USER MOD reduce.3.24.130724 H: found=0, std=0, add=635, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 637 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : P 360 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : P 362 GLN : amide:sc= -0.851 X(o=-0.85,f=-0.99) USER MOD Single : P 370 SER OG : rot 180:sc= 0 USER MOD Single : P 376 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : P 378 CYS SG : rot 14:sc= -10.4! USER MOD Single : P 379 SER OG : rot 94:sc= 0.296 USER MOD Single : P 381 SER OG : rot 180:sc= 0 USER MOD Single : P 382 THR OG1 : rot 170:sc= -4.44! USER MOD Single : P 383 LYS NZ :NH3+ -122:sc= 0.116 (180deg=-2.09!) USER MOD Single : P 385 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 460 SER OG : rot 180:sc= 0 USER MOD Single : S 461 GLN : amide:sc= -0.175 K(o=-0.18,f=-0.98) USER MOD Single : S 467 SER OG : rot 180:sc= 0.902 USER MOD Single : S 468 TYR OH : rot -104:sc= 1.23 USER MOD Single : S 471 THR OG1 : rot 180:sc= 0.0145 USER MOD Single : S 472 GLN : amide:sc= -0.185 K(o=-0.19,f=-3.7!) USER MOD Single : S 479 GLN : amide:sc= -0.0847 X(o=-0.085,f=-0.21) USER MOD Single : S 488 SER OG : rot 180:sc= 0 USER MOD Single : S 489 LYS NZ :NH3+ -175:sc= -0.546 (180deg=-0.656) USER MOD Single : S 491 ASN : amide:sc= -7.59! C(o=-7.6!,f=-14!) USER MOD Single : S 499 SER OG : rot 180:sc= 0.424 USER MOD Single : S 500 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : S 502 LYS NZ :NH3+ -141:sc= 1.18 (180deg=-0.176) USER MOD Single : S 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 90 N SER S 460 -4.265 -9.729 2.804 1.00 0.00 N ATOM 91 CA SER S 460 -5.295 -9.964 1.802 1.00 0.00 C ATOM 92 C SER S 460 -4.949 -9.253 0.496 1.00 0.00 C ATOM 93 O SER S 460 -3.801 -8.864 0.282 1.00 0.00 O ATOM 94 CB SER S 460 -6.646 -9.485 2.327 1.00 0.00 C ATOM 95 OG SER S 460 -7.649 -10.466 2.135 1.00 0.00 O ATOM 0 HA SER S 460 -5.351 -11.034 1.601 1.00 0.00 H new ATOM 0 HB2 SER S 460 -6.563 -9.249 3.388 1.00 0.00 H new ATOM 0 HB3 SER S 460 -6.932 -8.565 1.817 1.00 0.00 H new ATOM 0 HG SER S 460 -8.503 -10.133 2.482 1.00 0.00 H new ATOM 101 N GLN S 461 -5.938 -9.087 -0.380 1.00 0.00 N ATOM 102 CA GLN S 461 -5.703 -8.421 -1.659 1.00 0.00 C ATOM 103 C GLN S 461 -6.950 -7.694 -2.153 1.00 0.00 C ATOM 104 O GLN S 461 -8.071 -8.007 -1.754 1.00 0.00 O ATOM 105 CB GLN S 461 -5.254 -9.431 -2.722 1.00 0.00 C ATOM 106 CG GLN S 461 -4.486 -10.619 -2.163 1.00 0.00 C ATOM 107 CD GLN S 461 -3.747 -11.394 -3.238 1.00 0.00 C ATOM 108 OE1 GLN S 461 -3.214 -10.812 -4.182 1.00 0.00 O ATOM 109 NE2 GLN S 461 -3.714 -12.713 -3.099 1.00 0.00 N ATOM 0 H GLN S 461 -6.897 -9.400 -0.231 1.00 0.00 H new ATOM 0 HA GLN S 461 -4.914 -7.687 -1.496 1.00 0.00 H new ATOM 0 HB2 GLN S 461 -6.132 -9.797 -3.254 1.00 0.00 H new ATOM 0 HB3 GLN S 461 -4.629 -8.919 -3.453 1.00 0.00 H new ATOM 0 HG2 GLN S 461 -3.772 -10.267 -1.418 1.00 0.00 H new ATOM 0 HG3 GLN S 461 -5.179 -11.286 -1.651 1.00 0.00 H new ATOM 0 HE21 GLN S 461 -4.170 -13.153 -2.300 1.00 0.00 H new ATOM 0 HE22 GLN S 461 -3.233 -13.287 -3.791 1.00 0.00 H new ATOM 118 N VAL S 462 -6.735 -6.725 -3.038 1.00 0.00 N ATOM 119 CA VAL S 462 -7.820 -5.943 -3.618 1.00 0.00 C ATOM 120 C VAL S 462 -7.370 -5.275 -4.907 1.00 0.00 C ATOM 121 O VAL S 462 -6.427 -4.483 -4.906 1.00 0.00 O ATOM 122 CB VAL S 462 -8.330 -4.848 -2.663 1.00 0.00 C ATOM 123 CG1 VAL S 462 -9.462 -5.374 -1.791 1.00 0.00 C ATOM 124 CG2 VAL S 462 -7.187 -4.303 -1.818 1.00 0.00 C ATOM 0 H VAL S 462 -5.808 -6.461 -3.372 1.00 0.00 H new ATOM 0 HA VAL S 462 -8.631 -6.645 -3.812 1.00 0.00 H new ATOM 0 HB VAL S 462 -8.728 -4.027 -3.259 1.00 0.00 H new ATOM 0 HG11 VAL S 462 -9.806 -4.583 -1.125 1.00 0.00 H new ATOM 0 HG12 VAL S 462 -10.288 -5.700 -2.424 1.00 0.00 H new ATOM 0 HG13 VAL S 462 -9.104 -6.217 -1.199 1.00 0.00 H new ATOM 0 HG21 VAL S 462 -7.566 -3.530 -1.149 1.00 0.00 H new ATOM 0 HG22 VAL S 462 -6.752 -5.111 -1.230 1.00 0.00 H new ATOM 0 HG23 VAL S 462 -6.424 -3.877 -2.469 1.00 0.00 H new ATOM 134 N GLU S 463 -8.046 -5.585 -6.007 1.00 0.00 N ATOM 135 CA GLU S 463 -7.701 -4.994 -7.288 1.00 0.00 C ATOM 136 C GLU S 463 -7.663 -3.474 -7.179 1.00 0.00 C ATOM 137 O GLU S 463 -8.291 -2.895 -6.296 1.00 0.00 O ATOM 138 CB GLU S 463 -8.702 -5.420 -8.364 1.00 0.00 C ATOM 139 CG GLU S 463 -8.179 -6.521 -9.265 1.00 0.00 C ATOM 140 CD GLU S 463 -9.181 -6.931 -10.327 1.00 0.00 C ATOM 141 OE1 GLU S 463 -10.363 -7.131 -9.983 1.00 0.00 O ATOM 142 OE2 GLU S 463 -8.780 -7.053 -11.506 1.00 0.00 O ATOM 0 H GLU S 463 -8.830 -6.237 -6.035 1.00 0.00 H new ATOM 0 HA GLU S 463 -6.711 -5.350 -7.574 1.00 0.00 H new ATOM 0 HB2 GLU S 463 -9.620 -5.758 -7.883 1.00 0.00 H new ATOM 0 HB3 GLU S 463 -8.961 -4.554 -8.973 1.00 0.00 H new ATOM 0 HG2 GLU S 463 -7.261 -6.185 -9.747 1.00 0.00 H new ATOM 0 HG3 GLU S 463 -7.922 -7.390 -8.659 1.00 0.00 H new ATOM 149 N ALA S 464 -6.925 -2.832 -8.073 1.00 0.00 N ATOM 150 CA ALA S 464 -6.819 -1.383 -8.059 1.00 0.00 C ATOM 151 C ALA S 464 -7.910 -0.765 -8.922 1.00 0.00 C ATOM 152 O ALA S 464 -8.435 -1.410 -9.830 1.00 0.00 O ATOM 153 CB ALA S 464 -5.444 -0.942 -8.539 1.00 0.00 C ATOM 0 H ALA S 464 -6.394 -3.290 -8.813 1.00 0.00 H new ATOM 0 HA ALA S 464 -6.950 -1.037 -7.034 1.00 0.00 H new ATOM 0 HB1 ALA S 464 -5.384 0.146 -8.521 1.00 0.00 H new ATOM 0 HB2 ALA S 464 -4.679 -1.358 -7.883 1.00 0.00 H new ATOM 0 HB3 ALA S 464 -5.282 -1.298 -9.557 1.00 0.00 H new ATOM 159 N LEU S 465 -8.260 0.480 -8.633 1.00 0.00 N ATOM 160 CA LEU S 465 -9.301 1.168 -9.384 1.00 0.00 C ATOM 161 C LEU S 465 -8.784 2.464 -10.004 1.00 0.00 C ATOM 162 O LEU S 465 -9.493 3.120 -10.767 1.00 0.00 O ATOM 163 CB LEU S 465 -10.491 1.463 -8.473 1.00 0.00 C ATOM 164 CG LEU S 465 -11.110 0.234 -7.804 1.00 0.00 C ATOM 165 CD1 LEU S 465 -10.184 -0.317 -6.738 1.00 0.00 C ATOM 166 CD2 LEU S 465 -12.469 0.576 -7.213 1.00 0.00 C ATOM 0 H LEU S 465 -7.840 1.033 -7.886 1.00 0.00 H new ATOM 0 HA LEU S 465 -9.617 0.513 -10.196 1.00 0.00 H new ATOM 0 HB2 LEU S 465 -10.172 2.159 -7.697 1.00 0.00 H new ATOM 0 HB3 LEU S 465 -11.261 1.967 -9.057 1.00 0.00 H new ATOM 0 HG LEU S 465 -11.251 -0.536 -8.562 1.00 0.00 H new ATOM 0 HD11 LEU S 465 -10.642 -1.190 -6.274 1.00 0.00 H new ATOM 0 HD12 LEU S 465 -9.235 -0.603 -7.192 1.00 0.00 H new ATOM 0 HD13 LEU S 465 -10.007 0.446 -5.980 1.00 0.00 H new ATOM 0 HD21 LEU S 465 -12.894 -0.310 -6.741 1.00 0.00 H new ATOM 0 HD22 LEU S 465 -12.354 1.364 -6.468 1.00 0.00 H new ATOM 0 HD23 LEU S 465 -13.134 0.920 -8.005 1.00 0.00 H new ATOM 178 N PHE S 466 -7.550 2.835 -9.675 1.00 0.00 N ATOM 179 CA PHE S 466 -6.960 4.056 -10.207 1.00 0.00 C ATOM 180 C PHE S 466 -5.445 3.965 -10.273 1.00 0.00 C ATOM 181 O PHE S 466 -4.813 3.303 -9.452 1.00 0.00 O ATOM 182 CB PHE S 466 -7.337 5.252 -9.341 1.00 0.00 C ATOM 183 CG PHE S 466 -8.783 5.302 -8.961 1.00 0.00 C ATOM 184 CD1 PHE S 466 -9.712 5.864 -9.814 1.00 0.00 C ATOM 185 CD2 PHE S 466 -9.208 4.801 -7.740 1.00 0.00 C ATOM 186 CE1 PHE S 466 -11.041 5.933 -9.459 1.00 0.00 C ATOM 187 CE2 PHE S 466 -10.538 4.861 -7.381 1.00 0.00 C ATOM 188 CZ PHE S 466 -11.454 5.432 -8.244 1.00 0.00 C ATOM 0 H PHE S 466 -6.943 2.310 -9.046 1.00 0.00 H new ATOM 0 HA PHE S 466 -7.351 4.184 -11.216 1.00 0.00 H new ATOM 0 HB2 PHE S 466 -6.735 5.233 -8.433 1.00 0.00 H new ATOM 0 HB3 PHE S 466 -7.081 6.168 -9.874 1.00 0.00 H new ATOM 0 HD1 PHE S 466 -9.393 6.254 -10.770 1.00 0.00 H new ATOM 0 HD2 PHE S 466 -8.491 4.360 -7.064 1.00 0.00 H new ATOM 0 HE1 PHE S 466 -11.758 6.379 -10.132 1.00 0.00 H new ATOM 0 HE2 PHE S 466 -10.862 4.464 -6.430 1.00 0.00 H new ATOM 0 HZ PHE S 466 -12.496 5.486 -7.965 1.00 0.00 H new ATOM 198 N SER S 467 -4.867 4.670 -11.237 1.00 0.00 N ATOM 199 CA SER S 467 -3.423 4.704 -11.391 1.00 0.00 C ATOM 200 C SER S 467 -2.839 5.750 -10.451 1.00 0.00 C ATOM 201 O SER S 467 -2.912 6.950 -10.717 1.00 0.00 O ATOM 202 CB SER S 467 -3.043 5.019 -12.838 1.00 0.00 C ATOM 203 OG SER S 467 -3.917 4.375 -13.748 1.00 0.00 O ATOM 0 H SER S 467 -5.378 5.225 -11.923 1.00 0.00 H new ATOM 0 HA SER S 467 -3.015 3.725 -11.140 1.00 0.00 H new ATOM 0 HB2 SER S 467 -3.075 6.097 -12.999 1.00 0.00 H new ATOM 0 HB3 SER S 467 -2.018 4.699 -13.026 1.00 0.00 H new ATOM 0 HG SER S 467 -3.653 4.594 -14.666 1.00 0.00 H new ATOM 209 N TYR S 468 -2.275 5.289 -9.343 1.00 0.00 N ATOM 210 CA TYR S 468 -1.694 6.181 -8.349 1.00 0.00 C ATOM 211 C TYR S 468 -0.312 6.649 -8.798 1.00 0.00 C ATOM 212 O TYR S 468 0.578 5.838 -9.050 1.00 0.00 O ATOM 213 CB TYR S 468 -1.625 5.458 -6.998 1.00 0.00 C ATOM 214 CG TYR S 468 -1.014 6.258 -5.862 1.00 0.00 C ATOM 215 CD1 TYR S 468 -0.840 7.633 -5.950 1.00 0.00 C ATOM 216 CD2 TYR S 468 -0.616 5.621 -4.691 1.00 0.00 C ATOM 217 CE1 TYR S 468 -0.284 8.350 -4.904 1.00 0.00 C ATOM 218 CE2 TYR S 468 -0.062 6.330 -3.644 1.00 0.00 C ATOM 219 CZ TYR S 468 0.104 7.693 -3.755 1.00 0.00 C ATOM 220 OH TYR S 468 0.656 8.404 -2.714 1.00 0.00 O ATOM 0 H TYR S 468 -2.207 4.298 -9.109 1.00 0.00 H new ATOM 0 HA TYR S 468 -2.321 7.066 -8.240 1.00 0.00 H new ATOM 0 HB2 TYR S 468 -2.634 5.164 -6.711 1.00 