.847 -2.540 1.00 0.00 H new ATOM 0 HA VAL S 503 6.517 -4.274 -1.524 1.00 0.00 H new ATOM 0 HB VAL S 503 9.130 -3.980 0.008 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.823 -4.795 1.925 1.00 0.00 H new ATOM 0 HG12 VAL S 503 7.179 -3.262 1.291 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.354 -4.795 0.920 1.00 0.00 H new ATOM 0 HG21 VAL S 503 8.929 -6.407 0.413 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.506 -6.462 -0.655 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.102 -6.041 -1.320 1.00 0.00 H new ATOM 775 N GLY S 504 6.091 -1.984 -0.733 1.00 0.00 N ATOM 776 CA GLY S 504 5.742 -0.611 -0.440 1.00 0.00 C ATOM 777 C GLY S 504 4.390 -0.539 0.232 1.00 0.00 C ATOM 778 O GLY S 504 3.975 -1.499 0.878 1.00 0.00 O ATOM 0 H GLY S 504 5.323 -2.645 -0.617 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.500 -0.167 0.206 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.728 -0.029 -1.361 1.00 0.00 H new ATOM 782 N ILE S 505 3.689 0.577 0.078 1.00 0.00 N ATOM 783 CA ILE S 505 2.370 0.723 0.683 1.00 0.00 C ATOM 784 C ILE S 505 1.459 1.597 -0.159 1.00 0.00 C ATOM 785 O ILE S 505 1.922 2.397 -0.969 1.00 0.00 O ATOM 786 CB ILE S 505 2.455 1.296 2.106 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.493 2.419 2.178 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.787 0.186 3.085 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.118 3.528 3.138 1.00 0.00 C ATOM 0 H ILE S 505 4.007 1.387 -0.455 1.00 0.00 H new ATOM 0 HA ILE S 505 1.946 -0.280 0.734 1.00 0.00 H new ATOM 0 HB ILE S 505 1.488 1.722 2.374 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.452 1.998 2.479 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.629 2.842 1.182 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.847 0.596 4.093 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.009 -0.576 3.049 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.745 -0.260 2.818 1.00 0.00 H new ATOM 0 HD11 ILE S 505 3.899 4.289 3.138 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.175 3.976 2.826 1.00 0.00 H new ATOM 0 HD13 ILE S 505 3.011 3.119 4.143 1.00 0.00 H new ATOM 801 N PHE S 506 0.159 1.434 0.032 1.00 0.00 N ATOM 802 CA PHE S 506 -0.814 2.211 -0.729 1.00 0.00 C ATOM 803 C PHE S 506 -2.118 2.387 0.041 1.00 0.00 C ATOM 804 O PHE S 506 -2.391 1.664 1.000 1.00 0.00 O ATOM 805 CB PHE S 506 -1.084 1.540 -2.078 1.00 0.00 C ATOM 806 CG PHE S 506 -1.647 0.148 -1.971 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.954 -0.849 -1.303 1.00 0.00 C ATOM 808 CD2 PHE S 506 -2.868 -0.161 -2.547 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.472 -2.128 -1.211 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.388 -1.439 -2.461 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.689 -2.422 -1.791 1.00 0.00 C ATOM 0 H PHE S 506 -0.246 0.778 0.700 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.391 3.202 -0.897 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.779 2.158 -2.647 1.00 0.00 H new ATOM 0 HB3 PHE S 506 -0.154 1.501 -2.645 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.000 -0.625 -0.850 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.421 0.606 -3.070 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.924 -2.896 -0.685 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.340 -1.668 -2.917 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.094 -3.421 -1.721 1.00 0.00 H new ATOM 821 N PRO S 507 -2.946 3.363 -0.374 1.00 0.00 N ATOM 822 CA PRO S 507 -4.224 3.644 0.269 1.00 0.00 C ATOM 823 C PRO S 507 -5.351 2.778 -0.289 1.00 0.00 C ATOM 824 O PRO S 507 -5.649 2.816 -1.481 1.00 0.00 O ATOM 825 CB PRO S 507 -4.440 5.116 -0.064 1.00 0.00 C ATOM 826 CG PRO S 507 -3.805 5.300 -1.400 1.00 0.00 C ATOM 827 CD PRO S 507 -2.702 4.274 -1.509 1.00 0.00 C ATOM 0 HA PRO S 507 -4.221 3.430 1.338 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.501 5.364 -0.093 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -3.982 5.763 0.684 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.537 5.166 -2.197 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.405 6.309 -1.501 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.742 3.745 -2.461 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.718 4.738 -1.444 1.00 0.00 H new ATOM 835 N LYS S 508 -5.959 1.990 0.590 1.00 0.00 N ATOM 836 CA LYS S 508 -7.043 1.089 0.217 1.00 0.00 C ATOM 837 C LYS S 508 -8.109 1.780 -0.637 1.00 0.00 C ATOM 838 O LYS S 508 -8.805 1.128 -1.413 1.00 0.00 O ATOM 839 CB LYS S 508 -7.681 0.512 1.480 1.00 0.00 C ATOM 840 CG LYS S 508 -8.258 -0.878 1.287 1.00 