USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 576 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: A 91 THR OG1 : rot 180:sc= 0.0388 USER MOD Set 1.2: A 132 GLN : amide:sc= -0.389 K(o=-0.35,f=-1.5) USER MOD Single : A 88 ASN : amide:sc= -2.84! C(o=-2.8!,f=-2.7!) USER MOD Single : A 90 THR OG1 : rot -159:sc= -0.161 USER MOD Single : A 101 ASN : amide:sc= -0.265 K(o=-0.27,f=-1.3!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= -0.178 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot -156:sc= 0.00374 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot -179:sc= 0.635 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -1.9 K(o=-1.9,f=-2.8!) USER MOD Single : A 143 CYS SG : rot -168:sc= 1.78 USER MOD Single : A 145 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0316) USER MOD Single : A 146 MET CE :methyl -121:sc= 0 (180deg=-1.25) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -9.530 12.252 -5.076 1.00 0.00 N ATOM 175 CA ASN A 88 -8.634 12.693 -6.139 1.00 0.00 C ATOM 176 C ASN A 88 -7.328 11.905 -6.112 1.00 0.00 C ATOM 177 O ASN A 88 -6.772 11.613 -5.053 1.00 0.00 O ATOM 178 CB ASN A 88 -8.343 14.189 -6.001 1.00 0.00 C ATOM 179 CG ASN A 88 -7.835 14.800 -7.293 1.00 0.00 C ATOM 180 OD1 ASN A 88 -8.576 15.478 -8.004 1.00 0.00 O ATOM 181 ND2 ASN A 88 -6.566 14.562 -7.601 1.00 0.00 N ATOM 0 HA ASN A 88 -9.127 12.512 -7.094 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -9.251 14.706 -5.690 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.604 14.342 -5.215 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.168 14.947 -8.458 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.989 13.994 -6.981 1.00 0.00 H new ATOM 188 N PRO A 89 -6.826 11.551 -7.305 1.00 0.00 N ATOM 189 CA PRO A 89 -5.579 10.793 -7.445 1.00 0.00 C ATOM 190 C PRO A 89 -4.354 11.616 -7.063 1.00 0.00 C ATOM 191 O PRO A 89 -4.419 12.843 -6.975 1.00 0.00 O ATOM 192 CB PRO A 89 -5.544 10.442 -8.935 1.00 0.00 C ATOM 193 CG PRO A 89 -6.361 11.500 -9.593 1.00 0.00 C ATOM 194 CD PRO A 89 -7.436 11.866 -8.607 1.00 0.00 C ATOM 0 HA PRO A 89 -5.554 9.924 -6.787 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.523 10.436 -9.316 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -5.959 9.451 -9.118 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.749 12.367 -9.843 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -6.794 11.136 -10.525 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.706 12.919 -8.680 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.347 11.291 -8.774 1.00 0.00 H new ATOM 202 N THR A 90 -3.235 10.934 -6.837 1.00 0.00 N ATOM 203 CA THR A 90 -1.995 11.602 -6.463 1.00 0.00 C ATOM 204 C THR A 90 -0.795 10.682 -6.656 1.00 0.00 C ATOM 205 O THR A 90 -0.930 9.458 -6.647 1.00 0.00 O ATOM 206 CB THR A 90 -2.032 12.078 -4.999 1.00 0.00 C ATOM 207 OG1 THR A 90 -2.788 11.158 -4.204 1.00 0.00 O ATOM 208 CG2 THR A 90 -2.645 13.466 -4.896 1.00 0.00 C ATOM 0 H THR A 90 -3.163 9.919 -6.907 1.00 0.00 H new ATOM 0 HA THR A 90 -1.894 12.469 -7.116 1.00 0.00 H new ATOM 0 HB THR A 90 -1.008 12.122 -4.629 