0.00 H new ATOM 0 HB3 TYR S 468 -1.049 4.541 -7.125 1.00 0.00 H new ATOM 0 HD1 TYR S 468 -1.143 8.151 -6.848 1.00 0.00 H new ATOM 0 HD2 TYR S 468 -0.743 4.552 -4.599 1.00 0.00 H new ATOM 0 HE1 TYR S 468 -0.155 9.419 -4.987 1.00 0.00 H new ATOM 0 HE2 TYR S 468 0.240 5.818 -2.742 1.00 0.00 H new ATOM 0 HH TYR S 468 1.624 8.256 -2.694 1.00 0.00 H new ATOM 230 N GLU S 469 -0.156 7.966 -8.920 1.00 0.00 N ATOM 231 CA GLU S 469 1.100 8.572 -9.364 1.00 0.00 C ATOM 232 C GLU S 469 2.181 8.545 -8.286 1.00 0.00 C ATOM 233 O GLU S 469 3.167 9.278 -8.368 1.00 0.00 O ATOM 234 CB GLU S 469 0.851 10.012 -9.776 1.00 0.00 C ATOM 235 CG GLU S 469 0.351 10.882 -8.638 1.00 0.00 C ATOM 236 CD GLU S 469 0.054 12.304 -9.074 1.00 0.00 C ATOM 237 OE1 GLU S 469 0.973 13.148 -9.015 1.00 0.00 O ATOM 238 OE2 GLU S 469 -1.097 12.573 -9.478 1.00 0.00 O ATOM 0 H GLU S 469 -0.892 8.641 -8.715 1.00 0.00 H new ATOM 0 HA GLU S 469 1.459 7.982 -10.207 1.00 0.00 H new ATOM 0 HB2 GLU S 469 1.775 10.435 -10.169 1.00 0.00 H new ATOM 0 HB3 GLU S 469 0.122 10.030 -10.586 1.00 0.00 H new ATOM 0 HG2 GLU S 469 -0.552 10.439 -8.218 1.00 0.00 H new ATOM 0 HG3 GLU S 469 1.097 10.898 -7.844 1.00 0.00 H new ATOM 245 N ALA S 470 1.987 7.707 -7.282 1.00 0.00 N ATOM 246 CA ALA S 470 2.936 7.577 -6.177 1.00 0.00 C ATOM 247 C ALA S 470 4.383 7.641 -6.662 1.00 0.00 C ATOM 248 O ALA S 470 4.867 6.726 -7.326 1.00 0.00 O ATOM 249 CB ALA S 470 2.688 6.274 -5.439 1.00 0.00 C ATOM 0 H ALA S 470 1.173 7.098 -7.205 1.00 0.00 H new ATOM 0 HA ALA S 470 2.780 8.417 -5.500 1.00 0.00 H new ATOM 0 HB1 ALA S 470 3.397 6.181 -4.616 1.00 0.00 H new ATOM 0 HB2 ALA S 470 1.672 6.267 -5.045 1.00 0.00 H new ATOM 0 HB3 ALA S 470 2.817 5.437 -6.125 1.00 0.00 H new ATOM 255 N THR S 471 5.062 8.731 -6.323 1.00 0.00 N ATOM 256 CA THR S 471 6.451 8.920 -6.719 1.00 0.00 C ATOM 257 C THR S 471 7.388 8.571 -5.569 1.00 0.00 C ATOM 258 O THR S 471 8.443 7.971 -5.777 1.00 0.00 O ATOM 259 CB THR S 471 6.686 10.364 -7.164 1.00 0.00 C ATOM 260 OG1 THR S 471 5.984 11.267 -6.328 1.00 0.00 O ATOM 261 CG2 THR S 471 6.254 10.629 -8.590 1.00 0.00 C ATOM 0 H THR S 471 4.672 9.497 -5.774 1.00 0.00 H new ATOM 0 HA THR S 471 6.661 8.254 -7.556 1.00 0.00 H new ATOM 0 HB THR S 471 7.763 10.516 -7.094 1.00 0.00 H new ATOM 0 HG1 THR S 471 6.148 12.185 -6.628 1.00 0.00 H new ATOM 0 HG21 THR S 471 6.448 11.672 -8.841 1.00 0.00 H new ATOM 0 HG22 THR S 471 6.814 9.982 -9.266 1.00 0.00 H new ATOM 0 HG23 THR S 471 5.188 10.424 -8.691 1.00 0.00 H new ATOM 269 N GLN S 472 6.996 8.944 -4.354 1.00 0.00 N ATOM 270 CA GLN S 472 7.806 8.663 -3.170 1.00 0.00 C ATOM 271 C GLN S 472 8.209 7.189 -3.128 1.00 0.00 C ATOM 272 O GLN S 472 7.723 6.381 -3.918 1.00 0.00 O ATOM 273 CB GLN S 472 7.069 9.052 -1.882 1.00 0.00 C ATOM 274 CG GLN S 472 5.553 8.946 -1.968 1.00 0.00 C ATOM 275 CD GLN S 472 4.876 10.303 -2.009 1.00 0.00 C ATOM 276 OE1 GLN S 472 5.112 11.154 -1.153 1.00 0.00 O ATOM 277 NE2 GLN S 472 4.026 10.510 -3.009 1.00 0.00 N ATOM 0 H GLN S 472 6.126 9.440 -4.162 1.00 0.00 H new ATOM 0 HA GLN S 472 8.709 9.270 -3.237 1.00 0.00 H new ATOM 0 HB2 GLN S 472 7.420 8.415 -1.070 1.00 0.00 H new ATOM 0 HB3 GLN S 472 7.335 10.076 -1.621 1.00 0.00 H new ATOM 0 HG2 GLN S 472 5.282 8.381 -2.860 1.00 0.00 H new ATOM 0 HG3 GLN S 472 5.182 8.385 -1.110 1.00 0.00 H new ATOM 0 HE21 GLN S 472 3.860 9.776 -3.697 1.00 0.00 H new ATOM 0 HE22 GLN S 472 3.540 11.403 -3.088 1.00 0.00 H new ATOM 286 N PRO S 473 9.129 6.826 -2.219 1.00 0.00 N ATOM 287 CA PRO S 473 9.628 5.452 -2.093 1.00 0.00 C ATOM 288 C PRO S 473 8.584 4.457 -1.574 1.00 0.00 C ATOM 289 O PRO S 473 8.133 3.585 -2.314 1.00 0.00 O ATOM 290 CB PRO S 473 10.794 5.573 -1.098 1.00 0.00 C ATOM 291 CG PRO S 473 11.082 7.033 -0.991 1.00 0.00 C ATOM 292 CD PRO S 473 9.783 7.730 -1.265 1.00 0.00 C ATOM 0 HA PRO S 473 9.913 5.056 -3.068 1.00 0.00 H new ATOM 0 HB2 PRO S 473 10.526 5.154 -0.128 1.00 0.00 H new ATOM 0 HB3 PRO S 473 11.668 5.026 -1.451 1.00 0.00 H new ATOM 0 HG2 PRO S 473 11.459 7.285 0.000 1.00 0.00 H new ATOM 0 HG3 PRO S 473 11.846 7.334 -1.708 1.00 0.00 H new ATOM 0 HD2 PRO S 473 9.192 7.858 -0.358 1.00 0.00 H new ATOM 0 HD3 PRO S 473 9.937 8.723 -1.688 1.00 0.00 H new ATOM 300 N GLU S 474 8.231 4.571 -0.295 1.00 0.00 N ATOM 301 CA GLU S 474 7.270 3.650 0.316 1.00 0.00 C ATOM 302 C GLU S 474 5.960 3.568 -0.472 1.00 0.00 C ATOM 303 O GLU S 474 5.420 2.481 -0.669 1.00 0.00 O ATOM 304 CB GLU S 474 6.996 4.041 1.774 1.00 0.00 C ATOM 305 CG GLU S 474 5.983 5.162 1.946 1.00 0.00 C ATOM 306 CD GLU S 474 6.505 6.501 1.467 1.00 0.00 C ATOM 307 OE1 GLU S 474 7.721 6.748 1.605 1.00 0.00 O ATOM 308 OE2 GLU S 474 5.698 7.304 0.954 1.00 0.00 O ATOM 0 H GLU S 474 8.592 5.286 0.336 1.00 0.00 H new ATOM 0 HA GLU S 474 7.722 2.658 0.294 1.00 0.00 H new ATOM 0 HB2 GLU S 474 6.641 3.162 2.312 1.00 0.00 H new ATOM 0 HB3 GLU S 474 7.935 4.342 2.239 1.00 0.00 H new ATOM 0 HG2 GLU S 474 5.075 4.913 1.397 1.00 0.00 H new ATOM 0 HG3 GLU S 474 5.708 5.239 2.998 1.00 0.00 H new ATOM 315 N ASP S 475 5.449 4.713 -0.922 1.00 0.00 N ATOM 316 CA ASP S 475 4.205 4.747 -1.679 1.00 0.00 C ATOM 317 C ASP S 475 4.226 3.739 -2.823 1.00 0.00 C ATOM 318 O ASP S 475 5.027 3.851 -3.751 1.00 0.00 O ATOM 319 CB ASP S 475 3.967 6.150 -2.224 1.00 0.00 C ATOM 320 CG ASP S 475 3.173 7.019 -1.267 1.00 0.00 C ATOM 321 OD1 ASP S 475 2.782 6.518 -0.192 1.00 0.00 O ATOM 322 OD2 ASP S 475 2.940 8.202 -1.595 1.00 0.00 O ATOM 0 H ASP S 475 5.879 5.626 -0.774 1.00 0.00 H new ATOM 0 HA ASP S 475 3.391 4.477 -1.006 1.00 0.00 H new ATOM 0 HB2 ASP S 475 4.927 6.624 -2.429 1.00 0.00 H new ATOM 0 HB3 ASP S 475 3.436 6.082 -3.173 1.00 0.00 H new ATOM 327 N LEU S 476 3.333 2.760 -2.750 1.00 0.00 N ATOM 328 CA LEU S 476 3.238 1.732 -3.776 1.00 0.00 C ATOM 329 C LEU S 476 2.466 2.267 -4.977 1.00 0.00 C ATOM 330 O LEU S 476 1.264 2.520 -4.899 1.00 0.00 O ATOM 331 CB LEU S 476 2.558 0.479 -3.212 1.00 0.00 C ATOM 332 CG LEU S 476 2.222 -0.597 -4.245 1.00 0.00 C ATOM 333 CD1 LEU S 476 3.454 -0.970 -5.053 1.00 0.00 C ATOM 334 CD2 LEU S 476 1.632 -1.824 -3.571 1.00 0.00 C ATOM 0 H LEU S 476 2.663 2.657 -1.988 1.00 0.00 H new ATOM 0 HA LEU S 476 4.243 1.460 -4.100 1.00 0.00 H new ATOM 0 HB2 LEU S 476 3.208 0.042 -2.453 1.00 0.00 H new ATOM 0 HB3 LEU S 476 1.638 0.779 -2.710 1.00 0.00 H new ATOM 0 HG LEU S 476 1.476 -0.191 -4.928 1.00 0.00 H new ATOM 0 HD11 LEU S 476 3.193 -1.737 -5.782 1.00 0.00 H new ATOM 0 HD12 LEU S 476 3.829 -0.088 -5.573 1.00 0.00 H new ATOM 0 HD13 LEU S 476 4.225 -1.353 -4.385 1.00 0.00 H new ATOM 0 HD21 LEU S 476 1.400 -2.577 -4.324 1.00 0.00 H new ATOM 0 HD22 LEU S 476 2.352 -2.231 -2.861 1.00 0.00 H new ATOM 0 HD23 LEU S 476 0.720 -1.546 -3.043 1.00 0.00 H new ATOM 346 N GLU S 477 3.176 2.454 -6.084 1.00 0.00 N ATOM 347 CA GLU S 477 2.579 2.980 -7.305 1.00 0.00 C ATOM 348 C GLU S 477 1.982 1.866 -8.159 1.00 0.00 C ATOM 349 O GLU S 477 2.558 0.784 -8.279 1.00 0.00 O ATOM 350 CB GLU S 477 3.635 3.735 -8.114 1.00 0.00 C ATOM 351 CG GLU S 477 3.080 4.908 -8.903 1.00 0.00 C ATOM 352 CD GLU S 477 4.143 5.613 -9.725 1.00 0.00 C ATOM 353 OE1 GLU S 477 4.995 4.917 -10.316 1.00 0.00 O ATOM 354 OE2 GLU S 477 4.122 6.861 -9.777 1.00 0.00 O ATOM 0 H GLU S 477 4.172 2.247 -6.160 1.00 0.00 H new ATOM 0 HA GLU S 477 1.775 3.658 -7.020 1.00 0.00 H new ATOM 0 HB2 GLU S 477 4.407 4.098 -7.436 1.00 0.00 H new ATOM 0 HB3 GLU S 477 4.116 3.041 -8.803 1.00 0.00 H new ATOM 0 HG2 GLU S 477 2.289 4.555 -9.565 1.00 0.00 H new ATOM 0 HG3 GLU S 477 2.625 5.621 -8.215 1.00 0.00 H new ATOM 361 N PHE S 478 0.829 2.144 -8.760 1.00 0.00 N ATOM 362 CA PHE S 478 0.160 1.169 -9.615 1.00 0.00 C ATOM 363 C PHE S 478 -0.749 1.868 -10.621 1.00 0.00 C ATOM 364 O PHE S 478 -1.010 3.065 -10.508 1.00 0.00 O ATOM 365 CB PHE S 478 -0.650 0.172 -8.781 1.00 0.00 C ATOM 366 CG PHE S 478 -1.131 0.725 -7.470 1.00 0.00 C ATOM 367 CD1 PHE S 478 -2.095 1.717 -7.434 1.00 0.00 C ATOM 368 CD2 PHE S 478 -0.617 0.251 -6.274 1.00 0.00 C ATOM 369 CE1 PHE S 478 -2.539 2.228 -6.230 1.00 0.00 C ATOM 370 CE2 PHE S 478 -1.056 0.758 -5.067 1.00 0.00 C ATOM 371 CZ PHE S 478 -2.019 1.748 -5.045 1.00 0.00 C ATOM 0 H PHE S 478 0.339 3.034 -8.671 1.00 0.00 H new ATOM 0 HA PHE S 478 0.929 0.620 -10.159 1.00 0.00 H new ATOM 0 HB2 PHE S 478 -1.511 -0.158 -9.363 1.00 0.00 H new ATOM 0 HB3 PHE S 478 -0.037 -0.709 -8.590 1.00 0.00 H new ATOM 0 HD1 PHE S 478 -2.505 2.096 -8.358 1.00 0.00 H new ATOM 0 HD2 PHE S 478 0.135 -0.524 -6.286 1.00 0.00 H new ATOM 0 HE1 PHE S 478 -3.292 3.002 -6.216 1.00 0.00 H new ATOM 0 HE2 PHE S 478 -0.647 0.381 -4.141 1.00 0.00 H new ATOM 0 HZ PHE S 478 -2.364 2.146 -4.102 1.00 0.00 H new ATOM 381 N GLN S 479 -1.223 1.115 -11.609 1.00 0.00 N ATOM 382 CA GLN S 479 -2.097 1.666 -12.638 1.00 0.00 C ATOM 383 C GLN S 479 -3.530 1.176 -12.462 1.00 0.00 C ATOM 384 O GLN S 479 -3.780 0.198 -11.756 1.00 0.00 O ATOM 385 CB GLN S 479 -1.584 1.288 -14.029 1.00 0.00 C ATOM 386 CG GLN S 479 -1.327 -0.201 -14.197 1.00 0.00 C ATOM 387 CD GLN S 479 0.128 -0.568 -13.975 1.00 0.00 C ATOM 