0.00 C ATOM 841 CD LYS S 508 -9.777 -0.862 1.290 1.00 0.00 C ATOM 842 CE LYS S 508 -10.349 -2.264 1.166 1.00 0.00 C ATOM 843 NZ LYS S 508 -9.851 -3.166 2.242 1.00 0.00 N ATOM 0 H LYS S 508 -5.715 1.958 1.580 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.615 0.290 -0.389 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -6.933 0.479 2.273 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.473 1.182 1.816 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -7.900 -1.293 0.344 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -7.900 -1.534 2.080 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -10.135 -0.402 2.211 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -10.137 -0.247 0.465 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -11.437 -2.217 1.207 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -10.084 -2.679 0.193 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -10.463 -4.005 2.303 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -8.878 -3.463 2.024 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -9.863 -2.661 3.151 1.00 0.00 H new ATOM 857 N VAL S 509 -8.242 3.095 -0.487 1.00 0.00 N ATOM 858 CA VAL S 509 -9.237 3.847 -1.251 1.00 0.00 C ATOM 859 C VAL S 509 -9.095 3.595 -2.754 1.00 0.00 C ATOM 860 O VAL S 509 -10.054 3.759 -3.509 1.00 0.00 O ATOM 861 CB VAL S 509 -9.147 5.364 -0.964 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.703 5.836 -0.991 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.993 6.158 -1.953 1.00 0.00 C ATOM 0 H VAL S 509 -7.680 3.659 0.150 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.216 3.491 -0.928 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.543 5.539 0.036 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.666 6.906 -0.786 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -7.131 5.302 -0.232 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.274 5.640 -1.974 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.912 7.222 -1.729 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.638 5.973 -2.967 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -11.035 5.848 -1.871 1.00 0.00 H new ATOM 873 N PHE S 510 -7.902 3.194 -3.184 1.00 0.00 N ATOM 874 CA PHE S 510 -7.655 2.920 -4.599 1.00 0.00 C ATOM 875 C PHE S 510 -7.905 1.451 -4.928 1.00 0.00 C ATOM 876 O PHE S 510 -7.694 1.017 -6.060 1.00 0.00 O ATOM 877 CB PHE S 510 -6.221 3.295 -4.973 1.00 0.00 C ATOM 878 CG PHE S 510 -5.992 4.774 -4.997 1.00 0.00 C ATOM 879 CD1 PHE S 510 -6.218 5.533 -3.864 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.565 5.408 -6.150 1.00 0.00 C ATOM 881 CE1 PHE S 510 -6.023 6.897 -3.879 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.374 6.775 -6.175 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.605 7.520 -5.033 1.00 0.00 C ATOM 0 H PHE S 510 -7.094 3.052 -2.578 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.349 3.527 -5.180 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.534 2.838 -4.261 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.987 2.880 -5.953 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.551 5.051 -2.957 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.379 4.827 -7.041 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -6.198 7.477 -2.985 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.046 7.260 -7.082 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.458 8.590 -5.047 1.00 0.00 H new ATOM 893 N VAL S 511 -8.352 0.692 -3.933 1.00 0.00 N ATOM 894 CA VAL S 511 -8.627 -0.726 -4.113 1.00 0.00 C ATOM 895 C VAL S 511 -9.830 -1.148 -3.270 1.00 0.00 C ATOM 896 O VAL S 511 -9.755 -2.090 -2.483 1.00 0.00 O ATOM 897 CB VAL S 511 -7.402 -1.577 -3.721 1.00 0.00 C ATOM 898 CG1 VAL S 511 -6.174 -1.148 -4.506 1.00 0.00 C ATOM 899 CG2 VAL S 511 -7.130 -1.466 -2.232 1.00 0.00 C ATOM 0 H VAL S 511 -8.532 1.038 -2.991 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.849 -0.892 -5.167 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.623 -2.617 -3.962 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.322 -1.762 -4.213 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.362 -1.273 -5.572 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -5.956 -0.101 -4.296 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -6.262 -2.073 -1.974 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -6.934 -0.425 -1.975 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -7.998 -1.820 -1.676 1.00 0.00 H new ATOM 909 N GLU S 512 -10.939 -0.437 -3.438 1.00 0.00 N ATOM 910 CA GLU S 512 -12.157 -0.726 -2.685 1.00 0.00 C ATOM 911 C GLU