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.092 11.605 -3.386 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.660 13.780 -3.852 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.051 14.170 -5.479 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.664 13.443 -5.283 1.00 0.00 H new ATOM 216 N THR A 91 0.380 11.278 -6.831 1.00 0.00 N ATOM 217 CA THR A 91 1.604 10.512 -7.026 1.00 0.00 C ATOM 218 C THR A 91 2.178 10.043 -5.694 1.00 0.00 C ATOM 219 O THR A 91 3.143 9.279 -5.658 1.00 0.00 O ATOM 220 CB THR A 91 2.671 11.337 -7.770 1.00 0.00 C ATOM 221 OG1 THR A 91 2.668 12.687 -7.291 1.00 0.00 O ATOM 222 CG2 THR A 91 2.417 11.326 -9.269 1.00 0.00 C ATOM 0 H THR A 91 0.510 12.290 -6.842 1.00 0.00 H new ATOM 0 HA THR A 91 1.340 9.644 -7.630 1.00 0.00 H new ATOM 0 HB THR A 91 3.645 10.886 -7.580 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.350 13.205 -7.768 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.184 11.915 -9.772 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.449 10.300 -9.636 1.00 0.00 H new ATOM 0 HG23 THR A 91 1.436 11.755 -9.475 1.00 0.00 H new ATOM 230 N ARG A 92 1.579 10.504 -4.602 1.00 0.00 N ATOM 231 CA ARG A 92 2.031 10.131 -3.267 1.00 0.00 C ATOM 232 C ARG A 92 0.978 9.290 -2.551 1.00 0.00 C ATOM 233 O ARG A 92 -0.081 9.792 -2.173 1.00 0.00 O ATOM 234 CB ARG A 92 2.346 11.382 -2.444 1.00 0.00 C ATOM 235 CG ARG A 92 2.985 11.080 -1.098 1.00 0.00 C ATOM 236 CD ARG A 92 3.811 12.255 -0.598 1.00 0.00 C ATOM 237 NE ARG A 92 4.690 11.876 0.505 1.00 0.00 N ATOM 238 CZ ARG A 92 5.393 12.749 1.217 1.00 0.00 C ATOM 239 NH1 ARG A 92 5.320 14.045 0.944 1.00 0.00 N ATOM 240 NH2 ARG A 92 6.171 12.327 2.206 1.00 0.00 N ATOM 0 H ARG A 92 0.779 11.137 -4.615 1.00 0.00 H new ATOM 0 HA ARG A 92 2.938 9.535 -3.371 1.00 0.00 H new ATOM 0 HB2 ARG A 92 3.013 12.025 -3.017 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.425 11.942 -2.282 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.209 10.844 -0.370 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.620 10.198 -1.185 1.00 0.00 H new ATOM 0 HD2 ARG A 92 4.409 12.653 -1.418 1.00 0.00 H new ATOM 0 HD3 ARG A 92 3.145 13.054 -0.273 1.00 0.00 H new ATOM 0 HE ARG A 92 4.768 10.887 0.741 1.00 0.00 H new ATOM 0 HH11 ARG A 92 4.723 14.374 0.185 1.00 0.00 H new ATOM 0 HH12 ARG A 92 5.861 14.713 1.493 1.00 0.00 H new ATOM 0 HH21 ARG A 92 6.229 11.331 2.420 1.00 0.00 H new ATOM 0 HH22 ARG A 92 6.711 12.998 2.752 1.00 0.00 H new ATOM 254 N LEU A 93 1.276 8.008 -2.368 1.00 0.00 N ATOM 255 CA LEU A 93 0.355 7.097 -1.698 1.00 0.00 C ATOM 256 C LEU A 93 0.726 6.932 -0.228 1.00 0.00 C ATOM 257 O LEU A 93 1.903 6.949 0.131 1.00 0.00 O ATOM 258 CB LEU A 93 0.360 5.734 -2.392 1.00 0.00 C ATOM 259 CG LEU A 93 0.416 5.759 -3.920 1.00 0.00 C ATOM 260 CD1 LEU A 93 0.425 4.344 -4.478 1.00 0.00 C ATOM 261 CD2 LEU A 93 -0.756 6.549 -4.484 1.00 0.00 C ATOM 0 H LEU A 93 2.148 7.576 -2.674 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.646 7.524 -1.756 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.215 5.166 -2.026 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.536 