388 OE1 GLN S 479 1.026 -0.011 -14.606 1.00 0.00 O ATOM 389 NE2 GLN S 479 0.369 -1.514 -13.073 1.00 0.00 N ATOM 0 H GLN S 479 -1.016 0.122 -11.718 1.00 0.00 H new ATOM 0 HA GLN S 479 -2.091 2.751 -12.537 1.00 0.00 H new ATOM 0 HB2 GLN S 479 -2.311 1.610 -14.775 1.00 0.00 H new ATOM 0 HB3 GLN S 479 -0.661 1.833 -14.227 1.00 0.00 H new ATOM 0 HG2 GLN S 479 -1.949 -0.755 -13.495 1.00 0.00 H new ATOM 0 HG3 GLN S 479 -1.627 -0.507 -15.199 1.00 0.00 H new ATOM 0 HE21 GLN S 479 -0.405 -1.950 -12.572 1.00 0.00 H new ATOM 0 HE22 GLN S 479 1.328 -1.804 -12.882 1.00 0.00 H new ATOM 398 N GLU S 480 -4.469 1.862 -13.110 1.00 0.00 N ATOM 399 CA GLU S 480 -5.882 1.504 -13.030 1.00 0.00 C ATOM 400 C GLU S 480 -6.090 0.005 -13.215 1.00 0.00 C ATOM 401 O GLU S 480 -5.365 -0.648 -13.965 1.00 0.00 O ATOM 402 CB GLU S 480 -6.671 2.272 -14.090 1.00 0.00 C ATOM 403 CG GLU S 480 -7.252 3.574 -13.580 1.00 0.00 C ATOM 404 CD GLU S 480 -7.899 4.398 -14.678 1.00 0.00 C ATOM 405 OE1 GLU S 480 -7.160 5.069 -15.428 1.00 0.00 O ATOM 406 OE2 GLU S 480 -9.142 4.372 -14.785 1.00 0.00 O ATOM 0 H GLU S 480 -4.275 2.672 -13.699 1.00 0.00 H new ATOM 0 HA GLU S 480 -6.242 1.773 -12.037 1.00 0.00 H new ATOM 0 HB2 GLU S 480 -6.018 2.481 -14.938 1.00 0.00 H new ATOM 0 HB3 GLU S 480 -7.480 1.641 -14.458 1.00 0.00 H new ATOM 0 HG2 GLU S 480 -7.992 3.359 -12.809 1.00 0.00 H new ATOM 0 HG3 GLU S 480 -6.462 4.160 -13.110 1.00 0.00 H new ATOM 413 N GLY S 481 -7.091 -0.535 -12.525 1.00 0.00 N ATOM 414 CA GLY S 481 -7.386 -1.954 -12.620 1.00 0.00 C ATOM 415 C GLY S 481 -6.148 -2.820 -12.491 1.00 0.00 C ATOM 416 O GLY S 481 -5.646 -3.346 -13.485 1.00 0.00 O ATOM 0 H GLY S 481 -7.705 -0.013 -11.900 1.00 0.00 H new ATOM 0 HA2 GLY S 481 -8.097 -2.226 -11.840 1.00 0.00 H new ATOM 0 HA3 GLY S 481 -7.868 -2.157 -13.576 1.00 0.00 H new ATOM 420 N ASP S 482 -5.647 -2.965 -11.267 1.00 0.00 N ATOM 421 CA ASP S 482 -4.456 -3.771 -11.026 1.00 0.00 C ATOM 422 C ASP S 482 -4.703 -4.825 -9.957 1.00 0.00 C ATOM 423 O ASP S 482 -5.645 -4.725 -9.177 1.00 0.00 O ATOM 424 CB ASP S 482 -3.280 -2.874 -10.627 1.00 0.00 C ATOM 425 CG ASP S 482 -2.044 -3.662 -10.232 1.00 0.00 C ATOM 426 OD1 ASP S 482 -1.726 -4.653 -10.922 1.00 0.00 O ATOM 427 OD2 ASP S 482 -1.396 -3.288 -9.231 1.00 0.00 O ATOM 0 H ASP S 482 -6.046 -2.537 -10.431 1.00 0.00 H new ATOM 0 HA ASP S 482 -4.210 -4.289 -11.953 1.00 0.00 H new ATOM 0 HB2 ASP S 482 -3.034 -2.215 -11.459 1.00 0.00 H new ATOM 0 HB3 ASP S 482 -3.581 -2.238 -9.794 1.00 0.00 H new ATOM 432 N ILE S 483 -3.841 -5.836 -9.931 1.00 0.00 N ATOM 433 CA ILE S 483 -3.956 -6.915 -8.961 1.00 0.00 C ATOM 434 C ILE S 483 -2.925 -6.758 -7.848 1.00 0.00 C ATOM 435 O ILE S 483 -1.909 -7.452 -7.825 1.00 0.00 O ATOM 436 CB ILE S 483 -3.771 -8.291 -9.624 1.00 0.00 C ATOM 437 CG1 ILE S 483 -4.625 -8.396 -10.887 1.00 0.00 C ATOM 438 CG2 ILE S 483 -4.122 -9.397 -8.644 1.00 0.00 C ATOM 439 CD1 ILE S 483 -6.104 -8.197 -10.634 1.00 0.00 C ATOM 0 H ILE S 483 -3.054 -5.929 -10.573 1.00 0.00 H new ATOM 0 HA ILE S 483 -4.960 -6.858 -8.539 1.00 0.00 H new ATOM 0 HB ILE S 483 -2.725 -8.403 -9.911 1.00 0.00 H new ATOM 0 HG12 ILE S 483 -4.285 -7.653 -11.609 1.00 0.00 H new ATOM 0 HG13 ILE S 483 -4.471 -9.375 -11.340 1.00 0.00 H new ATOM 0 HG21 ILE S 483 -3.987 -10.366 -9.125 1.00 0.00 H new ATOM 0 HG22 ILE S 483 -3.471 -9.331 -7.772 1.00 0.00 H new ATOM 0 HG23 ILE S 483 -5.160 -9.289 -8.330 1.00 0.00 H new ATOM 0 HD11 ILE S 483 -6.649 -8.285 -11.574 1.00 0.00 H new ATOM 0 HD12 ILE S 483 -6.459 -8.956 -9.936 1.00 0.00 H new ATOM 0 HD13 ILE S 483 -6.271 -7.207 -10.209 1.00 0.00 H new ATOM 451 N ILE S 484 -3.195 -5.840 -6.929 1.00 0.00 N ATOM 452 CA ILE S 484 -2.293 -5.587 -5.815 1.00 0.00 C ATOM 453 C ILE S 484 -2.470 -6.626 -4.716 1.00 0.00 C ATOM 454 O ILE S 484 -3.518 -7.262 -4.607 1.00 0.00 O ATOM 455 CB ILE S 484 -2.531 -4.191 -5.208 1.00 0.00 C ATOM 456 CG1 ILE S 484 -2.410 -3.115 -6.283 1.00 0.00 C ATOM 457 CG2 ILE S 484 -1.555 -3.922 -4.072 1.00 0.00 C ATOM 458 CD1 ILE S 484 -3.092 -1.823 -5.906 1.00 0.00 C ATOM 0 H ILE S 484 -4.033 -5.258 -6.934 1.00 0.00 H new ATOM 0 HA ILE S 484 -1.280 -5.644 -6.214 1.00 0.00 H new ATOM 0 HB ILE S 484 -3.542 -4.163 -4.801 1.00 0.00 H new ATOM 0 HG12 ILE S 484 -1.355 -2.919 -6.476 1.00 0.00 H new ATOM 0 HG13 ILE S 484 -2.840 -3.488 -7.212 1.00 0.00 H new ATOM 0 HG21 ILE S 484 -1.742 -2.931 -3.659 1.00 0.00 H new ATOM 0 HG22 ILE S 484 -1.689 -4.671 -3.292 1.00 0.00 H new ATOM 0 HG23 ILE S 484 -0.534 -3.971 -4.450 1.00 0.00 H new ATOM 0 HD11 ILE S 484 -2.970 -1.099 -6.711 1.00 0.00 H new ATOM 0 HD12 ILE S 484 -4.154 -2.007 -5.741 1.00 0.00 H new ATOM 0 HD13 ILE S 484 -2.646 -1.429 -4.993 1.00 0.00 H new ATOM 470 N LEU S 485 -1.441 -6.775 -3.891 1.00 0.00 N ATOM 471 CA LEU S 485 -1.480 -7.717 -2.785 1.00 0.00 C ATOM 472 C LEU S 485 -1.316 -6.976 -1.465 1.00 0.00 C ATOM 473 O LEU S 485 -0.229 -6.503 -1.135 1.00 0.00 O ATOM 474 CB LEU S 485 -0.390 -8.785 -2.947 1.00 0.00 C ATOM 475 CG LEU S 485 -0.011 -9.578 -1.681 1.00 0.00 C ATOM 476 CD1 LEU S 485 1.041 -8.833 -0.872 1.00 0.00 C ATOM 477 CD2 LEU S 485 -1.235 -9.874 -0.818 1.00 0.00 C ATOM 0 H LEU S 485 -0.568 -6.253 -3.969 1.00 0.00 H new ATOM 0 HA LEU S 485 -2.447 -8.219 -2.785 1.00 0.00 H new ATOM 0 HB2 LEU S 485 -0.717 -9.493 -3.708 1.00 0.00 H new ATOM 0 HB3 LEU S 485 0.509 -8.300 -3.328 1.00 0.00 H new ATOM 0 HG LEU S 485 0.408 -10.531 -2.005 1.00 0.00 H new ATOM 0 HD11 LEU S 485 1.293 -9.411 0.017 1.00 0.00 H new ATOM 0 HD12 LEU S 485 1.935 -8.693 -1.479 1.00 0.00 H new ATOM 0 HD13 LEU S 485 0.649 -7.861 -0.573 1.00 0.00 H new ATOM 0 HD21 LEU S 485 -0.930 -10.434 0.066 1.00 0.00 H new ATOM 0 HD22 LEU S 485 -1.699 -8.937 -0.511 1.00 0.00 H new ATOM 0 HD23 LEU S 485 -1.951 -10.463 -1.392 1.00 0.00 H new ATOM 489 N VAL S 486 -2.402 -6.884 -0.712 1.00 0.00 N ATOM 490 CA VAL S 486 -2.372 -6.211 0.578 1.00 0.00 C ATOM 491 C VAL S 486 -1.641 -7.076 1.576 1.00 0.00 C ATOM 492 O VAL S 486 -2.142 -8.130 1.944 1.00 0.00 O ATOM 493 CB VAL S 486 -3.780 -5.945 1.159 1.00 0.00 C ATOM 494 CG1 VAL S 486 -3.775 -4.694 2.010 1.00 0.00 C ATOM 495 CG2 VAL S 486 -4.844 -5.853 0.077 1.00 0.00 C ATOM 0 H VAL S 486 -3.312 -7.265 -0.971 1.00 0.00 H new ATOM 0 HA VAL S 486 -1.877 -5.254 0.411 1.00 0.00 H new ATOM 0 HB VAL S 486 -4.036 -6.799 1.786 1.00 0.00 H new ATOM 0 HG11 VAL S 486 -4.774 -4.522 2.411 1.00 0.00 H new ATOM 0 HG12 VAL S 486 -3.070 -4.816 2.833 1.00 0.00 H new ATOM 0 HG13 VAL S 486 -3.477 -3.841 1.401 1.00 0.00 H new ATOM 0 HG21 VAL S 486 -5.815 -5.665 0.536 1.00 0.00 H new ATOM 0 HG22 VAL S 486 -4.601 -5.037 -0.604 1.00 0.00 H new ATOM 0 HG23 VAL S 486 -4.880 -6.790 -0.478 1.00 0.00 H new ATOM 505 N LEU S 487 -0.474 -6.653 2.023 1.00 0.00 N ATOM 506 CA LEU S 487 0.260 -7.456 2.993 1.00 0.00 C ATOM 507 C LEU S 487 -0.283 -7.276 4.405 1.00 0.00 C ATOM 508 O LEU S 487 -0.062 -8.125 5.269 1.00 0.00 O ATOM 509 CB LEU S 487 1.749 -7.136 2.964 1.00 0.00 C ATOM 510 CG LEU S 487 2.592 -8.011 2.027 1.00 0.00 C ATOM 511 CD1 LEU S 487 4.066 -7.887 2.374 1.00 0.00 C ATOM 512 CD2 LEU S 487 2.158 -9.472 2.110 1.00 0.00 C ATOM 0 H LEU S 487 -0.020 -5.784 1.743 1.00 0.00 H new ATOM 0 HA LEU S 487 0.121 -8.498 2.706 1.00 0.00 H new ATOM 0 HB2 LEU S 487 1.874 -6.094 2.670 1.00 0.00 H new ATOM 0 HB3 LEU S 487 2.144 -7.231 3.976 1.00 0.00 H new ATOM 0 HG LEU S 487 2.436 -7.662 1.006 1.00 0.00 H new ATOM 0 HD11 LEU S 487 4.652 -8.513 1.701 1.00 0.00 H new ATOM 0 HD12 LEU S 487 4.379 -6.848 2.268 1.00 0.00 H new ATOM 0 HD13 LEU S 487 4.226 -8.211 3.402 1.00 0.00 H new ATOM 0 HD21 LEU S 487 2.770 -10.072 1.437 1.00 0.00 H new ATOM 0 HD22 LEU S 487 2.283 -9.831 3.132 1.00 0.00 H new ATOM 0 HD23 LEU S 487 1.110 -9.557 1.821 1.00 0.00 H new ATOM 524 N SER S 488 -0.998 -6.181 4.636 1.00 0.00 N ATOM 525 CA SER S 488 -1.574 -5.907 5.955 1.00 0.00 C ATOM 526 C SER S 488 -2.167 -4.505 6.024 1.00 0.00 C ATOM 527 O SER S 488 -1.837 -3.640 5.217 1.00 0.00 O ATOM 528 CB SER S 488 -0.508 -6.032 7.049 1.00 0.00 C ATOM 529 OG SER S 488 -1.078 -6.460 8.273 1.00 0.00 O ATOM 0 H SER S 488 -1.194 -5.469 3.933 1.00 0.00 H new ATOM 0 HA SER S 488 -2.363 -6.642 6.114 1.00 0.00 H new ATOM 0 HB2 SER S 488 0.258 -6.740 6.734 1.00 0.00 H new ATOM 0 HB3 SER S 488 -0.014 -5.071 7.191 1.00 0.00 H new ATOM 0 HG SER S 488 -0.376 -6.533 8.953 1.00 0.00 H new ATOM 535 N LYS S 489 -3.014 -4.280 7.025 1.00 0.00 N ATOM 536 CA LYS S 489 -3.619 -2.971 7.229 1.00 0.00 C ATOM 537 C LYS S 489 -2.610 -2.072 7.931 1.00 0.00 C ATOM 538 O LYS S 489 -2.049 -2.450 8.960 1.00 0.00 O ATOM 539 CB LYS S 489 -4.895 -3.089 8.064 1.00 0.00 C ATOM 540 CG LYS S 489 -5.920 -2.008 7.765 1.00 0.00 C ATOM 541 CD LYS S 489 -7.026 -1.984 8.808 1.00 0.00 C ATOM 542 CE LYS S 489 -6.775 -0.917 9.861 1.00 0.00 C ATOM 543 NZ LYS S 489 -5.373 -0.950 10.363 1.00 0.00 N ATOM 0 H LYS S 489 -3.295 -4.986 7.705 1.00 0.00 H new ATOM 0 HA LYS S 489 -3.890 -2.542 6.264 1.00 0.00 H new ATOM 0 HB2 LYS S 489 -5.346 -4.065 7.886 1.00 0.00 H new ATOM 0 HB3 LYS S 489 -4.633 -3.047 9.121 1.00 