S 512 -12.847 -1.999 -3.169 1.00 0.00 C ATOM 912 O GLU S 512 -14.000 -2.255 -2.823 1.00 0.00 O ATOM 913 CB GLU S 512 -13.124 0.450 -2.785 1.00 0.00 C ATOM 914 CG GLU S 512 -13.621 0.695 -4.200 1.00 0.00 C ATOM 915 CD GLU S 512 -14.566 1.878 -4.290 1.00 0.00 C ATOM 916 OE1 GLU S 512 -14.481 2.774 -3.424 1.00 0.00 O ATOM 917 OE2 GLU S 512 -15.391 1.907 -5.227 1.00 0.00 O ATOM 0 H GLU S 512 -11.021 0.344 -4.089 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.866 -0.882 -1.646 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -13.978 0.267 -2.133 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.631 1.350 -2.419 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.768 0.866 -4.856 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.128 -0.199 -4.563 1.00 0.00 H new ATOM 986 N LYS P 360 -11.546 7.711 -15.111 1.00 0.00 N ATOM 987 CA LYS P 360 -11.985 8.104 -13.778 1.00 0.00 C ATOM 988 C LYS P 360 -10.922 8.937 -13.069 1.00 0.00 C ATOM 989 O LYS P 360 -9.731 8.630 -13.134 1.00 0.00 O ATOM 990 CB LYS P 360 -12.317 6.870 -12.934 1.00 0.00 C ATOM 991 CG LYS P 360 -13.768 6.426 -13.038 1.00 0.00 C ATOM 992 CD LYS P 360 -14.278 5.892 -11.708 1.00 0.00 C ATOM 993 CE LYS P 360 -15.686 5.332 -11.837 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.714 6.304 -11.370 1.00 0.00 N ATOM 0 HA LYS P 360 -12.882 8.712 -13.894 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.672 6.047 -13.242 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.086 7.083 -11.890 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.386 7.266 -13.356 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.861 5.654 -13.802 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.607 5.113 -11.346 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.269 6.691 -10.966 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -15.879 5.071 -12.877 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -15.766 4.412 -11.257 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.660 5.885 -11.474 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -16.545 6.534 -10.370 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -16.655 7.172 -11.940 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.346 10.005 -12.377 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.450 10.894 -11.644 1.00 0.00 C ATOM 1010 C PRO P 361 -10.100 10.325 -10.275 1.00 0.00 C ATOM 1011 O PRO P 361 -10.883 10.426 -9.333 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.274 12.190 -11.499 1.00 0.00 C ATOM 1013 CG PRO P 361 -12.572 11.930 -12.205 1.00 0.00 C ATOM 1014 CD PRO P 361 -12.734 10.447 -12.242 1.00 0.00 C ATOM 0 HA PRO P 361 -9.497 11.042 -12.153 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -11.441 12.432 -10.449 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -10.751 13.038 -11.942 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.403 12.400 -11.678 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -12.558 12.346 -13.213 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.200 10.063 -11.335 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.351 10.123 -13.080 1.00 0.00 H new ATOM 1022 N GLN P 362 -8.925 9.708 -10.176 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.482 9.103 -8.923 1.00 0.00 C ATOM 1024 C GLN P 362 -8.706 10.031 -7.738 1.00 0.00 C ATOM 1025 O GLN P 362 -8.791 11.249 -7.885 1.00 0.00 O ATOM 1026 CB GLN P 362 -6.999 8.726 -8.985 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.072 9.921 -9.131 1.00 0.00 C ATOM 1028 CD GLN P 362 -6.023 10.453 -10.550 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -5.331 9.904 -11.407 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -6.760 11.527 -10.804 1.00 0.00 N ATOM 0 H GLN P 362 -8.264 9.614 -10.947 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.081 8.203 -8.784 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.734 8.180 -8.080 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -6.840 8.049 -9.824 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.401 10.715 -8.461 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.067 9.637 -8.819 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -7.319 11.949 -10.062 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -6.768 11.930 -11.741 1.00 0.00 H new ATOM 1039 N PRO P 363 -8.794 9.444 -6.540 1.00 0.00 N ATOM 1040 CA PRO P 363 -8.995 10.191 -5.307 1.00 0.00 C ATOM 1041 C PRO P 363 -7.727 10.882 -4.831 1.00 0.00 C ATOM 1042 O PRO P 363 -6.667 10.267 -4.773 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.401 9.126 -4.284 1.00 0.00 C ATOM 1044 CG