5.192 -2.090 1.00 0.00 H new ATOM 0 HG LEU A 93 1.340 6.252 -4.222 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.465 4.382 -5.567 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.297 3.810 -4.101 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.481 3.824 -4.166 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.700 6.556 -5.573 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.692 6.085 -4.172 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.717 7.573 -4.112 1.00 0.00 H new ATOM 273 N TRP A 94 -0.286 6.772 0.617 1.00 0.00 N ATOM 274 CA TRP A 94 -0.067 6.602 2.049 1.00 0.00 C ATOM 275 C TRP A 94 -0.417 5.185 2.489 1.00 0.00 C ATOM 276 O TRP A 94 -1.484 4.668 2.159 1.00 0.00 O ATOM 277 CB TRP A 94 -0.899 7.615 2.837 1.00 0.00 C ATOM 278 CG TRP A 94 -1.023 7.277 4.292 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.126 7.566 5.280 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.107 6.586 4.922 1.00 0.00 C ATOM 281 NE1 TRP A 94 -0.587 7.095 6.486 1.00 0.00 N ATOM 282 CE2 TRP A 94 -1.801 6.491 6.294 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.308 6.039 4.461 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.651 5.871 7.205 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.151 5.424 5.367 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.820 5.344 6.726 1.00 0.00 C ATOM 0 H TRP A 94 -1.266 6.756 0.336 1.00 0.00 H new ATOM 0 HA TRP A 94 0.990 6.774 2.253 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.447 8.602 2.738 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -1.895 7.675 2.399 1.00 0.00 H new ATOM 0 HD1 TRP A 94 0.808 8.088 5.135 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.103 7.181 7.380 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.572 6.096 3.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.397 5.808 8.253 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -5.081 4.998 5.021 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.500 4.857 7.409 1.00 0.00 H new ATOM 297 N VAL A 95 0.488 4.561 3.237 1.00 0.00 N ATOM 298 CA VAL A 95 0.273 3.204 3.724 1.00 0.00 C ATOM 299 C VAL A 95 0.270 3.160 5.248 1.00 0.00 C ATOM 300 O VAL A 95 1.252 3.526 5.892 1.00 0.00 O ATOM 301 CB VAL A 95 1.354 2.241 3.196 1.00 0.00 C ATOM 302 CG1 VAL A 95 1.078 0.821 3.665 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.428 2.305 1.678 1.00 0.00 C ATOM 0 H VAL A 95 1.377 4.974 3.519 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.701 2.885 3.353 1.00 0.00 H new ATOM 0 HB VAL A 95 2.319 2.550 3.597 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.851 0.155 3.283 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.079 0.791 4.755 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.105 0.498 3.294 1.00 0.00 H new ATOM 0 HG21 VAL A 95 2.196 1.619 1.322 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.464 2.022 1.254 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.676 3.320 1.368 1.00 0.00 H new ATOM 313 N GLY A 96 -0.843 2.710 5.819 1.00 0.00 N ATOM 314 CA GLY A 96 -0.954 2.626 7.264 1.00 0.00 C ATOM 315 C GLY A 96 -1.325 1.235 7.737 