0.00 H new ATOM 0 HG2 LYS S 489 -5.427 -1.036 7.734 1.00 0.00 H new ATOM 0 HG3 LYS S 489 -6.352 -2.178 6.779 1.00 0.00 H new ATOM 0 HD2 LYS S 489 -7.983 -1.798 8.321 1.00 0.00 H new ATOM 0 HD3 LYS S 489 -7.097 -2.960 9.287 1.00 0.00 H new ATOM 0 HE2 LYS S 489 -6.986 0.066 9.439 1.00 0.00 H new ATOM 0 HE3 LYS S 489 -7.462 -1.061 10.695 1.00 0.00 H new ATOM 0 HZ1 LYS S 489 -5.266 -0.265 11.138 1.00 0.00 H new ATOM 0 HZ2 LYS S 489 -5.151 -1.905 10.711 1.00 0.00 H new ATOM 0 HZ3 LYS S 489 -4.722 -0.704 9.590 1.00 0.00 H new ATOM 557 N VAL S 490 -2.347 -0.902 7.363 1.00 0.00 N ATOM 558 CA VAL S 490 -1.361 0.002 7.950 1.00 0.00 C ATOM 559 C VAL S 490 -2.002 1.163 8.715 1.00 0.00 C ATOM 560 O VAL S 490 -1.433 1.643 9.696 1.00 0.00 O ATOM 561 CB VAL S 490 -0.378 0.529 6.879 1.00 0.00 C ATOM 562 CG1 VAL S 490 0.562 1.576 7.459 1.00 0.00 C ATOM 563 CG2 VAL S 490 0.424 -0.627 6.291 1.00 0.00 C ATOM 0 H VAL S 490 -2.792 -0.559 6.512 1.00 0.00 H new ATOM 0 HA VAL S 490 -0.801 -0.585 8.677 1.00 0.00 H new ATOM 0 HB VAL S 490 -0.961 1.001 6.089 1.00 0.00 H new ATOM 0 HG11 VAL S 490 1.240 1.927 6.681 1.00 0.00 H new ATOM 0 HG12 VAL S 490 -0.019 2.416 7.839 1.00 0.00 H new ATOM 0 HG13 VAL S 490 1.139 1.136 8.272 1.00 0.00 H new ATOM 0 HG21 VAL S 490 1.113 -0.246 5.538 1.00 0.00 H new ATOM 0 HG22 VAL S 490 0.988 -1.119 7.084 1.00 0.00 H new ATOM 0 HG23 VAL S 490 -0.256 -1.344 5.831 1.00 0.00 H new ATOM 573 N ASN S 491 -3.179 1.615 8.290 1.00 0.00 N ATOM 574 CA ASN S 491 -3.847 2.713 8.989 1.00 0.00 C ATOM 575 C ASN S 491 -5.241 2.984 8.413 1.00 0.00 C ATOM 576 O ASN S 491 -5.710 4.122 8.413 1.00 0.00 O ATOM 577 CB ASN S 491 -2.976 3.980 8.942 1.00 0.00 C ATOM 578 CG ASN S 491 -3.257 4.869 7.743 1.00 0.00 C ATOM 579 OD1 ASN S 491 -3.752 4.411 6.716 1.00 0.00 O ATOM 580 ND2 ASN S 491 -2.947 6.154 7.875 1.00 0.00 N ATOM 0 H ASN S 491 -3.683 1.248 7.482 1.00 0.00 H new ATOM 0 HA ASN S 491 -3.980 2.419 10.030 1.00 0.00 H new ATOM 0 HB2 ASN S 491 -3.136 4.554 9.855 1.00 0.00 H new ATOM 0 HB3 ASN S 491 -1.926 3.688 8.929 1.00 0.00 H new ATOM 0 HD21 ASN S 491 -3.119 6.802 7.106 1.00 0.00 H new ATOM 0 HD22 ASN S 491 -2.537 6.493 8.745 1.00 0.00 H new ATOM 587 N GLU S 492 -5.901 1.933 7.930 1.00 0.00 N ATOM 588 CA GLU S 492 -7.241 2.064 7.356 1.00 0.00 C ATOM 589 C GLU S 492 -7.181 2.693 5.965 1.00 0.00 C ATOM 590 O GLU S 492 -7.625 2.097 4.985 1.00 0.00 O ATOM 591 CB GLU S 492 -8.143 2.898 8.270 1.00 0.00 C ATOM 592 CG GLU S 492 -9.583 2.414 8.312 1.00 0.00 C ATOM 593 CD GLU S 492 -9.851 1.484 9.479 1.00 0.00 C ATOM 594 OE1 GLU S 492 -9.537 1.865 10.627 1.00 0.00 O ATOM 595 OE2 GLU S 492 -10.373 0.375 9.246 1.00 0.00 O ATOM 0 H GLU S 492 -5.531 0.982 7.924 1.00 0.00 H new ATOM 0 HA GLU S 492 -7.663 1.063 7.265 1.00 0.00 H new ATOM 0 HB2 GLU S 492 -7.734 2.884 9.280 1.00 0.00 H new ATOM 0 HB3 GLU S 492 -8.127 3.935 7.934 1.00 0.00 H new ATOM 0 HG2 GLU S 492 -10.250 3.274 8.377 1.00 0.00 H new ATOM 0 HG3 GLU S 492 -9.817 1.899 7.380 1.00 0.00 H new ATOM 602 N GLU S 493 -6.623 3.899 5.887 1.00 0.00 N ATOM 603 CA GLU S 493 -6.497 4.602 4.612 1.00 0.00 C ATOM 604 C GLU S 493 -5.137 4.328 3.973 1.00 0.00 C ATOM 605 O GLU S 493 -4.739 5.001 3.023 1.00 0.00 O ATOM 606 CB GLU S 493 -6.686 6.107 4.816 1.00 0.00 C ATOM 607 CG GLU S 493 -8.078 6.488 5.288 1.00 0.00 C ATOM 608 CD GLU S 493 -9.043 6.708 4.140 1.00 0.00 C ATOM 609 OE1 GLU S 493 -8.789 7.611 3.315 1.00 0.00 O ATOM 610 OE2 GLU S 493 -10.053 5.976 4.064 1.00 0.00 O ATOM 0 H GLU S 493 -6.252 4.409 6.689 1.00 0.00 H new ATOM 0 HA GLU S 493 -7.274 4.234 3.942 1.00 0.00 H new ATOM 0 HB2 GLU S 493 -5.956 6.461 5.544 1.00 0.00 H new ATOM 0 HB3 GLU S 493 -6.476 6.621 3.878 1.00 0.00 H new ATOM 0 HG2 GLU S 493 -8.465 5.703 5.938 1.00 0.00 H new ATOM 0 HG3 GLU S 493 -8.018 7.397 5.887 1.00 0.00 H new ATOM 617 N TRP S 494 -4.443 3.324 4.499 1.00 0.00 N ATOM 618 CA TRP S 494 -3.131 2.923 4.003 1.00 0.00 C ATOM 619 C TRP S 494 -2.804 1.530 4.509 1.00 0.00 C ATOM 620 O TRP S 494 -3.168 1.164 5.627 1.00 0.00 O ATOM 621 CB TRP S 494 -2.034 3.894 4.456 1.00 0.00 C ATOM 622 CG TRP S 494 -2.150 5.266 3.868 1.00 0.00 C ATOM 623 CD1 TRP S 494 -2.889 6.304 4.354 1.00 0.00 C ATOM 624 CD2 TRP S 494 -1.494 5.760 2.694 1.00 0.00 C ATOM 625 NE1 TRP S 494 -2.740 7.407 3.553 1.00 0.00 N ATOM 626 CE2 TRP S 494 -1.893 7.098 2.527 1.00 0.00 C ATOM 627 CE3 TRP S 494 -0.609 5.203 1.763 1.00 0.00 C ATOM 628 CZ2 TRP S 494 -1.444 7.887 1.477 1.00 0.00 C ATOM 629 CZ3 TRP S 494 -0.160 5.991 0.718 1.00 0.00 C ATOM 630 CH2 TRP S 494 -0.579 7.320 0.583 1.00 0.00 C ATOM 0 H TRP S 494 -4.776 2.764 5.284 1.00 0.00 H new ATOM 0 HA TRP S 494 -3.166 2.934 2.914 1.00 0.00 H new ATOM 0 HB2 TRP S 494 -2.060 3.973 5.543 1.00 0.00 H new ATOM 0 HB3 TRP S 494 -1.063 3.477 4.190 1.00 0.00 H new ATOM 0 HD1 TRP S 494 -3.503 6.263 5.242 1.00 0.00 H new ATOM 0 HE1 TRP S 494 -3.189 8.311 3.700 1.00 0.00 H new ATOM 0 HE3 TRP S 494 -0.283 4.178 1.859 1.00 0.00 H new ATOM 0 HZ2 TRP S 494 -1.766 8.912 1.370 1.00 0.00 H new ATOM 0 HZ3 TRP S 494 0.525 5.574 -0.005 1.00 0.00 H new ATOM 0 HH2 TRP S 494 -0.211 7.909 -0.244 1.00 0.00 H new ATOM 641 N LEU S 495 -2.122 0.753 3.688 1.00 0.00 N ATOM 642 CA LEU S 495 -1.757 -0.599 4.064 1.00 0.00 C ATOM 643 C LEU S 495 -0.445 -1.018 3.430 1.00 0.00 C ATOM 644 O LEU S 495 0.159 -0.265 2.667 1.00 0.00 O ATOM 645 CB LEU S 495 -2.867 -1.580 3.696 1.00 0.00 C ATOM 646 CG LEU S 495 -3.730 -1.182 2.501 1.00 0.00 C ATOM 647 CD1 LEU S 495 -3.199 -1.801 1.215 1.00 0.00 C ATOM 648 CD2 LEU S 495 -5.167 -1.597 2.754 1.00 0.00 C ATOM 0 H LEU S 495 -1.810 1.035 2.758 1.00 0.00 H new ATOM 0 HA LEU S 495 -1.623 -0.615 5.146 1.00 0.00 H new ATOM 0 HB2 LEU S 495 -2.416 -2.550 3.488 1.00 0.00 H new ATOM 0 HB3 LEU S 495 -3.515 -1.709 4.563 1.00 0.00 H new ATOM 0 HG LEU S 495 -3.692 -0.099 2.380 1.00 0.00 H new ATOM 0 HD11 LEU S 495 -3.831 -1.502 0.379 1.00 0.00 H new ATOM 0 HD12 LEU S 495 -2.180 -1.457 1.040 1.00 0.00 H new ATOM 0 HD13 LEU S 495 -3.205 -2.887 1.304 1.00 0.00 H new ATOM 0 HD21 LEU S 495 -5.783 -1.313 1.901 1.00 0.00 H new ATOM 0 HD22 LEU S 495 -5.215 -2.677 2.893 1.00 0.00 H new ATOM 0 HD23 LEU S 495 -5.537 -1.100 3.651 1.00 0.00 H new ATOM 660 N GLU S 496 -0.007 -2.226 3.755 1.00 0.00 N ATOM 661 CA GLU S 496 1.239 -2.743 3.221 1.00 0.00 C ATOM 662 C GLU S 496 1.030 -3.242 1.806 1.00 0.00 C ATOM 663 O GLU S 496 0.195 -4.111 1.554 1.00 0.00 O ATOM 664 CB GLU S 496 1.779 -3.861 4.112 1.00 0.00 C ATOM 665 CG GLU S 496 3.191 -4.298 3.754 1.00 0.00 C ATOM 666 CD GLU S 496 3.695 -5.424 4.636 1.00 0.00 C ATOM 667 OE1 GLU S 496 3.057 -5.697 5.675 1.00 0.00 O ATOM 668 OE2 GLU S 496 4.727 -6.035 4.286 1.00 0.00 O ATOM 0 H GLU S 496 -0.496 -2.863 4.384 1.00 0.00 H new ATOM 0 HA GLU S 496 1.974 -1.938 3.202 1.00 0.00 H new ATOM 0 HB2 GLU S 496 1.763 -3.527 5.149 1.00 0.00 H new ATOM 0 HB3 GLU S 496 1.113 -4.721 4.044 1.00 0.00 H new ATOM 0 HG2 GLU S 496 3.215 -4.619 2.713 1.00 0.00 H new ATOM 0 HG3 GLU S 496 3.864 -3.445 3.840 1.00 0.00 H new ATOM 675 N GLY S 497 1.776 -2.659 0.879 1.00 0.00 N ATOM 676 CA GLY S 497 1.641 -3.026 -0.508 1.00 0.00 C ATOM 677 C GLY S 497 2.832 -3.782 -1.062 1.00 0.00 C ATOM 678 O GLY S 497 3.915 -3.224 -1.221 1.00 0.00 O ATOM 0 H GLY S 497 2.472 -1.938 1.067 1.00 0.00 H new ATOM 0 HA2 GLY S 497 0.747 -3.639 -0.626 1.00 0.00 H new ATOM 0 HA3 GLY S 497 1.489 -2.123 -1.099 1.00 0.00 H new ATOM 682 N GLU S 498 2.616 -5.054 -1.382 1.00 0.00 N ATOM 683 CA GLU S 498 3.661 -5.897 -1.952 1.00 0.00 C ATOM 684 C GLU S 498 3.152 -6.523 -3.245 1.00 0.00 C ATOM 685 O GLU S 498 2.586 -7.614 -3.238 1.00 0.00 O ATOM 686 CB GLU S 498 4.075 -6.987 -0.962 1.00 0.00 C ATOM 687 CG GLU S 498 5.314 -7.757 -1.390 1.00 0.00 C ATOM 688 CD GLU S 498 5.651 -8.892 -0.444 1.00 0.00 C ATOM 689 OE1 GLU S 498 4.798 -9.786 -0.263 1.00 0.00 O ATOM 690 OE2 GLU S 498 6.767 -8.888 0.116 1.00 0.00 O ATOM 0 H GLU S 498 1.721 -5.526 -1.255 1.00 0.00 H new ATOM 0 HA GLU S 498 4.537 -5.284 -2.165 1.00 0.00 H new ATOM 0 HB2 GLU S 498 4.258 -6.532 0.011 1.00 0.00 H new ATOM 0 HB3 GLU S 498 3.248 -7.686 -0.837 1.00 0.00 H new ATOM 0 HG2 GLU S 498 5.160 -8.158 -2.392 1.00 0.00 H new ATOM 0 HG3 GLU S 498 6.161 -7.073 -1.447 1.00 0.00 H new ATOM 697 N SER S 499 3.334 -5.812 -4.352 1.00 0.00 N ATOM 698 CA SER S 499 2.864 -6.289 -5.646 1.00 0.00 C ATOM 699 C SER S 499 3.925 -7.144 -6.351 1.00 0.00 C ATOM 700 O SER S 499 4.628 -7.920 -5.703 1.00 0.00 O ATOM 701 CB SER S 499 2.437 -5.099 -6.518 1.00 0.00 C ATOM 702 OG SER S 499 1.951 -5.532 -7.777 1.00 0.00 O ATOM 0 H SER S 499 3.802 -4.906 -4.379 1.00 0.00 H new ATOM 0 HA SER S 499 1.998 -6.930 -5.482 1.00 0.00 H new ATOM 0 HB2 SER S 499 1.664 -4.528 -6.004 1.00 0.00 H new ATOM 0 HB3 SER S 499 3.285 -4.429 -6.664 1.00 0.00 H new ATOM 0 HG SER S 499 1.685 -4.754 -8.310 1.00 0.00 H new ATOM 708 N LYS S 500 4.020 -7.015 -7.677 1.00 0.00 N ATOM 709 CA LYS S 500 4.976 -7.786 -8.477 1.00 0.00 C ATOM 710 C LYS S 500 6.310 -7.980 -7.754 1.00 0.00 C ATOM 711 O LYS S 500 6.518 -8.991 -7.082 1.00 0.00 