PRO P 363 -9.095 7.792 -4.886 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.691 7.997 -6.317 1.00 0.00 C ATOM 0 HA PRO P 363 -9.734 10.980 -5.447 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.854 9.261 -3.351 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.462 9.206 -4.046 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -8.294 7.301 -4.333 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.967 7.141 -4.828 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -7.676 7.642 -6.495 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.344 7.446 -6.994 1.00 0.00 H new ATOM 1053 N ALA P 364 -7.838 12.153 -4.455 1.00 0.00 N ATOM 1054 CA ALA P 364 -6.683 12.878 -3.945 1.00 0.00 C ATOM 1055 C ALA P 364 -6.068 12.075 -2.808 1.00 0.00 C ATOM 1056 O ALA P 364 -6.666 11.949 -1.739 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.082 14.268 -3.473 1.00 0.00 C ATOM 0 H ALA P 364 -8.702 12.693 -4.493 1.00 0.00 H new ATOM 0 HA ALA P 364 -5.949 13.004 -4.741 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.203 14.791 -3.096 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -7.507 14.827 -4.306 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -7.822 14.184 -2.678 1.00 0.00 H new ATOM 1063 N VAL P 365 -4.901 11.491 -3.050 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.262 10.655 -2.037 1.00 0.00 C ATOM 1065 C VAL P 365 -4.211 11.362 -0.683 1.00 0.00 C ATOM 1066 O VAL P 365 -3.864 12.541 -0.592 1.00 0.00 O ATOM 1067 CB VAL P 365 -2.846 10.186 -2.435 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.560 8.837 -1.803 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -2.692 10.079 -3.942 1.00 0.00 C ATOM 0 H VAL P 365 -4.383 11.577 -3.924 1.00 0.00 H new ATOM 0 HA VAL P 365 -4.886 9.765 -1.957 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.135 10.930 -2.075 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.560 8.508 -2.085 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.621 8.923 -0.718 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.293 8.109 -2.151 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -1.682 9.746 -4.182 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.413 9.360 -4.331 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -2.870 11.054 -4.396 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.590 10.640 0.387 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.627 11.177 1.755 1.00 0.00 C ATOM 1081 C PRO P 366 -3.249 11.301 2.400 1.00 0.00 C ATOM 1082 O PRO P 366 -2.246 10.862 1.838 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.468 10.140 2.501 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.228 8.864 1.773 1.00 0.00 C ATOM 1085 CD PRO P 366 -5.039 9.236 0.331 1.00 0.00 C ATOM 0 HA PRO P 366 -5.026 12.191 1.776 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.166 10.063 3.546 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.525 10.407 2.493 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.347 8.353 2.162 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.071 8.183 1.892 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.299 8.598 -0.153 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.966 9.134 -0.233 1.00 0.00 H new ATOM 1093 N PRO P 367 -3.189 11.900 3.608 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.935 12.079 4.352 1.00 0.00 C ATOM 1095 C PRO P 367 -1.351 10.749 4.805 1.00 0.00 C ATOM 1096 O PRO P 367 -1.585 10.296 5.924 1.00 0.00 O ATOM 1097 CB PRO P 367 -2.355 12.912 5.561 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.785 12.566 5.745 1.00 0.00 C ATOM 1099 CD PRO P 367 -4.339 12.441 4.357 1.00 0.00 C ATOM 0 HA PRO P 367 -1.160 12.548 3.745 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -1.766 12.663 6.443 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -2.221 13.978 5.379 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.897 11.634 6.299 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -4.308 13.338 6.310 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -5.199 11.772 4.321 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.666 13.403 3.961 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.602 10.137 3.909 1.00 0.00 N ATOM 1108 CA ARG P 368 0.035 8.846 4.152 1.00 0.00 C ATOM 1109 C ARG P 368 0.596 8.729 5.573 1.00 0.00 C ATOM 1110 O ARG P 368 1.307 9.615 6.044 1.00 0.00 O ATOM 1111 CB ARG P 368 1.155 8.637 3.132 1.00 0.00 C ATOM 1112 CG ARG P 368 1.694 7.218 3.088 1.00 0.00 C ATOM 1113 CD ARG P 368 3.200 7.182 3.299 1.00 0.00 C ATOM 1114 NE ARG P 368 3.615 7.990 4.445 1.00 0.00 N ATOM 1115 