1.00 0.00 C ATOM 316 O GLY A 96 -1.871 0.437 6.976 1.00 0.00 O ATOM 0 H GLY A 96 -1.670 2.402 5.307 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.006 2.919 7.716 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.705 3.336 7.610 1.00 0.00 H new ATOM 320 N GLY A 97 -1.026 0.941 8.999 1.00 0.00 N ATOM 321 CA GLY A 97 -1.337 -0.365 9.550 1.00 0.00 C ATOM 322 C GLY A 97 -0.182 -1.338 9.424 1.00 0.00 C ATOM 323 O GLY A 97 -0.389 -2.543 9.277 1.00 0.00 O ATOM 0 H GLY A 97 -0.574 1.584 9.649 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.605 -0.258 10.601 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.209 -0.773 9.039 1.00 0.00 H new ATOM 327 N LEU A 98 1.038 -0.816 9.479 1.00 0.00 N ATOM 328 CA LEU A 98 2.232 -1.646 9.368 1.00 0.00 C ATOM 329 C LEU A 98 2.517 -2.369 10.681 1.00 0.00 C ATOM 330 O LEU A 98 2.696 -1.738 11.722 1.00 0.00 O ATOM 331 CB LEU A 98 3.437 -0.792 8.971 1.00 0.00 C ATOM 332 CG LEU A 98 3.287 0.026 7.688 1.00 0.00 C ATOM 333 CD1 LEU A 98 4.560 0.806 7.400 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.937 -0.880 6.516 1.00 0.00 C ATOM 0 H LEU A 98 1.227 0.179 9.600 1.00 0.00 H new ATOM 0 HA LEU A 98 2.054 -2.393 8.594 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.658 -0.108 9.790 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.301 -1.447 8.861 1.00 0.00 H new ATOM 0 HG LEU A 98 2.473 0.738 7.827 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.434 1.382 6.483 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.767 1.483 8.229 1.00 0.00 H new ATOM 0 HD13 LEU A 98 5.393 0.113 7.281 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.834 -0.281 5.611 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.729 -1.616 6.376 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.997 -1.393 6.721 1.00 0.00 H new ATOM 346 N GLY A 99 2.559 -3.697 10.623 1.00 0.00 N ATOM 347 CA GLY A 99 2.825 -4.483 11.814 1.00 0.00 C ATOM 348 C GLY A 99 4.297 -4.803 11.981 1.00 0.00 C ATOM 349 O GLY A 99 5.128 -4.459 11.140 1.00 0.00 O ATOM 0 H GLY A 99 2.414 -4.242 9.773 1.00 0.00 H new ATOM 0 HA2 GLY A 99 2.473 -3.939 12.691 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.257 -5.412 11.766 1.00 0.00 H new ATOM 353 N PRO A 100 4.639 -5.475 13.090 1.00 0.00 N ATOM 354 CA PRO A 100 6.022 -5.855 13.391 1.00 0.00 C ATOM 355 C PRO A 100 6.542 -6.941 12.456 1.00 0.00 C ATOM 356 O PRO A 100 7.703 -7.338 12.536 1.00 0.00 O ATOM 357 CB PRO A 100 5.941 -6.380 14.827 1.00 0.00 C ATOM 358 CG PRO A 100 4.532 -6.838 14.984 1.00 0.00 C ATOM 359 CD PRO A 100 3.700 -5.916 14.136 1.00 0.00 C ATOM 0 HA PRO A 100 6.710 -5.019 13.266 1.00 0.00 H new ATOM 0 HB2 PRO A 100 6.643 -7.197 14.990 1.00 0.00 H new ATOM 0 HB3 PRO A 100 6.187 -5.600 15.548 1.00 0.00 H new ATOM 0 HG2 PRO A 100 4.420 -7.873 14.661 1.00 0.00 H new ATOM 0 HG3 PRO A 100 4.222 -6.795 16.028 1.00 0.00 H new ATOM 0 HD2 PRO A 100 2.837 -6.429 13.711 1.00 0.00 H new ATOM 0 HD3 PRO A 100 3.317 -5.074 14.714 1.00 0.00 H new ATOM 367 N ASN A 101 5.674 -7.416 11.569 1.00 0.00 N ATOM 368 CA ASN A 101 6.046 -8.457 10.617 1.00 0.00 C ATOM 369 C ASN A 101 