O ATOM 712 CB LYS S 500 5.202 -7.105 -9.828 1.00 0.00 C ATOM 713 CG LYS S 500 4.180 -7.490 -10.883 1.00 0.00 C ATOM 714 CD LYS S 500 4.586 -6.994 -12.261 1.00 0.00 C ATOM 715 CE LYS S 500 4.232 -5.528 -12.452 1.00 0.00 C ATOM 716 NZ LYS S 500 4.567 -5.049 -13.822 1.00 0.00 N ATOM 0 H LYS S 500 3.441 -6.378 -8.224 1.00 0.00 H new ATOM 0 HA LYS S 500 4.546 -8.775 -8.635 1.00 0.00 H new ATOM 0 HB2 LYS S 500 5.178 -6.024 -9.689 1.00 0.00 H new ATOM 0 HB3 LYS S 500 6.198 -7.358 -10.190 1.00 0.00 H new ATOM 0 HG2 LYS S 500 4.068 -8.574 -10.904 1.00 0.00 H new ATOM 0 HG3 LYS S 500 3.208 -7.074 -10.618 1.00 0.00 H new ATOM 0 HD2 LYS S 500 5.659 -7.131 -12.397 1.00 0.00 H new ATOM 0 HD3 LYS S 500 4.089 -7.592 -13.025 1.00 0.00 H new ATOM 0 HE2 LYS S 500 3.167 -5.385 -12.268 1.00 0.00 H new ATOM 0 HE3 LYS S 500 4.766 -4.927 -11.717 1.00 0.00 H new ATOM 0 HZ1 LYS S 500 4.310 -4.045 -13.911 1.00 0.00 H new ATOM 0 HZ2 LYS S 500 5.587 -5.162 -13.989 1.00 0.00 H new ATOM 0 HZ3 LYS S 500 4.038 -5.605 -14.523 1.00 0.00 H new ATOM 730 N GLY S 501 7.215 -7.015 -7.898 1.00 0.00 N ATOM 731 CA GLY S 501 8.510 -7.118 -7.254 1.00 0.00 C ATOM 732 C GLY S 501 8.919 -5.839 -6.556 1.00 0.00 C ATOM 733 O GLY S 501 10.002 -5.309 -6.803 1.00 0.00 O ATOM 0 H GLY S 501 7.074 -6.167 -8.447 1.00 0.00 H new ATOM 0 HA2 GLY S 501 8.487 -7.931 -6.529 1.00 0.00 H new ATOM 0 HA3 GLY S 501 9.262 -7.377 -7.999 1.00 0.00 H new ATOM 737 N LYS S 502 8.054 -5.342 -5.680 1.00 0.00 N ATOM 738 CA LYS S 502 8.334 -4.121 -4.941 1.00 0.00 C ATOM 739 C LYS S 502 7.466 -4.033 -3.697 1.00 0.00 C ATOM 740 O LYS S 502 6.240 -4.109 -3.774 1.00 0.00 O ATOM 741 CB LYS S 502 8.109 -2.893 -5.825 1.00 0.00 C ATOM 742 CG LYS S 502 9.353 -2.459 -6.580 1.00 0.00 C ATOM 743 CD LYS S 502 9.133 -2.481 -8.085 1.00 0.00 C ATOM 744 CE LYS S 502 10.449 -2.568 -8.840 1.00 0.00 C ATOM 745 NZ LYS S 502 11.054 -3.924 -8.750 1.00 0.00 N ATOM 0 H LYS S 502 7.152 -5.768 -5.465 1.00 0.00 H new ATOM 0 HA LYS S 502 9.380 -4.145 -4.634 1.00 0.00 H new ATOM 0 HB2 LYS S 502 7.316 -3.110 -6.540 1.00 0.00 H new ATOM 0 HB3 LYS S 502 7.762 -2.066 -5.205 1.00 0.00 H new ATOM 0 HG2 LYS S 502 9.636 -1.454 -6.268 1.00 0.00 H new ATOM 0 HG3 LYS S 502 10.183 -3.118 -6.324 1.00 0.00 H new ATOM 0 HD2 LYS S 502 8.504 -3.331 -8.349 1.00 0.00 H new ATOM 0 HD3 LYS S 502 8.597 -1.582 -8.388 1.00 0.00 H new ATOM 0 HE2 LYS S 502 10.284 -2.313 -9.887 1.00 0.00 H new ATOM 0 HE3 LYS S 502 11.146 -1.832 -8.439 1.00 0.00 H new ATOM 0 HZ1 LYS S 502 12.085 -3.838 -8.646 1.00 0.00 H new ATOM 0 HZ2 LYS S 502 10.664 -4.424 -7.926 1.00 0.00 H new ATOM 0 HZ3 LYS S 502 10.837 -4.459 -9.615 1.00 0.00 H new ATOM 759 N VAL S 503 8.109 -3.871 -2.549 1.00 0.00 N ATOM 760 CA VAL S 503 7.391 -3.775 -1.288 1.00 0.00 C ATOM 761 C VAL S 503 7.268 -2.323 -0.841 1.00 0.00 C ATOM 762 O VAL S 503 8.265 -1.649 -0.580 1.00 0.00 O ATOM 763 CB VAL S 503 8.076 -4.587 -0.171 1.00 0.00 C ATOM 764 CG1 VAL S 503 7.135 -4.776 1.009 1.00 0.00 C ATOM 765 CG2 VAL S 503 8.556 -5.933 -0.696 1.00 0.00 C ATOM 0 H VAL S 503 9.123 -3.804 -2.466 1.00 0.00 H new ATOM 0 HA VAL S 503 6.399 -4.191 -1.462 1.00 0.00 H new ATOM 0 HB VAL S 503 8.946 -4.027 0.171 1.00 0.00 H new ATOM 0 HG11 VAL S 503 7.637 -5.352 1.786 1.00 0.00 H new ATOM 0 HG12 VAL S 503 6.849 -3.802 1.406 1.00 0.00 H new ATOM 0 HG13 VAL S 503 6.243 -5.310 0.681 1.00 0.00 H new ATOM 0 HG21 VAL S 503 9.036 -6.488 0.110 1.00 0.00 H new ATOM 0 HG22 VAL S 503 7.705 -6.502 -1.071 1.00 0.00 H new ATOM 0 HG23 VAL S 503 9.271 -5.775 -1.503 1.00 0.00 H new ATOM 775 N GLY S 504 6.033 -1.859 -0.748 1.00 0.00 N ATOM 776 CA GLY S 504 5.760 -0.502 -0.327 1.00 0.00 C ATOM 777 C GLY S 504 4.417 -0.414 0.361 1.00 0.00 C ATOM 778 O GLY S 504 3.967 -1.392 0.951 1.00 0.00 O ATOM 0 H GLY S 504 5.201 -2.409 -0.961 1.00 0.00 H new ATOM 0 HA2 GLY S 504 6.544 -0.162 0.350 1.00 0.00 H new ATOM 0 HA3 GLY S 504 5.775 0.162 -1.191 1.00 0.00 H new ATOM 782 N ILE S 505 3.769 0.740 0.282 1.00 0.00 N ATOM 783 CA ILE S 505 2.464 0.908 0.905 1.00 0.00 C ATOM 784 C ILE S 505 1.581 1.857 0.122 1.00 0.00 C ATOM 785 O ILE S 505 2.065 2.735 -0.589 1.00 0.00 O ATOM 786 CB ILE S 505 2.578 1.404 2.352 1.00 0.00 C ATOM 787 CG1 ILE S 505 3.640 2.501 2.472 1.00 0.00 C ATOM 788 CG2 ILE S 505 2.898 0.234 3.258 1.00 0.00 C ATOM 789 CD1 ILE S 505 3.203 3.668 3.332 1.00 0.00 C ATOM 0 H ILE S 505 4.121 1.566 -0.202 1.00 0.00 H new ATOM 0 HA ILE S 505 2.005 -0.081 0.907 1.00 0.00 H new ATOM 0 HB ILE S 505 1.626 1.839 2.657 1.00 0.00 H new ATOM 0 HG12 ILE S 505 4.550 2.071 2.891 1.00 0.00 H new ATOM 0 HG13 ILE S 505 3.889 2.866 1.476 1.00 0.00 H new ATOM 0 HG21 ILE S 505 2.980 0.583 4.287 1.00 0.00 H new ATOM 0 HG22 ILE S 505 2.103 -0.508 3.188 1.00 0.00 H new ATOM 0 HG23 ILE S 505 3.842 -0.216 2.951 1.00 0.00 H new ATOM 0 HD11 ILE S 505 4.002 4.408 3.374 1.00 0.00 H new ATOM 0 HD12 ILE S 505 2.310 4.122 2.902 1.00 0.00 H new ATOM 0 HD13 ILE S 505 2.982 3.315 4.339 1.00 0.00 H new ATOM 801 N PHE S 506 0.278 1.665 0.252 1.00 0.00 N ATOM 802 CA PHE S 506 -0.680 2.501 -0.463 1.00 0.00 C ATOM 803 C PHE S 506 -2.013 2.583 0.272 1.00 0.00 C ATOM 804 O PHE S 506 -2.288 1.788 1.170 1.00 0.00 O ATOM 805 CB PHE S 506 -0.901 1.938 -1.865 1.00 0.00 C ATOM 806 CG PHE S 506 -1.537 0.578 -1.862 1.00 0.00 C ATOM 807 CD1 PHE S 506 -0.836 -0.526 -1.408 1.00 0.00 C ATOM 808 CD2 PHE S 506 -2.837 0.407 -2.307 1.00 0.00 C ATOM 809 CE1 PHE S 506 -1.419 -1.779 -1.399 1.00 0.00 C ATOM 810 CE2 PHE S 506 -3.425 -0.843 -2.300 1.00 0.00 C ATOM 811 CZ PHE S 506 -2.715 -1.936 -1.847 1.00 0.00 C ATOM 0 H PHE S 506 -0.141 0.944 0.840 1.00 0.00 H new ATOM 0 HA PHE S 506 -0.269 3.509 -0.524 1.00 0.00 H new ATOM 0 HB2 PHE S 506 -1.530 2.625 -2.431 1.00 0.00 H new ATOM 0 HB3 PHE S 506 0.057 1.883 -2.383 1.00 0.00 H new ATOM 0 HD1 PHE S 506 0.178 -0.407 -1.057 1.00 0.00 H new ATOM 0 HD2 PHE S 506 -3.397 1.259 -2.663 1.00 0.00 H new ATOM 0 HE1 PHE S 506 -0.862 -2.633 -1.042 1.00 0.00 H new ATOM 0 HE2 PHE S 506 -4.440 -0.965 -2.649 1.00 0.00 H new ATOM 0 HZ PHE S 506 -3.173 -2.914 -1.843 1.00 0.00 H new ATOM 821 N PRO S 507 -2.866 3.549 -0.111 1.00 0.00 N ATOM 822 CA PRO S 507 -4.173 3.732 0.500 1.00 0.00 C ATOM 823 C PRO S 507 -5.235 2.841 -0.135 1.00 0.00 C ATOM 824 O PRO S 507 -5.536 2.958 -1.322 1.00 0.00 O ATOM 825 CB PRO S 507 -4.459 5.207 0.241 1.00 0.00 C ATOM 826 CG PRO S 507 -3.776 5.507 -1.052 1.00 0.00 C ATOM 827 CD PRO S 507 -2.621 4.539 -1.177 1.00 0.00 C ATOM 0 HA PRO S 507 -4.188 3.462 1.556 1.00 0.00 H new ATOM 0 HB2 PRO S 507 -5.530 5.397 0.176 1.00 0.00 H new ATOM 0 HB3 PRO S 507 -4.073 5.832 1.046 1.00 0.00 H new ATOM 0 HG2 PRO S 507 -4.466 5.394 -1.888 1.00 0.00 H new ATOM 0 HG3 PRO S 507 -3.420 6.537 -1.070 1.00 0.00 H new ATOM 0 HD2 PRO S 507 -2.599 4.069 -2.160 1.00 0.00 H new ATOM 0 HD3 PRO S 507 -1.663 5.041 -1.042 1.00 0.00 H new ATOM 835 N LYS S 508 -5.787 1.944 0.674 1.00 0.00 N ATOM 836 CA LYS S 508 -6.810 1.004 0.230 1.00 0.00 C ATOM 837 C LYS S 508 -7.882 1.671 -0.633 1.00 0.00 C ATOM 838 O LYS S 508 -8.533 1.006 -1.438 1.00 0.00 O ATOM 839 CB LYS S 508 -7.456 0.354 1.452 1.00 0.00 C ATOM 840 CG LYS S 508 -7.979 -1.047 1.193 1.00 0.00 C ATOM 841 CD LYS S 508 -9.461 -1.038 0.861 1.00 0.00 C ATOM 842 CE LYS S 508 -10.304 -0.714 2.083 1.00 0.00 C ATOM 843 NZ LYS S 508 -10.684 -1.940 2.838 1.00 0.00 N ATOM 0 H LYS S 508 -5.537 1.848 1.658 1.00 0.00 H new ATOM 0 HA LYS S 508 -6.324 0.251 -0.391 1.00 0.00 H new ATOM 0 HB2 LYS S 508 -6.726 0.316 2.261 1.00 0.00 H new ATOM 0 HB3 LYS S 508 -8.279 0.982 1.794 1.00 0.00 H new ATOM 0 HG2 LYS S 508 -7.424 -1.497 0.370 1.00 0.00 H new ATOM 0 HG3 LYS S 508 -7.806 -1.669 2.071 1.00 0.00 H new ATOM 0 HD2 LYS S 508 -9.655 -0.304 0.079 1.00 0.00 H new ATOM 0 HD3 LYS S 508 -9.752 -2.011 0.465 1.00 0.00 H new ATOM 0 HE2 LYS S 508 -9.750 -0.042 2.738 1.00 0.00 H new ATOM 0 HE3 LYS S 508 -11.205 -0.185 1.772 1.00 0.00 H new ATOM 0 HZ1 LYS S 508 -11.258 -1.675 3.664 1.00 0.00 H new ATOM 0 HZ2 LYS S 508 -11.235 -2.571 2.221 1.00 0.00 H new ATOM 0 HZ3 LYS S 508 -9.825 -2.431 3.157 1.00 0.00 H new ATOM 857 N VAL S 509 -8.071 2.976 -0.466 1.00 0.00 N ATOM 858 CA VAL S 509 -9.073 3.701 -1.244 1.00 0.00 C ATOM 859 C VAL S 509 -8.927 3.411 -2.740 1.00 0.00 C ATOM 860 O VAL S 509 -9.894 3.503 -3.496 1.00 0.00 O ATOM 861 CB VAL S 509 -8.987 5.224 -0.999 1.00 0.00 C ATOM 862 CG1 VAL S 509 -7.551 5.710 -1.122 1.00 0.00 C ATOM 863 CG2 VAL S 509 -9.893 5.983 -1.958 1.00 0.00 C ATOM 0 H VAL S 509 -7.549 3.551 0.195 1.00 0.00 H new ATOM 0 HA VAL S 509 -10.050 3.351 -0.910 1.00 0.00 H new ATOM 0 HB VAL S 509 -9.330 5.420 0.017 1.00 0.00 H new ATOM 0 HG11 VAL S 509 -7.514 6.785 -0.946 1.00 0.00 H new ATOM 0 HG12 VAL S 509 -6.930 5.200 -0.386 1.00 0.00 H new ATOM 0 HG13 VAL S 509 -7.178 5.494 -2.123 1.00 0.00 H new ATOM 0 HG21 VAL S 509 -9.813 7.053 -1.764 1.00 0.00 H new ATOM 0 HG22 VAL S 509 -9.590 5.777 -2.985 1.00 0.00 H new ATOM 0 HG23 VAL S 509 -10.925 5.664 -1.813 1.00 0.00 H new ATOM 873 N PHE S 510 -7.715 3.054 -3.160 1.00 0.00 N ATOM 