CZ ARG P 368 4.879 8.316 4.706 1.00 0.00 C ATOM 1116 NH1 ARG P 368 5.853 7.902 3.909 1.00 0.00 N ATOM 1117 NH2 ARG P 368 5.167 9.058 5.766 1.00 0.00 N ATOM 0 H ARG P 368 -0.413 10.520 2.983 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.727 8.074 4.044 1.00 0.00 H new ATOM 0 HB2 ARG P 368 0.786 8.905 2.142 1.00 0.00 H new ATOM 0 HB3 ARG P 368 1.974 9.319 3.362 1.00 0.00 H new ATOM 0 HG2 ARG P 368 1.204 6.619 3.856 1.00 0.00 H new ATOM 0 HG3 ARG P 368 1.450 6.766 2.127 1.00 0.00 H new ATOM 0 HD2 ARG P 368 3.520 6.151 3.448 1.00 0.00 H new ATOM 0 HD3 ARG P 368 3.700 7.544 2.401 1.00 0.00 H new ATOM 0 HE ARG P 368 2.892 8.324 5.083 1.00 0.00 H new ATOM 0 HH11 ARG P 368 5.636 7.331 3.092 1.00 0.00 H new ATOM 0 HH12 ARG P 368 6.820 8.154 4.112 1.00 0.00 H new ATOM 0 HH21 ARG P 368 4.420 9.379 6.382 1.00 0.00 H new ATOM 0 HH22 ARG P 368 6.136 9.308 5.966 1.00 0.00 H new ATOM 1131 N PRO P 369 0.271 7.610 6.261 1.00 0.00 N ATOM 1132 CA PRO P 369 0.713 7.300 7.618 1.00 0.00 C ATOM 1133 C PRO P 369 2.026 7.972 8.006 1.00 0.00 C ATOM 1134 O PRO P 369 2.843 8.315 7.151 1.00 0.00 O ATOM 1135 CB PRO P 369 0.892 5.786 7.543 1.00 0.00 C ATOM 1136 CG PRO P 369 -0.059 5.315 6.476 1.00 0.00 C ATOM 1137 CD PRO P 369 -0.573 6.531 5.758 1.00 0.00 C ATOM 0 HA PRO P 369 0.009 7.653 8.372 1.00 0.00 H new ATOM 0 HB2 PRO P 369 1.921 5.525 7.293 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.668 5.317 8.501 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.447 4.645 5.781 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.883 4.754 6.917 1.00 0.00 H new ATOM 0 HD2 PRO P 369 -0.486 6.425 4.677 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -1.626 6.710 5.977 1.00 0.00 H new ATOM 1145 N SER P 370 2.228 8.153 9.307 1.00 0.00 N ATOM 1146 CA SER P 370 3.441 8.786 9.814 1.00 0.00 C ATOM 1147 C SER P 370 4.625 7.818 9.828 1.00 0.00 C ATOM 1148 O SER P 370 5.482 7.897 10.708 1.00 0.00 O ATOM 1149 CB SER P 370 3.201 9.330 11.224 1.00 0.00 C ATOM 1150 OG SER P 370 2.361 10.470 11.194 1.00 0.00 O ATOM 0 H SER P 370 1.567 7.870 10.030 1.00 0.00 H new ATOM 0 HA SER P 370 3.688 9.607 9.141 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.747 8.556 11.843 1.00 0.00 H new ATOM 0 HB3 SER P 370 4.154 9.589 11.685 1.00 0.00 H new ATOM 0 HG SER P 370 2.221 10.798 12.107 1.00 0.00 H new ATOM 1156 N ALA P 371 4.679 6.918 8.845 1.00 0.00 N ATOM 1157 CA ALA P 371 5.767 5.951 8.739 1.00 0.00 C ATOM 1158 C ALA P 371 5.767 4.958 9.900 1.00 0.00 C ATOM 1159 O ALA P 371 5.616 3.758 9.703 1.00 0.00 O ATOM 1160 CB ALA P 371 7.103 6.674 8.665 1.00 0.00 C ATOM 0 H ALA P 371 3.977 6.841 8.109 1.00 0.00 H new ATOM 0 HA ALA P 371 5.612 5.381 7.823 1.00 0.00 H new ATOM 0 HB1 ALA P 371 7.908 5.944 8.586 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.117 7.325 7.791 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.243 7.273 9.565 1.00 0.00 H new ATOM 1166 N ASP P 372 5.964 5.463 11.109 1.00 0.00 N ATOM 1167 CA ASP P 372 6.010 4.614 12.301 1.00 0.00 C ATOM 1168 C ASP P 372 4.915 3.550 12.307 1.00 0.00 C ATOM 1169 O ASP P 372 5.225 2.360 12.292 1.00 0.00 O ATOM 1170 CB ASP P 372 5.921 5.467 13.568 1.00 0.00 C ATOM 1171 CG ASP P 372 7.251 6.089 13.943 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.279 5.380 13.870 1.00 0.00 O ATOM 1173 OD2 ASP P 372 7.267 7.283 14.310 1.00 0.00 O ATOM 0 H ASP P 372 6.095 6.457 11.296 1.00 0.00 H new ATOM 0 HA ASP P 372 6.967 4.092 12.280 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.183 6.256 13.420 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.566 4.850 14.394 1.00 0.00 H new ATOM 1178 N LEU P 373 3.635 3.944 12.334 1.00 0.00 N ATOM 1179 CA LEU P 373 2.579 2.936 12.344 1.00 0.00 C ATOM 1180 C LEU P 373 2.772 1.981 11.171 1.00 0.00 C ATOM 1181 O LEU P 373 2.413 0.807 11.250 1.00 0.00 O ATOM 1182 CB LEU P 373 1.159 3.539 12.394 1.00 0.00 C ATOM 1183 CG LEU P 373 0.620 4.253 11.145 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.767 3.407 9.896 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.845 4.592 11.351 1.00 0.00 C ATOM 0 H LEU P 373 3.318 4.913 12.349 1.00 0.00 H new ATOM 0 HA LEU P 373 2.666 2.369 13.271 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.466 2.735 12.641 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.130 4.249 13.220 1.00 0.00 H new ATOM 0 HG LEU P 373 1.207 5.160 11.004 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.373 3.952 9.039 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.821 3.183 9.730 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.213 2.476 10.020 