6.390 -7.854 9.258 1.00 0.00 C ATOM 370 O ASN A 101 7.378 -8.234 8.629 1.00 0.00 O ATOM 371 CB ASN A 101 4.909 -9.469 10.466 1.00 0.00 C ATOM 372 CG ASN A 101 5.311 -10.670 9.632 1.00 0.00 C ATOM 373 OD1 ASN A 101 6.436 -10.747 9.136 1.00 0.00 O ATOM 374 ND2 ASN A 101 4.391 -11.615 9.473 1.00 0.00 N ATOM 0 H ASN A 101 4.708 -7.097 11.489 1.00 0.00 H new ATOM 0 HA ASN A 101 6.929 -8.968 11.002 1.00 0.00 H new ATOM 0 HB2 ASN A 101 4.592 -9.805 11.453 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.051 -8.981 10.005 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.604 -12.446 8.922 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.472 -11.509 9.902 1.00 0.00 H new ATOM 381 N THR A 102 5.567 -6.910 8.811 1.00 0.00 N ATOM 382 CA THR A 102 5.782 -6.255 7.527 1.00 0.00 C ATOM 383 C THR A 102 7.150 -5.583 7.475 1.00 0.00 C ATOM 384 O THR A 102 7.517 -4.829 8.377 1.00 0.00 O ATOM 385 CB THR A 102 4.695 -5.201 7.245 1.00 0.00 C ATOM 386 OG1 THR A 102 3.399 -5.809 7.292 1.00 0.00 O ATOM 387 CG2 THR A 102 4.908 -4.554 5.885 1.00 0.00 C ATOM 0 H THR A 102 4.746 -6.582 9.319 1.00 0.00 H new ATOM 0 HA THR A 102 5.732 -7.032 6.764 1.00 0.00 H new ATOM 0 HB THR A 102 4.762 -4.429 8.011 1.00 0.00 H new ATOM 0 HG1 THR A 102 2.713 -5.132 7.113 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.128 -3.813 5.708 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.883 -4.067 5.862 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.866 -5.318 5.108 1.00 0.00 H new ATOM 395 N SER A 103 7.901 -5.862 6.414 1.00 0.00 N ATOM 396 CA SER A 103 9.230 -5.286 6.247 1.00 0.00 C ATOM 397 C SER A 103 9.284 -4.395 5.010 1.00 0.00 C ATOM 398 O SER A 103 8.717 -4.725 3.967 1.00 0.00 O ATOM 399 CB SER A 103 10.278 -6.395 6.136 1.00 0.00 C ATOM 400 OG SER A 103 10.754 -6.777 7.416 1.00 0.00 O ATOM 0 H SER A 103 7.612 -6.483 5.658 1.00 0.00 H new ATOM 0 HA SER A 103 9.448 -4.675 7.123 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.845 -7.260 5.633 1.00 0.00 H new ATOM 0 HB3 SER A 103 11.111 -6.052 5.522 1.00 0.00 H new ATOM 0 HG SER A 103 11.421 -7.488 7.318 1.00 0.00 H new ATOM 406 N LEU A 104 9.970 -3.264 5.133 1.00 0.00 N ATOM 407 CA LEU A 104 10.100 -2.323 4.025 1.00 0.00 C ATOM 408 C LEU A 104 10.380 -3.057 2.718 1.00 0.00 C ATOM 409 O LEU A 104 9.556 -3.054 1.804 1.00 0.00 O ATOM 410 CB LEU A 104 11.219 -1.321 4.311 1.00 0.00 C ATOM 411 CG LEU A 104 11.342 -0.154 3.329 1.00 0.00 C ATOM 412 CD1 LEU A 104 10.453 1.002 3.761 1.00 0.00 C ATOM 413 CD2 LEU A 104 12.791 0.298 3.216 1.00 0.00 C ATOM 0 H LEU A 104 10.445 -2.976 5.989 1.00 0.00 H new ATOM 0 HA LEU A 104 9.157 -1.786 3.923 1.00 0.00 H new ATOM 0 HB2 LEU A 104 11.068 -0.914 5.311 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.167 -1.859 4.325 1.00 0.00 H new ATOM 0 HG LEU A 104 11.011 -0.493 2.347 1.00 0.00 H new ATOM 0 HD11 LEU A 104 10.553 1.823 3.051 1.00 0.00 H new ATOM 0 HD12 LEU A 104 9.415 0.672 3.789 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.753 1.341 4.753 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.859 1.129 2.513 1.00 0.00 H new ATOM 0 HD22 LEU A 104 