874 CA PHE S 510 -7.450 2.744 -4.563 1.00 0.00 C ATOM 875 C PHE S 510 -7.607 1.252 -4.837 1.00 0.00 C ATOM 876 O PHE S 510 -7.154 0.755 -5.866 1.00 0.00 O ATOM 877 CB PHE S 510 -6.035 3.180 -4.944 1.00 0.00 C ATOM 878 CG PHE S 510 -5.871 4.665 -5.003 1.00 0.00 C ATOM 879 CD1 PHE S 510 -5.932 5.422 -3.850 1.00 0.00 C ATOM 880 CD2 PHE S 510 -5.666 5.304 -6.212 1.00 0.00 C ATOM 881 CE1 PHE S 510 -5.799 6.793 -3.898 1.00 0.00 C ATOM 882 CE2 PHE S 510 -5.526 6.676 -6.269 1.00 0.00 C ATOM 883 CZ PHE S 510 -5.597 7.422 -5.108 1.00 0.00 C ATOM 0 H PHE S 510 -6.902 2.972 -2.550 1.00 0.00 H new ATOM 0 HA PHE S 510 -8.177 3.289 -5.165 1.00 0.00 H new ATOM 0 HB2 PHE S 510 -5.329 2.772 -4.221 1.00 0.00 H new ATOM 0 HB3 PHE S 510 -5.780 2.754 -5.914 1.00 0.00 H new ATOM 0 HD1 PHE S 510 -6.086 4.934 -2.899 1.00 0.00 H new ATOM 0 HD2 PHE S 510 -5.615 4.723 -7.121 1.00 0.00 H new ATOM 0 HE1 PHE S 510 -5.853 7.374 -2.989 1.00 0.00 H new ATOM 0 HE2 PHE S 510 -5.362 7.165 -7.218 1.00 0.00 H new ATOM 0 HZ PHE S 510 -5.494 8.496 -5.148 1.00 0.00 H new ATOM 893 N VAL S 511 -8.236 0.542 -3.909 1.00 0.00 N ATOM 894 CA VAL S 511 -8.431 -0.894 -4.050 1.00 0.00 C ATOM 895 C VAL S 511 -9.605 -1.374 -3.197 1.00 0.00 C ATOM 896 O VAL S 511 -9.454 -2.251 -2.347 1.00 0.00 O ATOM 897 CB VAL S 511 -7.162 -1.657 -3.626 1.00 0.00 C ATOM 898 CG1 VAL S 511 -5.990 -1.316 -4.523 1.00 0.00 C ATOM 899 CG2 VAL S 511 -6.812 -1.334 -2.193 1.00 0.00 C ATOM 0 H VAL S 511 -8.620 0.938 -3.051 1.00 0.00 H new ATOM 0 HA VAL S 511 -8.645 -1.094 -5.100 1.00 0.00 H new ATOM 0 HB VAL S 511 -7.369 -2.723 -3.719 1.00 0.00 H new ATOM 0 HG11 VAL S 511 -5.110 -1.870 -4.198 1.00 0.00 H new ATOM 0 HG12 VAL S 511 -6.229 -1.585 -5.552 1.00 0.00 H new ATOM 0 HG13 VAL S 511 -5.787 -0.247 -4.466 1.00 0.00 H new ATOM 0 HG21 VAL S 511 -5.913 -1.880 -1.906 1.00 0.00 H new ATOM 0 HG22 VAL S 511 -6.633 -0.263 -2.095 1.00 0.00 H new ATOM 0 HG23 VAL S 511 -7.637 -1.625 -1.542 1.00 0.00 H new ATOM 909 N GLU S 512 -10.773 -0.791 -3.424 1.00 0.00 N ATOM 910 CA GLU S 512 -11.966 -1.159 -2.668 1.00 0.00 C ATOM 911 C GLU S 512 -12.673 -2.366 -3.280 1.00 0.00 C ATOM 912 O GLU S 512 -13.834 -2.633 -2.971 1.00 0.00 O ATOM 913 CB GLU S 512 -12.929 0.022 -2.613 1.00 0.00 C ATOM 914 CG GLU S 512 -13.451 0.422 -3.982 1.00 0.00 C ATOM 915 CD GLU S 512 -14.351 1.642 -3.932 1.00 0.00 C ATOM 916 OE1 GLU S 512 -15.195 1.719 -3.015 1.00 0.00 O ATOM 917 OE2 GLU S 512 -14.210 2.519 -4.809 1.00 0.00 O ATOM 0 H GLU S 512 -10.922 -0.063 -4.123 1.00 0.00 H new ATOM 0 HA GLU S 512 -11.650 -1.429 -1.660 1.00 0.00 H new ATOM 0 HB2 GLU S 512 -13.771 -0.231 -1.968 1.00 0.00 H new ATOM 0 HB3 GLU S 512 -12.425 0.875 -2.158 1.00 0.00 H new ATOM 0 HG2 GLU S 512 -12.608 0.624 -4.643 1.00 0.00 H new ATOM 0 HG3 GLU S 512 -14.002 -0.413 -4.415 1.00 0.00 H new ATOM 986 N LYS P 360 -11.520 8.110 -15.201 1.00 0.00 N ATOM 987 CA LYS P 360 -12.052 8.330 -13.861 1.00 0.00 C ATOM 988 C LYS P 360 -11.093 9.166 -13.021 1.00 0.00 C ATOM 989 O LYS P 360 -9.875 9.004 -13.102 1.00 0.00 O ATOM 990 CB LYS P 360 -12.317 6.993 -13.167 1.00 0.00 C ATOM 991 CG LYS P 360 -13.719 6.451 -13.396 1.00 0.00 C ATOM 992 CD LYS P 360 -14.284 5.820 -12.134 1.00 0.00 C ATOM 993 CE LYS P 360 -15.786 5.607 -12.240 1.00 0.00 C ATOM 994 NZ LYS P 360 -16.548 6.836 -11.885 1.00 0.00 N ATOM 0 HA LYS P 360 -12.991 8.875 -13.959 1.00 0.00 H new ATOM 0 HB2 LYS P 360 -11.592 6.260 -13.521 1.00 0.00 H new ATOM 0 HB3 LYS P 360 -12.154 7.111 -12.096 1.00 0.00 H new ATOM 0 HG2 LYS P 360 -14.373 7.258 -13.725 1.00 0.00 H new ATOM 0 HG3 LYS P 360 -13.698 5.711 -14.196 1.00 0.00 H new ATOM 0 HD2 LYS P 360 -13.792 4.864 -11.953 1.00 0.00 H new ATOM 0 HD3 LYS P 360 -14.066 6.458 -11.278 1.00 0.00 H new ATOM 0 HE2 LYS P 360 -16.039 5.304 -13.256 1.00 0.00 H new ATOM 0 HE3 LYS P 360 -16.084 4.792 -11.581 1.00 0.00 H new ATOM 0 HZ1 LYS P 360 -17.568 6.649 -11.970 1.00 0.00 H new ATOM 0 HZ2 LYS P 360 -16.327 7.111 -10.907 1.00 0.00 H new ATOM 0 HZ3 LYS P 360 -16.283 7.607 -12.530 1.00 0.00 H new ATOM 1008 N PRO P 361 -11.638 10.075 -12.199 1.00 0.00 N ATOM 1009 CA PRO P 361 -10.854 10.950 -11.333 1.00 0.00 C ATOM 1010 C PRO P 361 -10.455 10.251 -10.039 1.00 0.00 C ATOM 1011 O PRO P 361 -11.221 10.224 -9.075 1.00 0.00 O ATOM 1012 CB PRO P 361 -11.817 12.118 -11.044 1.00 0.00 C ATOM 1013 CG PRO P 361 -13.073 11.814 -11.806 1.00 0.00 C ATOM 1014 CD PRO P 361 -13.066 10.339 -12.039 1.00 0.00 C ATOM 0 HA PRO P 361 -9.917 11.263 -11.794 1.00 0.00 H new ATOM 0 HB2 PRO P 361 -12.019 12.203 -9.976 1.00 0.00 H new ATOM 0 HB3 PRO P 361 -11.387 13.067 -11.363 1.00 0.00 H new ATOM 0 HG2 PRO P 361 -13.955 12.116 -11.241 1.00 0.00 H new ATOM 0 HG3 PRO P 361 -13.098 12.358 -12.750 1.00 0.00 H new ATOM 0 HD2 PRO P 361 -13.493 9.789 -11.200 1.00 0.00 H new ATOM 0 HD3 PRO P 361 -13.636 10.061 -12.925 1.00 0.00 H new ATOM 1022 N GLN P 362 -9.258 9.673 -10.027 1.00 0.00 N ATOM 1023 CA GLN P 362 -8.762 8.958 -8.853 1.00 0.00 C ATOM 1024 C GLN P 362 -8.978 9.757 -7.576 1.00 0.00 C ATOM 1025 O GLN P 362 -9.051 10.986 -7.594 1.00 0.00 O ATOM 1026 CB GLN P 362 -7.268 8.649 -8.992 1.00 0.00 C ATOM 1027 CG GLN P 362 -6.402 9.890 -9.138 1.00 0.00 C ATOM 1028 CD GLN P 362 -6.318 10.378 -10.571 1.00 0.00 C ATOM 1029 OE1 GLN P 362 -5.979 9.619 -11.478 1.00 0.00 O ATOM 1030 NE2 GLN P 362 -6.626 11.653 -10.781 1.00 0.00 N ATOM 0 H GLN P 362 -8.612 9.685 -10.817 1.00 0.00 H new ATOM 0 HA GLN P 362 -9.327 8.028 -8.790 1.00 0.00 H new ATOM 0 HB2 GLN P 362 -6.939 8.087 -8.118 1.00 0.00 H new ATOM 0 HB3 GLN P 362 -7.117 8.007 -9.860 1.00 0.00 H new ATOM 0 HG2 GLN P 362 -6.805 10.685 -8.510 1.00 0.00 H new ATOM 0 HG3 GLN P 362 -5.398 9.673 -8.773 1.00 0.00 H new ATOM 0 HE21 GLN P 362 -6.902 12.246 -9.999 1.00 0.00 H new ATOM 0 HE22 GLN P 362 -6.586 12.039 -11.725 1.00 0.00 H new ATOM 1039 N PRO P 363 -9.072 9.050 -6.444 1.00 0.00 N ATOM 1040 CA PRO P 363 -9.267 9.675 -5.142 1.00 0.00 C ATOM 1041 C PRO P 363 -8.067 10.503 -4.716 1.00 0.00 C ATOM 1042 O PRO P 363 -6.969 9.973 -4.556 1.00 0.00 O ATOM 1043 CB PRO P 363 -9.440 8.499 -4.175 1.00 0.00 C ATOM 1044 CG PRO P 363 -9.041 7.263 -4.910 1.00 0.00 C ATOM 1045 CD PRO P 363 -8.986 7.585 -6.372 1.00 0.00 C ATOM 0 HA PRO P 363 -10.117 10.357 -5.161 1.00 0.00 H new ATOM 0 HB2 PRO P 363 -8.822 8.636 -3.288 1.00 0.00 H new ATOM 0 HB3 PRO P 363 -10.473 8.428 -3.836 1.00 0.00 H new ATOM 0 HG2 PRO P 363 -8.070 6.910 -4.562 1.00 0.00 H new ATOM 0 HG3 PRO P 363 -9.757 6.462 -4.724 1.00 0.00 H new ATOM 0 HD2 PRO P 363 -8.062 7.222 -6.821 1.00 0.00 H new ATOM 0 HD3 PRO P 363 -9.809 7.115 -6.911 1.00 0.00 H new ATOM 1053 N ALA P 364 -8.276 11.800 -4.500 1.00 0.00 N ATOM 1054 CA ALA P 364 -7.189 12.665 -4.057 1.00 0.00 C ATOM 1055 C ALA P 364 -6.500 12.020 -2.864 1.00 0.00 C ATOM 1056 O ALA P 364 -7.023 12.044 -1.749 1.00 0.00 O ATOM 1057 CB ALA P 364 -7.717 14.046 -3.695 1.00 0.00 C ATOM 0 H ALA P 364 -9.174 12.268 -4.623 1.00 0.00 H new ATOM 0 HA ALA P 364 -6.469 12.789 -4.866 1.00 0.00 H new ATOM 0 HB1 ALA P 364 -6.891 14.677 -3.367 1.00 0.00 H new ATOM 0 HB2 ALA P 364 -8.191 14.494 -4.568 1.00 0.00 H new ATOM 0 HB3 ALA P 364 -8.447 13.957 -2.891 1.00 0.00 H new ATOM 1063 N VAL P 365 -5.348 11.404 -3.105 1.00 0.00 N ATOM 1064 CA VAL P 365 -4.631 10.709 -2.042 1.00 0.00 C ATOM 1065 C VAL P 365 -4.490 11.594 -0.804 1.00 0.00 C ATOM 1066 O VAL P 365 -4.189 12.784 -0.905 1.00 0.00 O ATOM 1067 CB VAL P 365 -3.236 10.207 -2.477 1.00 0.00 C ATOM 1068 CG1 VAL P 365 -2.880 8.947 -1.712 1.00 0.00 C ATOM 1069 CG2 VAL P 365 -3.176 9.930 -3.969 1.00 0.00 C ATOM 0 H VAL P 365 -4.894 11.371 -4.018 1.00 0.00 H new ATOM 0 HA VAL P 365 -5.234 9.833 -1.802 1.00 0.00 H new ATOM 0 HB VAL P 365 -2.517 10.995 -2.252 1.00 0.00 H new ATOM 0 HG11 VAL P 365 -1.895 8.598 -2.023 1.00 0.00 H new ATOM 0 HG12 VAL P 365 -2.868 9.161 -0.643 1.00 0.00 H new ATOM 0 HG13 VAL P 365 -3.621 8.174 -1.919 1.00 0.00 H new ATOM 0 HG21 VAL P 365 -2.179 9.579 -4.234 1.00 0.00 H new ATOM 0 HG22 VAL P 365 -3.910 9.166 -4.227 1.00 0.00 H new ATOM 0 HG23 VAL P 365 -3.396 10.845 -4.518 1.00 0.00 H new ATOM 1079 N PRO P 366 -4.727 11.014 0.382 1.00 0.00 N ATOM 1080 CA PRO P 366 -4.657 11.722 1.663 1.00 0.00 C ATOM 1081 C PRO P 366 -3.283 11.632 2.301 1.00 0.00 C ATOM 1082 O PRO P 366 -2.421 10.899 1.823 1.00 0.00 O ATOM 1083 CB PRO P 366 -5.647 10.921 2.494 1.00 0.00 C ATOM 1084 CG PRO P 366 -5.380 9.517 2.065 1.00 0.00 C ATOM 1085 CD PRO P 366 -5.105 9.598 0.581 1.00 0.00 C ATOM 0 HA PRO P 366 -4.863 12.788 1.571 1.00 0.00 H new ATOM 0 HB2 PRO P 366 -5.480 11.056 3.563 1.00 0.00 H new ATOM 0 HB3 PRO P 366 -6.677 11.217 2.292 1.00 0.00 H new ATOM 0 HG2 PRO P 366 -4.528 9.098 2.600 1.00 0.00 H new ATOM 0 HG3 PRO P 366 -6.235 8.873 2.272 1.00 0.00 H new ATOM 0 HD2 PRO P 366 -4.304 8.922 0.283 1.00 0.00 H new ATOM 0 HD3 PRO P 366 -5.983 9.330 -0.006 1.00 0.00 H new ATOM 1093 N PRO P 367 -3.061 12.344 3.420 1.00 0.00 N ATOM 1094 CA PRO P 367 -1.786 12.286 4.127 1.00 0.00 C ATOM 1095 C PRO P 367 -1.439 10.848 4.449 1.00 