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -1.229 5.099 10.466 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.411 3.675 11.519 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.949 5.246 12.217 1.00 0.00 H new ATOM 1197 N ILE P 374 3.410 2.475 10.108 1.00 0.00 N ATOM 1198 CA ILE P 374 3.721 1.634 8.964 1.00 0.00 C ATOM 1199 C ILE P 374 4.781 0.654 9.424 1.00 0.00 C ATOM 1200 O ILE P 374 4.665 -0.557 9.248 1.00 0.00 O ATOM 1201 CB ILE P 374 4.264 2.440 7.764 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.221 3.437 7.257 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.698 1.502 6.652 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.728 4.330 6.146 1.00 0.00 C ATOM 0 H ILE P 374 3.716 3.444 10.021 1.00 0.00 H new ATOM 0 HA ILE P 374 2.811 1.141 8.623 1.00 0.00 H new ATOM 0 HB ILE P 374 5.133 3.007 8.097 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.349 2.889 6.902 1.00 0.00 H new ATOM 0 HG13 ILE P 374 2.890 4.058 8.089 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.079 2.084 5.813 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.482 0.840 7.020 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.845 0.907 6.324 1.00 0.00 H new ATOM 0 HD11 ILE P 374 2.935 5.011 5.836 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.582 4.906 6.503 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.032 3.718 5.297 1.00 0.00 H new ATOM 1216 N LEU P 375 5.793 1.214 10.077 1.00 0.00 N ATOM 1217 CA LEU P 375 6.875 0.438 10.646 1.00 0.00 C ATOM 1218 C LEU P 375 6.309 -0.540 11.667 1.00 0.00 C ATOM 1219 O LEU P 375 6.919 -1.563 11.982 1.00 0.00 O ATOM 1220 CB LEU P 375 7.889 1.390 11.288 1.00 0.00 C ATOM 1221 CG LEU P 375 8.556 2.350 10.300 1.00 0.00 C ATOM 1222 CD1 LEU P 375 8.813 3.702 10.947 1.00 0.00 C ATOM 1223 CD2 LEU P 375 9.860 1.764 9.775 1.00 0.00 C ATOM 0 H LEU P 375 5.881 2.220 10.224 1.00 0.00 H new ATOM 0 HA LEU P 375 7.384 -0.135 9.871 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.386 1.972 12.061 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.661 0.801 11.784 1.00 0.00 H new ATOM 0 HG LEU P 375 7.875 2.492 9.461 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.288 4.367 10.225 1.00 0.00 H new ATOM 0 HD12 LEU P 375 7.867 4.135 11.272 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.469 3.574 11.808 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.317 2.463 9.074 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.541 1.587 10.608 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.657 0.822 9.267 1.00 0.00 H new ATOM 1235 N ASN P 376 5.118 -0.214 12.155 1.00 0.00 N ATOM 1236 CA ASN P 376 4.414 -1.039 13.116 1.00 0.00 C ATOM 1237 C ASN P 376 3.516 -2.047 12.399 1.00 0.00 C ATOM 1238 O ASN P 376 3.147 -3.075 12.967 1.00 0.00 O ATOM 1239 CB ASN P 376 3.562 -0.151 14.026 1.00 0.00 C ATOM 1240 CG ASN P 376 3.700 -0.517 15.491 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.775 -0.906 15.947 1.00 0.00 O ATOM 1242 ND2 ASN P 376 2.610 -0.392 16.238 1.00 0.00 N ATOM 0 H ASN P 376 4.616 0.634 11.891 1.00 0.00 H new ATOM 0 HA ASN P 376 5.145 -1.583 13.713 1.00 0.00 H new ATOM 0 HB2 ASN P 376 3.852 0.890 13.886 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.516 -0.233 13.732 1.00 0.00 H new ATOM 0 HD21 ASN P 376 2.643 -0.622 17.231 1.00 0.00 H new ATOM 0 HD22 ASN P 376 1.739 -0.066 15.819 1.00 0.00 H new ATOM 1249 N ARG P 377 3.141 -1.727 11.159 1.00 0.00 N ATOM 1250 CA ARG P 377 2.254 -2.592 10.386 1.00 0.00 C ATOM 1251 C ARG P 377 2.753 -2.816 8.950 1.00 0.00 C ATOM 1252 O ARG P 377 1.962 -2.780 8.007 1.00 0.00 O ATOM 1253 CB ARG P 377 0.844 -1.988 10.355 1.00 0.00 C ATOM 1254 CG ARG P 377 0.382 -1.419 11.694 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.304 -0.067 11.528 1.00 0.00 C ATOM 1256 NE ARG P 377 -1.758 -0.181 11.611 1.00 0.00 N ATOM 1257 CZ ARG P 377 -2.435 -0.234 12.756 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -1.795 -0.185 13.918 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -3.757 -0.338 12.740 1.00 0.00 N ATOM 0 H ARG P 377 3.437 -0.880 10.673 1.00 0.00 H new ATOM 0 HA ARG P 377 2.239 -3.564 10.878 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.816 -1.196 9.606 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.138 -2.755 10.035 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.305 -2.119 12.169 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.239 -1.313 12.359 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.051 0.618 12.298 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -0.028 0.365 10.566 1.00 0.00 H new ATOM 0 HE ARG P 