13.149 0.620 4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 104 13.404 -0.530 2.860 1.00 0.00 H new ATOM 425 N ALA A 105 11.548 -3.686 2.636 1.00 0.00 N ATOM 426 CA ALA A 105 11.934 -4.428 1.442 1.00 0.00 C ATOM 427 C ALA A 105 10.729 -5.114 0.808 1.00 0.00 C ATOM 428 O ALA A 105 10.422 -4.892 -0.363 1.00 0.00 O ATOM 429 CB ALA A 105 13.009 -5.451 1.781 1.00 0.00 C ATOM 0 H ALA A 105 12.243 -3.696 3.382 1.00 0.00 H new ATOM 0 HA ALA A 105 12.337 -3.719 0.719 1.00 0.00 H new ATOM 0 HB1 ALA A 105 13.288 -5.998 0.880 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.885 -4.940 2.181 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.625 -6.149 2.525 1.00 0.00 H new ATOM 435 N ALA A 106 10.050 -5.948 1.588 1.00 0.00 N ATOM 436 CA ALA A 106 8.878 -6.666 1.103 1.00 0.00 C ATOM 437 C ALA A 106 7.938 -5.733 0.347 1.00 0.00 C ATOM 438 O ALA A 106 7.623 -5.965 -0.821 1.00 0.00 O ATOM 439 CB ALA A 106 8.148 -7.329 2.261 1.00 0.00 C ATOM 0 H ALA A 106 10.292 -6.143 2.560 1.00 0.00 H new ATOM 0 HA ALA A 106 9.216 -7.438 0.412 1.00 0.00 H new ATOM 0 HB1 ALA A 106 7.275 -7.861 1.884 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.816 -8.033 2.757 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.829 -6.568 2.973 1.00 0.00 H new ATOM 445 N LEU A 107 7.491 -4.678 1.020 1.00 0.00 N ATOM 446 CA LEU A 107 6.586 -3.710 0.412 1.00 0.00 C ATOM 447 C LEU A 107 7.218 -3.072 -0.821 1.00 0.00 C ATOM 448 O LEU A 107 6.655 -3.119 -1.914 1.00 0.00 O ATOM 449 CB LEU A 107 6.210 -2.627 1.425 1.00 0.00 C ATOM 450 CG LEU A 107 5.643 -3.121 2.756 1.00 0.00 C ATOM 451 CD1 LEU A 107 5.660 -2.005 3.790 1.00 0.00 C ATOM 452 CD2 LEU A 107 4.230 -3.654 2.569 1.00 0.00 C ATOM 0 H LEU A 107 7.741 -4.472 1.987 1.00 0.00 H new ATOM 0 HA LEU A 107 5.684 -4.238 0.103 1.00 0.00 H new ATOM 0 HB2 LEU A 107 7.096 -2.027 1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.477 -1.965 0.964 1.00 0.00 H new ATOM 0 HG LEU A 107 6.272 -3.934 3.117 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.253 -2.375 4.731 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.685 -1.669 3.945 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.054 -1.171 3.435 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.842 -4.001 3.527 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.590 -2.860 2.185 1.00 0.00 H new ATOM 0 HD23 LEU A 107 4.245 -4.483 1.861 1.00 0.00 H new ATOM 464 N ALA A 108 8.393 -2.479 -0.637 1.00 0.00 N ATOM 465 CA ALA A 108 9.104 -1.836 -1.735 1.00 0.00 C ATOM 466 C ALA A 108 9.066 -2.696 -2.993 1.00 0.00 C ATOM 467 O ALA A 108 9.128 -2.183 -4.110 1.00 0.00 O ATOM 468 CB ALA A 108 10.543 -1.547 -1.334 1.00 0.00 C ATOM 0 H ALA A 108 8.873 -2.431 0.262 1.00 0.00 H new ATOM 0 HA ALA A 108 8.603 -0.893 -1.956 1.00 0.00 H new ATOM 0 HB1 ALA A 108 11.062 -1.067 -2.163 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.553 -0.886 -0.468 1.00 0.00 H new ATOM 0 HB3 ALA A 108 11.046 -2.481 -1.083 1.00 0.00 H new ATOM 474 N ARG A 109 8.964 -4.008 -2.804 1.00 0.00 N ATOM 475 CA ARG A 109 8.920 -4.940 -3.924 1.00 0.00 C ATOM 476 C ARG A 109 7.504 -5.052 -4.483 