0.00 C ATOM 1096 O PRO P 367 -2.279 10.091 4.938 1.00 0.00 O ATOM 1097 CB PRO P 367 -2.042 13.080 5.405 1.00 0.00 C ATOM 1098 CG PRO P 367 -3.144 14.001 5.038 1.00 0.00 C ATOM 1099 CD PRO P 367 -4.024 13.224 4.097 1.00 0.00 C ATOM 0 HA PRO P 367 -0.954 12.685 3.548 1.00 0.00 H new ATOM 0 HB2 PRO P 367 -2.325 12.427 6.231 1.00 0.00 H new ATOM 0 HB3 PRO P 367 -1.153 13.626 5.721 1.00 0.00 H new ATOM 0 HG2 PRO P 367 -3.699 14.320 5.920 1.00 0.00 H new ATOM 0 HG3 PRO P 367 -2.759 14.902 4.561 1.00 0.00 H new ATOM 0 HD2 PRO P 367 -4.788 12.657 4.629 1.00 0.00 H new ATOM 0 HD3 PRO P 367 -4.543 13.876 3.394 1.00 0.00 H new ATOM 1107 N ARG P 368 -0.220 10.467 4.147 1.00 0.00 N ATOM 1108 CA ARG P 368 0.208 9.095 4.382 1.00 0.00 C ATOM 1109 C ARG P 368 0.814 8.919 5.771 1.00 0.00 C ATOM 1110 O ARG P 368 1.576 9.760 6.245 1.00 0.00 O ATOM 1111 CB ARG P 368 1.188 8.606 3.300 1.00 0.00 C ATOM 1112 CG ARG P 368 1.650 9.671 2.310 1.00 0.00 C ATOM 1113 CD ARG P 368 0.505 10.183 1.449 1.00 0.00 C ATOM 1114 NE ARG P 368 0.648 11.603 1.139 1.00 0.00 N ATOM 1115 CZ ARG P 368 1.611 12.102 0.368 1.00 0.00 C ATOM 1116 NH1 ARG P 368 2.519 11.301 -0.175 1.00 0.00 N ATOM 1117 NH2 ARG P 368 1.667 13.407 0.138 1.00 0.00 N ATOM 0 H ARG P 368 0.491 11.075 3.742 1.00 0.00 H new ATOM 0 HA ARG P 368 -0.689 8.478 4.326 1.00 0.00 H new ATOM 0 HB2 ARG P 368 2.065 8.185 3.791 1.00 0.00 H new ATOM 0 HB3 ARG P 368 0.715 7.797 2.744 1.00 0.00 H new ATOM 0 HG2 ARG P 368 2.095 10.504 2.855 1.00 0.00 H new ATOM 0 HG3 ARG P 368 2.429 9.257 1.669 1.00 0.00 H new ATOM 0 HD2 ARG P 368 0.465 9.611 0.522 1.00 0.00 H new ATOM 0 HD3 ARG P 368 -0.440 10.018 1.967 1.00 0.00 H new ATOM 0 HE ARG P 368 -0.031 12.251 1.537 1.00 0.00 H new ATOM 0 HH11 ARG P 368 2.481 10.296 -0.002 1.00 0.00 H new ATOM 0 HH12 ARG P 368 3.255 11.690 -0.765 1.00 0.00 H new ATOM 0 HH21 ARG P 368 0.972 14.028 0.552 1.00 0.00 H new ATOM 0 HH22 ARG P 368 2.405 13.789 -0.453 1.00 0.00 H new ATOM 1131 N PRO P 369 0.456 7.798 6.427 1.00 0.00 N ATOM 1132 CA PRO P 369 0.914 7.421 7.760 1.00 0.00 C ATOM 1133 C PRO P 369 2.265 8.027 8.134 1.00 0.00 C ATOM 1134 O PRO P 369 3.099 8.300 7.270 1.00 0.00 O ATOM 1135 CB PRO P 369 1.014 5.903 7.628 1.00 0.00 C ATOM 1136 CG PRO P 369 -0.001 5.521 6.584 1.00 0.00 C ATOM 1137 CD PRO P 369 -0.449 6.780 5.903 1.00 0.00 C ATOM 0 HA PRO P 369 0.250 7.775 8.548 1.00 0.00 H new ATOM 0 HB2 PRO P 369 2.017 5.601 7.329 1.00 0.00 H new ATOM 0 HB3 PRO P 369 0.803 5.412 8.578 1.00 0.00 H new ATOM 0 HG2 PRO P 369 0.434 4.830 5.862 1.00 0.00 H new ATOM 0 HG3 PRO P 369 -0.849 5.012 7.043 1.00 0.00 H new ATOM 0 HD2 PRO P 369 -0.374 6.697 4.819 1.00 0.00 H new ATOM 0 HD3 PRO P 369 -1.489 7.012 6.134 1.00 0.00 H new ATOM 1145 N SER P 370 2.473 8.240 9.429 1.00 0.00 N ATOM 1146 CA SER P 370 3.717 8.826 9.922 1.00 0.00 C ATOM 1147 C SER P 370 4.883 7.838 9.869 1.00 0.00 C ATOM 1148 O SER P 370 5.769 7.877 10.724 1.00 0.00 O ATOM 1149 CB SER P 370 3.528 9.324 11.356 1.00 0.00 C ATOM 1150 OG SER P 370 4.261 10.515 11.585 1.00 0.00 O ATOM 0 H SER P 370 1.796 8.016 10.158 1.00 0.00 H new ATOM 0 HA SER P 370 3.963 9.662 9.267 1.00 0.00 H new ATOM 0 HB2 SER P 370 2.470 9.503 11.545 1.00 0.00 H new ATOM 0 HB3 SER P 370 3.851 8.554 12.057 1.00 0.00 H new ATOM 0 HG SER P 370 4.122 10.813 12.508 1.00 0.00 H new ATOM 1156 N ALA P 371 4.893 6.969 8.859 1.00 0.00 N ATOM 1157 CA ALA P 371 5.964 5.989 8.693 1.00 0.00 C ATOM 1158 C ALA P 371 5.990 4.970 9.830 1.00 0.00 C ATOM 1159 O ALA P 371 5.800 3.777 9.611 1.00 0.00 O ATOM 1160 CB ALA P 371 7.306 6.698 8.589 1.00 0.00 C ATOM 0 H ALA P 371 4.169 6.924 8.142 1.00 0.00 H new ATOM 0 HA ALA P 371 5.770 5.441 7.771 1.00 0.00 H new ATOM 0 HB1 ALA P 371 8.099 5.960 8.465 1.00 0.00 H new ATOM 0 HB2 ALA P 371 7.298 7.369 7.730 1.00 0.00 H new ATOM 0 HB3 ALA P 371 7.485 7.274 9.497 1.00 0.00 H new ATOM 1166 N ASP P 372 6.248 5.442 11.041 1.00 0.00 N ATOM 1167 CA ASP P 372 6.323 4.565 12.206 1.00 0.00 C ATOM 1168 C ASP P 372 5.175 3.561 12.253 1.00 0.00 C ATOM 1169 O ASP P 372 5.422 2.356 12.244 1.00 0.00 O ATOM 1170 CB ASP P 372 6.354 5.387 13.495 1.00 0.00 C ATOM 1171 CG ASP P 372 7.757 5.827 13.868 1.00 0.00 C ATOM 1172 OD1 ASP P 372 8.302 6.716 13.179 1.00 0.00 O ATOM 1173 OD2 ASP P 372 8.310 5.284 14.846 1.00 0.00 O ATOM 0 H ASP P 372 6.409 6.428 11.245 1.00 0.00 H new ATOM 0 HA ASP P 372 7.249 3.997 12.116 1.00 0.00 H new ATOM 0 HB2 ASP P 372 5.720 6.266 13.377 1.00 0.00 H new ATOM 0 HB3 ASP P 372 5.933 4.797 14.309 1.00 0.00 H new ATOM 1178 N LEU P 373 3.921 4.026 12.301 1.00 0.00 N ATOM 1179 CA LEU P 373 2.815 3.074 12.343 1.00 0.00 C ATOM 1180 C LEU P 373 2.925 2.118 11.163 1.00 0.00 C ATOM 1181 O LEU P 373 2.516 0.962 11.251 1.00 0.00 O ATOM 1182 CB LEU P 373 1.429 3.753 12.458 1.00 0.00 C ATOM 1183 CG LEU P 373 0.799 4.393 11.207 1.00 0.00 C ATOM 1184 CD1 LEU P 373 0.911 3.514 9.981 1.00 0.00 C ATOM 1185 CD2 LEU P 373 -0.669 4.679 11.476 1.00 0.00 C ATOM 0 H LEU P 373 3.657 5.011 12.311 1.00 0.00 H new ATOM 0 HA LEU P 373 2.898 2.492 13.261 1.00 0.00 H new ATOM 0 HB2 LEU P 373 0.728 3.007 12.833 1.00 0.00 H new ATOM 0 HB3 LEU P 373 1.506 4.529 13.220 1.00 0.00 H new ATOM 0 HG LEU P 373 1.348 5.312 11.004 1.00 0.00 H new ATOM 0 HD11 LEU P 373 0.450 4.016 9.130 1.00 0.00 H new ATOM 0 HD12 LEU P 373 1.962 3.324 9.764 1.00 0.00 H new ATOM 0 HD13 LEU P 373 0.401 2.568 10.164 1.00 0.00 H new ATOM 0 HD21 LEU P 373 -1.119 5.132 10.593 1.00 0.00 H new ATOM 0 HD22 LEU P 373 -1.185 3.747 11.708 1.00 0.00 H new ATOM 0 HD23 LEU P 373 -0.758 5.363 12.320 1.00 0.00 H new ATOM 1197 N ILE P 374 3.550 2.585 10.078 1.00 0.00 N ATOM 1198 CA ILE P 374 3.780 1.730 8.928 1.00 0.00 C ATOM 1199 C ILE P 374 4.823 0.712 9.345 1.00 0.00 C ATOM 1200 O ILE P 374 4.664 -0.492 9.150 1.00 0.00 O ATOM 1201 CB ILE P 374 4.289 2.505 7.689 1.00 0.00 C ATOM 1202 CG1 ILE P 374 3.197 3.411 7.116 1.00 0.00 C ATOM 1203 CG2 ILE P 374 4.785 1.538 6.626 1.00 0.00 C ATOM 1204 CD1 ILE P 374 3.727 4.468 6.172 1.00 0.00 C ATOM 0 H ILE P 374 3.899 3.538 9.979 1.00 0.00 H new ATOM 0 HA ILE P 374 2.836 1.270 8.635 1.00 0.00 H new ATOM 0 HB ILE P 374 5.119 3.136 8.005 1.00 0.00 H new ATOM 0 HG12 ILE P 374 2.466 2.798 6.589 1.00 0.00 H new ATOM 0 HG13 ILE P 374 2.672 3.898 7.937 1.00 0.00 H new ATOM 0 HG21 ILE P 374 5.140 2.099 5.761 1.00 0.00 H new ATOM 0 HG22 ILE P 374 5.602 0.940 7.031 1.00 0.00 H new ATOM 0 HG23 ILE P 374 3.970 0.881 6.323 1.00 0.00 H new ATOM 0 HD11 ILE P 374 2.900 5.074 5.803 1.00 0.00 H new ATOM 0 HD12 ILE P 374 4.436 5.105 6.700 1.00 0.00 H new ATOM 0 HD13 ILE P 374 4.227 3.987 5.331 1.00 0.00 H new ATOM 1216 N LEU P 375 5.874 1.225 9.979 1.00 0.00 N ATOM 1217 CA LEU P 375 6.942 0.391 10.499 1.00 0.00 C ATOM 1218 C LEU P 375 6.362 -0.588 11.514 1.00 0.00 C ATOM 1219 O LEU P 375 6.927 -1.650 11.775 1.00 0.00 O ATOM 1220 CB LEU P 375 8.021 1.276 11.143 1.00 0.00 C ATOM 1221 CG LEU P 375 8.765 2.188 10.163 1.00 0.00 C ATOM 1222 CD1 LEU P 375 9.035 3.551 10.782 1.00 0.00 C ATOM 1223 CD2 LEU P 375 10.074 1.553 9.713 1.00 0.00 C ATOM 0 H LEU P 375 6.005 2.223 10.144 1.00 0.00 H new ATOM 0 HA LEU P 375 7.403 -0.175 9.690 1.00 0.00 H new ATOM 0 HB2 LEU P 375 7.555 1.893 11.911 1.00 0.00 H new ATOM 0 HB3 LEU P 375 8.746 0.635 11.645 1.00 0.00 H new ATOM 0 HG LEU P 375 8.125 2.323 9.291 1.00 0.00 H new ATOM 0 HD11 LEU P 375 9.564 4.178 10.065 1.00 0.00 H new ATOM 0 HD12 LEU P 375 8.089 4.023 11.049 1.00 0.00 H new ATOM 0 HD13 LEU P 375 9.645 3.430 11.677 1.00 0.00 H new ATOM 0 HD21 LEU P 375 10.582 2.221 9.018 1.00 0.00 H new ATOM 0 HD22 LEU P 375 10.711 1.379 10.580 1.00 0.00 H new ATOM 0 HD23 LEU P 375 9.867 0.604 9.218 1.00 0.00 H new ATOM 1235 N ASN P 376 5.209 -0.214 12.062 1.00 0.00 N ATOM 1236 CA ASN P 376 4.500 -1.029 13.032 1.00 0.00 C ATOM 1237 C ASN P 376 3.516 -1.968 12.336 1.00 0.00 C ATOM 1238 O ASN P 376 3.068 -2.956 12.920 1.00 0.00 O ATOM 1239 CB ASN P 376 3.740 -0.122 14.004 1.00 0.00 C ATOM 1240 CG ASN P 376 3.941 -0.524 15.452 1.00 0.00 C ATOM 1241 OD1 ASN P 376 4.901 -0.102 16.097 1.00 0.00 O ATOM 1242 ND2 ASN P 376 3.035 -1.343 15.970 1.00 0.00 N ATOM 0 H ASN P 376 4.743 0.666 11.842 1.00 0.00 H new ATOM 0 HA ASN P 376 5.227 -1.630 13.577 1.00 0.00 H new ATOM 0 HB2 ASN P 376 4.069 0.908 13.867 1.00 0.00 H new ATOM 0 HB3 ASN P 376 2.677 -0.151 13.767 1.00 0.00 H new ATOM 0 HD21 ASN P 376 3.118 -1.648 16.940 1.00 0.00 H new ATOM 0 HD22 ASN P 376 2.255 -1.668 15.398 1.00 0.00 H new ATOM 1249 N ARG P 377 3.158 -1.638 11.093 1.00 0.00 N ATOM 1250 CA ARG P 377 2.200 -2.440 10.339 1.00 0.00 C ATOM 1251 C ARG P 377 2.688 -2.757 8.919 1.00 0.00 C ATOM 1252 O ARG P 377 1.900 -2.736 7.976 1.00 0.00 O ATOM 1253 CB ARG P 377 0.856 -1.699 10.273 1.00 0.00 C ATOM 1254 CG ARG P 377 0.305 -1.310 11.638 1.00 0.00 C ATOM 1255 CD ARG P 377 -0.265 0.106 11.651 1.00 0.00 C ATOM 1256 NE ARG P 377 -0.341 0.649 13.005 1.00 0.00 N ATOM 1257 CZ ARG P 377 -1.206 1.588 13.385 1.00 0.00 C ATOM 1258 NH1 ARG P 377 -2.063 2.105 12.513 1.00 0.00 N ATOM 1259 NH2 ARG P 377 -1.210 