377 -2.286 -0.222 10.739 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -0.778 -0.106 13.937 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.320 -0.226 14.792 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -4.255 -0.377 11.851 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -4.276 -0.379 13.617 1.00 0.00 H new ATOM 1273 N CYS P 378 4.051 -3.073 8.784 1.00 0.00 N ATOM 1274 CA CYS P 378 4.614 -3.329 7.452 1.00 0.00 C ATOM 1275 C CYS P 378 5.956 -4.048 7.540 1.00 0.00 C ATOM 1276 O CYS P 378 6.517 -4.214 8.624 1.00 0.00 O ATOM 1277 CB CYS P 378 4.780 -2.034 6.648 1.00 0.00 C ATOM 1278 SG CYS P 378 3.336 -1.595 5.654 1.00 0.00 S ATOM 0 H CYS P 378 4.729 -3.110 9.545 1.00 0.00 H new ATOM 0 HA CYS P 378 3.903 -3.973 6.934 1.00 0.00 H new ATOM 0 HB2 CYS P 378 4.997 -1.217 7.336 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.644 -2.135 5.991 1.00 0.00 H new ATOM 0 HG CYS P 378 2.287 -2.208 6.118 1.00 0.00 H new ATOM 1284 N SER P 379 6.463 -4.473 6.385 1.00 0.00 N ATOM 1285 CA SER P 379 7.740 -5.175 6.314 1.00 0.00 C ATOM 1286 C SER P 379 8.905 -4.194 6.383 1.00 0.00 C ATOM 1287 O SER P 379 8.723 -2.987 6.221 1.00 0.00 O ATOM 1288 CB SER P 379 7.830 -5.989 5.020 1.00 0.00 C ATOM 1289 OG SER P 379 8.716 -7.086 5.168 1.00 0.00 O ATOM 0 H SER P 379 6.006 -4.342 5.483 1.00 0.00 H new ATOM 0 HA SER P 379 7.800 -5.849 7.168 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.840 -6.352 4.745 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.172 -5.349 4.207 1.00 0.00 H new ATOM 0 HG SER P 379 8.755 -7.591 4.329 1.00 0.00 H new ATOM 1295 N GLU P 380 10.102 -4.721 6.617 1.00 0.00 N ATOM 1296 CA GLU P 380 11.296 -3.890 6.699 1.00 0.00 C ATOM 1297 C GLU P 380 11.565 -3.202 5.364 1.00 0.00 C ATOM 1298 O GLU P 380 12.127 -2.109 5.319 1.00 0.00 O ATOM 1299 CB GLU P 380 12.506 -4.734 7.105 1.00 0.00 C ATOM 1300 CG GLU P 380 12.590 -4.994 8.601 1.00 0.00 C ATOM 1301 CD GLU P 380 12.916 -6.440 8.924 1.00 0.00 C ATOM 1302 OE1 GLU P 380 14.115 -6.787 8.952 1.00 0.00 O ATOM 1303 OE2 GLU P 380 11.972 -7.225 9.150 1.00 0.00 O ATOM 0 H GLU P 380 10.270 -5.718 6.753 1.00 0.00 H new ATOM 0 HA GLU P 380 11.128 -3.126 7.458 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.466 -5.688 6.580 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.416 -4.230 6.780 1.00 0.00 H new ATOM 0 HG2 GLU P 380 13.352 -4.348 9.036 1.00 0.00 H new ATOM 0 HG3 GLU P 380 11.641 -4.726 9.066 1.00 0.00 H new ATOM 1310 N SER P 381 11.153 -3.851 4.276 1.00 0.00 N ATOM 1311 CA SER P 381 11.343 -3.300 2.940 1.00 0.00 C ATOM 1312 C SER P 381 10.688 -1.928 2.824 1.00 0.00 C ATOM 1313 O SER P 381 11.369 -0.916 2.656 1.00 0.00 O ATOM 1314 CB SER P 381 10.764 -4.247 1.888 1.00 0.00 C ATOM 1315 OG SER P 381 11.268 -3.948 0.597 1.00 0.00 O ATOM 0 H SER P 381 10.686 -4.758 4.296 1.00 0.00 H new ATOM 0 HA SER P 381 12.413 -3.189 2.766 1.00 0.00 H new ATOM 0 HB2 SER P 381 11.009 -5.277 2.148 1.00 0.00 H new ATOM 0 HB3 SER P 381 9.677 -4.169 1.884 1.00 0.00 H new ATOM 0 HG SER P 381 11.154 -4.727 0.013 1.00 0.00 H new ATOM 1321 N THR P 382 9.362 -1.899 2.931 1.00 0.00 N ATOM 1322 CA THR P 382 8.619 -0.646 2.852 1.00 0.00 C ATOM 1323 C THR P 382 9.100 0.318 3.930 1.00 0.00 C ATOM 1324 O THR P 382 9.131 1.532 3.728 1.00 0.00 O ATOM 1325 CB THR P 382 7.117 -0.903 3.019 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.607 -1.634 1.920 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.297 0.367 3.147 1.00 0.00 C ATOM 0 H THR P 382 8.782 -2.726 3.072 1.00 0.00 H new ATOM 0 HA THR P 382 8.793 -0.202 1.872 1.00 0.00 H new ATOM 0 HB THR P 382 7.026 -1.468 3.947 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.988 -2.322 2.243 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.244 0.110 3.262 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.631 0.929 4.019 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.426 0.975 2.252 1.00 0.00 H new ATOM 1335 N LYS P 383 9.468 -0.241 5.074 1.00 0.00 N ATOM 1336 CA LYS P 383 9.944 0.551 6.198 1.00 0.00 C ATOM 1337 C LYS P 383 11.251 1.260 5.865 1.00 0.00 C ATOM 1338 O LYS P 383 11.417 2.445 6.154 1.00 0.00 O ATOM 1339 CB LYS P 383 10.135 -0.345 7.419 1.00 0.00 C ATOM 1340 CG LYS P 383 8.831 -0.679 8.117 1.00 0.00 C ATOM 1341 CD LYS P 383 8.947 -1.947 8.946 1.00 0.00 C ATOM 1342 CE LYS P 383 9.796 -1.727 10.187 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.045 -2.997 10.923 1.00 0.00 N ATOM 0 H LYS P 383 9.446 -1.246 5.248 1.00 0.00 H new ATOM 0 HA LYS P 383 9.195 1.312 6.416 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.624 -1.270 