2.015 14.640 1.00 0.00 N ATOM 0 H ARG P 377 3.516 -0.825 10.592 1.00 0.00 H new ATOM 0 HA ARG P 377 2.085 -3.391 10.859 1.00 0.00 H new ATOM 0 HB2 ARG P 377 0.976 -0.799 9.670 1.00 0.00 H new ATOM 0 HB3 ARG P 377 0.128 -2.330 9.763 1.00 0.00 H new ATOM 0 HG2 ARG P 377 -0.474 -2.015 11.927 1.00 0.00 H new ATOM 0 HG3 ARG P 377 1.097 -1.387 12.383 1.00 0.00 H new ATOM 0 HD2 ARG P 377 0.358 0.754 11.034 1.00 0.00 H new ATOM 0 HD3 ARG P 377 -1.260 0.101 11.205 1.00 0.00 H new ATOM 0 HE ARG P 377 0.309 0.287 13.703 1.00 0.00 H new ATOM 0 HH11 ARG P 377 -2.062 1.784 11.545 1.00 0.00 H new ATOM 0 HH12 ARG P 377 -2.723 2.824 12.811 1.00 0.00 H new ATOM 0 HH21 ARG P 377 -0.551 1.625 15.314 1.00 0.00 H new ATOM 0 HH22 ARG P 377 -1.872 2.734 14.932 1.00 0.00 H new ATOM 1273 N CYS P 378 3.978 -3.068 8.762 1.00 0.00 N ATOM 1274 CA CYS P 378 4.514 -3.399 7.435 1.00 0.00 C ATOM 1275 C CYS P 378 5.781 -4.246 7.516 1.00 0.00 C ATOM 1276 O CYS P 378 6.255 -4.586 8.600 1.00 0.00 O ATOM 1277 CB CYS P 378 4.804 -2.136 6.626 1.00 0.00 C ATOM 1278 SG CYS P 378 3.382 -1.522 5.702 1.00 0.00 S ATOM 0 H CYS P 378 4.660 -3.098 9.520 1.00 0.00 H new ATOM 0 HA CYS P 378 3.743 -3.984 6.933 1.00 0.00 H new ATOM 0 HB2 CYS P 378 5.152 -1.355 7.302 1.00 0.00 H new ATOM 0 HB3 CYS P 378 5.617 -2.340 5.930 1.00 0.00 H new ATOM 0 HG CYS P 378 2.301 -2.098 6.136 1.00 0.00 H new ATOM 1284 N SER P 379 6.318 -4.577 6.342 1.00 0.00 N ATOM 1285 CA SER P 379 7.532 -5.382 6.240 1.00 0.00 C ATOM 1286 C SER P 379 8.774 -4.504 6.370 1.00 0.00 C ATOM 1287 O SER P 379 8.681 -3.277 6.356 1.00 0.00 O ATOM 1288 CB SER P 379 7.560 -6.127 4.901 1.00 0.00 C ATOM 1289 OG SER P 379 7.094 -7.458 5.049 1.00 0.00 O ATOM 0 H SER P 379 5.927 -4.297 5.443 1.00 0.00 H new ATOM 0 HA SER P 379 7.531 -6.107 7.054 1.00 0.00 H new ATOM 0 HB2 SER P 379 6.941 -5.600 4.175 1.00 0.00 H new ATOM 0 HB3 SER P 379 8.576 -6.136 4.507 1.00 0.00 H new ATOM 0 HG SER P 379 6.134 -7.492 4.854 1.00 0.00 H new ATOM 1295 N GLU P 380 9.934 -5.142 6.491 1.00 0.00 N ATOM 1296 CA GLU P 380 11.192 -4.416 6.617 1.00 0.00 C ATOM 1297 C GLU P 380 11.502 -3.647 5.338 1.00 0.00 C ATOM 1298 O GLU P 380 12.109 -2.576 5.378 1.00 0.00 O ATOM 1299 CB GLU P 380 12.334 -5.382 6.935 1.00 0.00 C ATOM 1300 CG GLU P 380 12.499 -5.660 8.420 1.00 0.00 C ATOM 1301 CD GLU P 380 13.612 -4.844 9.046 1.00 0.00 C ATOM 1302 OE1 GLU P 380 13.410 -3.631 9.264 1.00 0.00 O ATOM 1303 OE2 GLU P 380 14.689 -5.417 9.320 1.00 0.00 O ATOM 0 H GLU P 380 10.029 -6.158 6.504 1.00 0.00 H new ATOM 0 HA GLU P 380 11.092 -3.703 7.435 1.00 0.00 H new ATOM 0 HB2 GLU P 380 12.158 -6.324 6.415 1.00 0.00 H new ATOM 0 HB3 GLU P 380 13.265 -4.972 6.545 1.00 0.00 H new ATOM 0 HG2 GLU P 380 11.562 -5.443 8.933 1.00 0.00 H new ATOM 0 HG3 GLU P 380 12.704 -6.720 8.567 1.00 0.00 H new ATOM 1310 N SER P 381 11.080 -4.198 4.205 1.00 0.00 N ATOM 1311 CA SER P 381 11.310 -3.561 2.913 1.00 0.00 C ATOM 1312 C SER P 381 10.693 -2.167 2.880 1.00 0.00 C ATOM 1313 O SER P 381 11.405 -1.166 2.805 1.00 0.00 O ATOM 1314 CB SER P 381 10.729 -4.419 1.787 1.00 0.00 C ATOM 1315 OG SER P 381 11.426 -5.647 1.668 1.00 0.00 O ATOM 0 H SER P 381 10.577 -5.084 4.155 1.00 0.00 H new ATOM 0 HA SER P 381 12.386 -3.466 2.767 1.00 0.00 H new ATOM 0 HB2 SER P 381 9.674 -4.614 1.981 1.00 0.00 H new ATOM 0 HB3 SER P 381 10.784 -3.874 0.845 1.00 0.00 H new ATOM 0 HG SER P 381 11.034 -6.177 0.943 1.00 0.00 H new ATOM 1321 N THR P 382 9.366 -2.107 2.948 1.00 0.00 N ATOM 1322 CA THR P 382 8.661 -0.830 2.937 1.00 0.00 C ATOM 1323 C THR P 382 9.134 0.049 4.090 1.00 0.00 C ATOM 1324 O THR P 382 9.143 1.275 3.989 1.00 0.00 O ATOM 1325 CB THR P 382 7.148 -1.054 3.036 1.00 0.00 C ATOM 1326 OG1 THR P 382 6.674 -1.781 1.917 1.00 0.00 O ATOM 1327 CG2 THR P 382 6.351 0.233 3.115 1.00 0.00 C ATOM 0 H THR P 382 8.760 -2.925 3.011 1.00 0.00 H new ATOM 0 HA THR P 382 8.881 -0.325 1.997 1.00 0.00 H new ATOM 0 HB THR P 382 7.002 -1.610 3.962 1.00 0.00 H new ATOM 0 HG1 THR P 382 5.745 -2.053 2.073 1.00 0.00 H new ATOM 0 HG21 THR P 382 5.289 -0.001 3.183 1.00 0.00 H new ATOM 0 HG22 THR P 382 6.656 0.796 3.997 1.00 0.00 H new ATOM 0 HG23 THR P 382 6.535 0.830 2.222 1.00 0.00 H new ATOM 1335 N LYS P 383 9.527 -0.592 5.185 1.00 0.00 N ATOM 1336 CA LYS P 383 10.006 0.124 6.359 1.00 0.00 C ATOM 1337 C LYS P 383 11.254 0.931 6.024 1.00 0.00 C ATOM 1338 O LYS P 383 11.374 2.094 6.409 1.00 0.00 O ATOM 1339 CB LYS P 383 10.300 -0.858 7.493 1.00 0.00 C ATOM 1340 CG LYS P 383 9.102 -1.111 8.392 1.00 0.00 C ATOM 1341 CD LYS P 383 9.230 -2.424 9.146 1.00 0.00 C ATOM 1342 CE LYS P 383 10.322 -2.354 10.202 1.00 0.00 C ATOM 1343 NZ LYS P 383 10.668 -3.700 10.737 1.00 0.00 N ATOM 0 H LYS P 383 9.523 -1.607 5.283 1.00 0.00 H new ATOM 0 HA LYS P 383 9.227 0.814 6.683 1.00 0.00 H new ATOM 0 HB2 LYS P 383 10.633 -1.805 7.068 1.00 0.00 H new ATOM 0 HB3 LYS P 383 11.123 -0.472 8.095 1.00 0.00 H new ATOM 0 HG2 LYS P 383 9.002 -0.291 9.104 1.00 0.00 H new ATOM 0 HG3 LYS P 383 8.193 -1.124 7.791 1.00 0.00 H new ATOM 0 HD2 LYS P 383 8.279 -2.667 9.620 1.00 0.00 H new ATOM 0 HD3 LYS P 383 9.452 -3.228 8.444 1.00 0.00 H new ATOM 0 HE2 LYS P 383 11.212 -1.895 9.773 1.00 0.00 H new ATOM 0 HE3 LYS P 383 9.995 -1.712 11.020 1.00 0.00 H new ATOM 0 HZ1 LYS P 383 10.525 -3.712 11.767 1.00 0.00 H new ATOM 0 HZ2 LYS P 383 10.058 -4.417 10.294 1.00 0.00 H new ATOM 0 HZ3 LYS P 383 11.663 -3.913 10.524 1.00 0.00 H new ATOM 1357 N ARG P 384 12.179 0.310 5.298 1.00 0.00 N ATOM 1358 CA ARG P 384 13.415 0.978 4.904 1.00 0.00 C ATOM 1359 C ARG P 384 13.104 2.262 4.142 1.00 0.00 C ATOM 1360 O ARG P 384 13.857 3.234 4.205 1.00 0.00 O ATOM 1361 CB ARG P 384 14.270 0.050 4.039 1.00 0.00 C ATOM 1362 CG ARG P 384 14.682 -1.231 4.745 1.00 0.00 C ATOM 1363 CD ARG P 384 16.122 -1.164 5.229 1.00 0.00 C ATOM 1364 NE ARG P 384 17.010 -2.000 4.422 1.00 0.00 N ATOM 1365 CZ ARG P 384 18.214 -2.404 4.823 1.00 0.00 C ATOM 1366 NH1 ARG P 384 18.676 -2.053 6.016 1.00 0.00 N ATOM 1367 NH2 ARG P 384 18.956 -3.161 4.028 1.00 0.00 N ATOM 0 H ARG P 384 12.096 -0.653 4.971 1.00 0.00 H new ATOM 0 HA ARG P 384 13.973 1.230 5.806 1.00 0.00 H new ATOM 0 HB2 ARG P 384 13.715 -0.205 3.136 1.00 0.00 H new ATOM 0 HB3 ARG P 384 15.166 0.585 3.722 1.00 0.00 H new ATOM 0 HG2 ARG P 384 14.020 -1.409 5.593 1.00 0.00 H new ATOM 0 HG3 ARG P 384 14.564 -2.076 4.066 1.00 0.00 H new ATOM 0 HD2 ARG P 384 16.468 -0.131 5.196 1.00 0.00 H new ATOM 0 HD3 ARG P 384 16.170 -1.484 6.270 1.00 0.00 H new ATOM 0 HE ARG P 384 16.689 -2.290 3.499 1.00 0.00 H new ATOM 0 HH11 ARG P 384 18.108 -1.471 6.632 1.00 0.00 H new ATOM 0 HH12 ARG P 384 19.599 -2.365 6.318 1.00 0.00 H new ATOM 0 HH21 ARG P 384 18.605 -3.434 3.110 1.00 0.00 H new ATOM 0 HH22 ARG P 384 19.878 -3.471 4.334 1.00 0.00 H new ATOM 1381 N LYS P 385 11.983 2.256 3.429 1.00 0.00 N ATOM 1382 CA LYS P 385 11.556 3.415 2.657 1.00 0.00 C ATOM 1383 C LYS P 385 11.246 4.591 3.580 1.00 0.00 C ATOM 1384 O LYS P 385 11.363 5.751 3.185 1.00 0.00 O ATOM 1385 CB LYS P 385 10.321 3.062 1.825 1.00 0.00 C ATOM 1386 CG LYS P 385 10.490 1.808 0.985 1.00 0.00 C ATOM 1387 CD LYS P 385 10.815 2.145 -0.461 1.00 0.00 C ATOM 1388 CE LYS P 385 10.141 1.180 -1.423 1.00 0.00 C ATOM 1389 NZ LYS P 385 10.987 -0.015 -1.695 1.00 0.00 N ATOM 0 H LYS P 385 11.352 1.457 3.370 1.00 0.00 H new ATOM 0 HA LYS P 385 12.367 3.705 1.989 1.00 0.00 H new ATOM 0 HB2 LYS P 385 9.470 2.930 2.493 1.00 0.00 H new ATOM 0 HB3 LYS P 385 10.084 3.899 1.169 1.00 0.00 H new ATOM 0 HG2 LYS P 385 11.286 1.193 1.404 1.00 0.00 H new ATOM 0 HG3 LYS P 385 9.576 1.216 1.025 1.00 0.00 H new ATOM 0 HD2 LYS P 385 10.493 3.163 -0.680 1.00 0.00 H new ATOM 0 HD3 LYS P 385 11.894 2.114 -0.609 1.00 0.00 H new ATOM 0 HE2 LYS P 385 9.185 0.861 -1.007 1.00 0.00 H new ATOM 0 HE3 LYS P 385 9.925 1.693 -2.360 1.00 0.00 H new ATOM 0 HZ1 LYS P 385 10.492 -0.648 -2.355 1.00 0.00 H new ATOM 0 HZ2 LYS P 385 11.889 0.287 -2.116 1.00 0.00 H new ATOM 0 HZ3 LYS P 385 11.172 -0.519 -0.805 1.00 0.00 H new ATOM 1403 N LEU P 386 10.851 4.278 4.810 1.00 0.00 N ATOM 1404 CA LEU P 386 10.522 5.302 5.798 1.00 0.00 C ATOM 1405 C LEU P 386 11.426 5.190 7.022 1.00 0.00 C ATOM 1406 O LEU P 386 10.982 5.384 8.154 1.00 0.00 O ATOM 1407 CB LEU P 386 9.052 5.191 6.217 1.00 0.00 C ATOM 1408 CG LEU P 386 8.458 3.782 6.144 1.00 0.00 C ATOM 1409 CD1 LEU P 386 7.447 3.569 7.257 1.00 0.00 C ATOM 1410 CD2 LEU P 386 7.808 3.553 4.789 1.00 0.00 C ATOM 0 H LEU P 386 10.750 3.321 5.148 1.00 0.00 H new ATOM 0 HA LEU P 386 10.685 6.277 5.339 1.00 0.00 H new ATOM 0 HB2 LEU P 386 8.954 5.557 7.239 1.00 0.00 H new ATOM 0 HB3 LEU P 386 8.459 5.851 5.584 1.00 0.00 H new ATOM 0 HG LEU P 386 9.266 3.061 6.271 1.00 0.00 H new ATOM 0 HD11 LEU P 386 7.036 2.562 7.188 1.00 0.00 H new ATOM 0 HD12 LEU P 386 7.937 3.696 8.223 1.00 0.00 H new ATOM 0 HD13 LEU P 386 6.641 4.297 7.161 1.00 0.00 H new ATOM 0 HD21 LEU P 386 7.390 2.547 4.751 1.00 0.00 H new ATOM 0 HD22 LEU P 386 7.012 4.283 4.639 1.00 0.00 H new ATOM 0 HD23 LEU P 386 8.555 3.665 4.003 1.00 0.00 H new