7.112 1.00 0.00 H new ATOM 0 HB3 LYS P 383 10.803 0.149 8.125 1.00 0.00 H new ATOM 0 HG2 LYS P 383 8.539 0.151 8.760 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.042 -0.800 7.375 1.00 0.00 H new ATOM 0 HD2 LYS P 383 7.952 -2.283 9.239 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.385 -2.740 8.340 1.00 0.00 H new ATOM 0 HE2 LYS P 383 10.748 -1.281 9.901 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.297 -1.017 10.847 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.955 -2.936 11.422 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 9.282 -3.154 11.612 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 10.072 -3.789 10.250 1.00 0.00 H new ATOM 1357 N ARG P 384 12.181 0.528 5.255 1.00 0.00 N ATOM 1358 CA ARG P 384 13.477 1.089 4.881 1.00 0.00 C ATOM 1359 C ARG P 384 13.308 2.433 4.176 1.00 0.00 C ATOM 1360 O ARG P 384 14.188 3.292 4.234 1.00 0.00 O ATOM 1361 CB ARG P 384 14.235 0.116 3.976 1.00 0.00 C ATOM 1362 CG ARG P 384 14.820 -1.076 4.719 1.00 0.00 C ATOM 1363 CD ARG P 384 16.335 -1.127 4.596 1.00 0.00 C ATOM 1364 NE ARG P 384 16.853 -2.483 4.753 1.00 0.00 N ATOM 1365 CZ ARG P 384 16.705 -3.443 3.844 1.00 0.00 C ATOM 1366 NH1 ARG P 384 16.055 -3.200 2.712 1.00 0.00 N ATOM 1367 NH2 ARG P 384 17.208 -4.649 4.066 1.00 0.00 N ATOM 0 H ARG P 384 12.061 -0.455 5.009 1.00 0.00 H new ATOM 0 HA ARG P 384 14.052 1.249 5.793 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.561 -0.246 3.200 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.041 0.652 3.474 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.542 -1.021 5.772 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.392 -1.997 4.324 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.633 -0.736 3.623 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.782 -0.479 5.350 1.00 0.00 H new ATOM 0 HE ARG P 384 17.358 -2.708 5.610 1.00 0.00 H new ATOM 0 HH11 ARG P 384 15.666 -2.274 2.536 1.00 0.00 H new ATOM 0 HH12 ARG P 384 15.944 -3.940 2.018 1.00 0.00 H new ATOM 0 HH21 ARG P 384 17.709 -4.841 4.934 1.00 0.00 H new ATOM 0 HH22 ARG P 384 17.095 -5.385 3.369 1.00 0.00 H new ATOM 1381 N LYS P 385 12.168 2.605 3.516 1.00 0.00 N ATOM 1382 CA LYS P 385 11.874 3.841 2.803 1.00 0.00 C ATOM 1383 C LYS P 385 11.520 4.960 3.780 1.00 0.00 C ATOM 1384 O LYS P 385 11.968 6.096 3.626 1.00 0.00 O ATOM 1385 CB LYS P 385 10.719 3.618 1.826 1.00 0.00 C ATOM 1386 CG LYS P 385 11.084 2.723 0.651 1.00 0.00 C ATOM 1387 CD LYS P 385 10.853 1.258 0.977 1.00 0.00 C ATOM 1388 CE LYS P 385 10.387 0.482 -0.243 1.00 0.00 C ATOM 1389 NZ LYS P 385 11.520 -0.176 -0.950 1.00 0.00 N ATOM 0 H LYS P 385 11.431 1.902 3.460 1.00 0.00 H new ATOM 0 HA LYS P 385 12.764 4.137 2.248 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.880 3.176 2.363 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.382 4.583 1.447 1.00 0.00 H new ATOM 0 HG2 LYS P 385 10.489 3.002 -0.219 1.00 0.00 H new ATOM 0 HG3 LYS P 385 12.130 2.878 0.385 1.00 0.00 H new ATOM 0 HD2 LYS P 385 11.775 0.819 1.358 1.00 0.00 H new ATOM 0 HD3 LYS P 385 10.109 1.174 1.769 1.00 0.00 H new ATOM 0 HE2 LYS P 385 9.662 -0.273 0.062 1.00 0.00 H new ATOM 0 HE3 LYS P 385 9.875 1.157 -0.928 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 11.159 -0.695 -1.776 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 12.199 0.546 -1.264 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 11.994 -0.840 -0.304 1.00 0.00 H new ATOM 1403 N LEU P 386 10.722 4.626 4.789 1.00 0.00 N ATOM 1404 CA LEU P 386 10.314 5.600 5.799 1.00 0.00 C ATOM 1405 C LEU P 386 11.272 5.589 6.988 1.00 0.00 C ATOM 1406 O LEU P 386 12.370 5.041 6.898 1.00 0.00 O ATOM 1407 CB LEU P 386 8.871 5.341 6.265 1.00 0.00 C ATOM 1408 CG LEU P 386 8.403 3.886 6.197 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.416 3.592 7.314 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.768 3.595 4.845 1.00 0.00 C ATOM 0 H LEU P 386 10.344 3.689 4.930 1.00 0.00 H new ATOM 0 HA LEU P 386 10.351 6.588 5.341 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.773 5.687 7.294 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.199 5.948 5.659 1.00 0.00 H new ATOM 0 HG LEU P 386 9.272 3.240 6.321 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.094 2.553 7.250 1.00 0.00 H new ATOM 0 HD12 LEU P 386 7.895 3.765 8.278 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.550 4.247 7.216 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.440 2.556 4.813 1.00 0.00 H new ATOM 0 HD22 LEU P 386 6.910 4.251 4.697 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.498 3.770 4.055 1.00 0.00 H new