1.00 0.00 C ATOM 477 O ARG A 109 7.309 -5.115 -5.696 1.00 0.00 O ATOM 478 CB ARG A 109 9.417 -6.319 -3.487 1.00 0.00 C ATOM 479 CG ARG A 109 9.981 -7.152 -4.627 1.00 0.00 C ATOM 480 CD ARG A 109 8.890 -7.939 -5.335 1.00 0.00 C ATOM 481 NE ARG A 109 9.439 -8.967 -6.215 1.00 0.00 N ATOM 482 CZ ARG A 109 9.859 -10.152 -5.788 1.00 0.00 C ATOM 483 NH1 ARG A 109 9.793 -10.458 -4.500 1.00 0.00 N ATOM 484 NH2 ARG A 109 10.347 -11.035 -6.650 1.00 0.00 N ATOM 0 H ARG A 109 8.910 -4.449 -1.886 1.00 0.00 H new ATOM 0 HA ARG A 109 9.573 -4.557 -4.708 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.186 -6.194 -2.724 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.594 -6.863 -3.024 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.483 -6.500 -5.342 1.00 0.00 H new ATOM 0 HG3 ARG A 109 10.733 -7.839 -4.239 1.00 0.00 H new ATOM 0 HD2 ARG A 109 8.241 -8.405 -4.594 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.271 -7.257 -5.917 1.00 0.00 H new ATOM 0 HE ARG A 109 9.503 -8.764 -7.212 1.00 0.00 H new ATOM 0 HH11 ARG A 109 9.419 -9.782 -3.834 1.00 0.00 H new ATOM 0 HH12 ARG A 109 10.116 -11.369 -4.175 1.00 0.00 H new ATOM 0 HH21 ARG A 109 10.400 -10.804 -7.642 1.00 0.00 H new ATOM 0 HH22 ARG A 109 10.669 -11.945 -6.321 1.00 0.00 H new ATOM 498 N GLU A 110 6.521 -5.075 -3.588 1.00 0.00 N ATOM 499 CA GLU A 110 5.124 -5.180 -3.993 1.00 0.00 C ATOM 500 C GLU A 110 4.672 -3.918 -4.721 1.00 0.00 C ATOM 501 O GLU A 110 3.952 -3.986 -5.717 1.00 0.00 O ATOM 502 CB GLU A 110 4.233 -5.426 -2.773 1.00 0.00 C ATOM 503 CG GLU A 110 4.407 -6.805 -2.161 1.00 0.00 C ATOM 504 CD GLU A 110 3.982 -6.855 -0.706 1.00 0.00 C ATOM 505 OE1 GLU A 110 4.014 -5.798 -0.041 1.00 0.00 O ATOM 506 OE2 GLU A 110 3.618 -7.952 -0.232 1.00 0.00 O ATOM 0 H GLU A 110 6.666 -5.022 -2.580 1.00 0.00 H new ATOM 0 HA GLU A 110 5.033 -6.024 -4.676 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.451 -4.672 -2.017 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.190 -5.295 -3.063 1.00 0.00 H new ATOM 0 HG2 GLU A 110 3.823 -7.528 -2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 110 5.452 -7.105 -2.241 1.00 0.00 H new ATOM 513 N PHE A 111 5.099 -2.765 -4.215 1.00 0.00 N ATOM 514 CA PHE A 111 4.737 -1.486 -4.815 1.00 0.00 C ATOM 515 C PHE A 111 5.537 -1.239 -6.091 1.00 0.00 C ATOM 516 O PHE A 111 4.989 -0.810 -7.107 1.00 0.00 O ATOM 517 CB PHE A 111 4.975 -0.347 -3.822 1.00 0.00 C ATOM 518 CG PHE A 111 3.852 -0.163 -2.841 1.00 0.00 C ATOM 519 CD1 PHE A 111 2.786 0.671 -3.138 1.00 0.00 C ATOM 520 CD2 PHE A 111 3.863 -0.823 -1.623 1.00 0.00 C ATOM 521 CE1 PHE A 111 1.751 0.843 -2.238 1.00 0.00 C ATOM 522 CE2 PHE A 111 2.830 -0.655 -0.720 1.00 0.00 C ATOM 523 CZ PHE A 111 1.773 0.180 -1.027 1.00 0.00 C ATOM 0 H PHE A 111 5.696 -2.690 -3.391 1.00 0.00 H new ATOM 0 HA PHE A 111 3.678 -1.520 -5.071 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.897 -0.540 -3.274 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.120 0.581 -4.374 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.764 1.193 -4.083 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.687 -1.476 -1.376 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.926 1.496 -2.482 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.849 -1.176 0.226 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.966 0.314 -0.322 1.00 0.00 H new ATOM 533 N ASP A 112 6.836 -1.511 -6.030 1.00 0.00 N ATOM 534 CA ASP A 112 7.712 -1.318 -7.180 1.00 0.00 C ATOM 535 C ASP A 112 7.154 -2.023 -8.412 1.00 0.00 C ATOM 536 O ASP A 112 7.232 -1.502 -9.525 1.00 0.00 O ATOM 537 CB ASP A 112 9.116 -1.841 -6.871 1.00 0.00 C ATOM 538 CG ASP A 112 9.890 -2.197 -8.125 1.00 0.00 C ATOM 539 OD1 ASP A 112 9.474 -3.139 -8.830 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.912 -1.534 -8.400 1.00 0.00 O ATOM 0 H ASP A 112 7.306 -1.866 -5.197 1.00 0.00 H new ATOM 0 HA ASP A 112 7.768 -0.250 -7.388 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.666 -1.086 -6.310 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.040 -2.721 -6.232 1.00 0.00 H new ATOM 545 N ARG A 113 6.591 -3.209 -8.206 1.00 0.00 N ATOM 546 CA ARG A 113 6.021 -3.985 -9.301 1.00 0.00 C ATOM 547 C ARG A 113 5.284 -3.080 -10.283 1.00 0.00 C ATOM 548 O ARG A 113 5.626 -3.019 -11.464 1.00 0.00 O ATOM 549 CB ARG A 113 5.067 -5.050 -8.757 1.00 0.00 C ATOM 550 CG ARG A 113 5.762 -6.336 -8.342 1.00 0.00 C ATOM 551 CD ARG A 113 4.878 -7.182 -7.440 1.00 0.00 C ATOM 552 NE ARG A 113 3.988 -8.051 -8.205 1.00 0.00 N ATOM 553 CZ ARG A 113 3.129 -8.897 -7.647 1.00 0.00 C ATOM 554 NH1 ARG A 113 3.044 -8.987 -6.327 1.00 0.00 N ATOM 555 NH2 ARG A 113 2.352 -9.656 -8.410 1.00 0.00 N ATOM 0 H ARG A 113 6.517 -3.654 -7.291 1.00 0.00 H new ATOM 0 HA ARG A 113 6.839 -4.475 -9.829 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.533 -4.643 -7.899 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.321 -5.280 -9.518 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.031 -6.908 -9.230 1.00 0.00 H new ATOM 0 HG3 ARG A 113 6.691 -6.098 -7.823 1.00 0.00 H new ATOM 0 HD2 ARG A 113 5.503 -7.789 -6.786 1.00 0.00 H new ATOM 0 HD3 ARG A 113 4.285 -6.530 -6.799 1.00 0.00 H new ATOM 0 HE ARG A 113 4.028 -8.006 -9.223 1.00 0.00 H new ATOM 0 HH11 ARG A 113 3.639 -8.406 -5.737 1.00 0.00 H new ATOM 0 HH12 ARG A 113 2.383 -9.638 -5.902 1.00 0.00 H new ATOM 0 HH21 ARG A 113 2.414 -9.590 -9.426 1.00 0.00 H new ATOM 0 HH22 ARG A 113 1.693 -10.305 -7.980 1.00 0.00 H new ATOM 569 N PHE A 114 4.270 -2.379 -9.787 1.00 0.00 N ATOM 570 CA PHE A 114 3.483 -1.478 -10.621 1.00 0.00 C ATOM 571 C PHE A 114 4.383 -0.478 -11.341 1.00 0.00 C ATOM 572 O PHE A 114 4.443 -0.452 -12.569 1.00 0.00 O ATOM 573 CB PHE A 114 2.451 -0.733 -9.771 1.00 0.00 C ATOM 574 CG PHE A 114 1.539 -1.645 -9.000 1.00 0.00 C ATOM 575 CD1 PHE A 114 1.886 -2.081 -7.732 1.00 0.00 C ATOM 576 CD2 PHE A 114 0.336 -2.065 -9.544 1.00 0.00 C ATOM 577 CE1 PHE A 114 1.050 -2.920 -7.019 1.00 0.00 C ATOM 578 CE2 PHE A 114 -0.504 -2.903 -8.836 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.147 -3.332 -7.572 1.00 0.00 C ATOM 0 H PHE A 114 3.974 -2.417 -8.812 1.00 0.00 H new ATOM 0 HA PHE A 114 2.963 -2.077 -11.369 1.00 0.00 H new ATOM 0 HB2 PHE A 114 2.972 -0.078 -9.073 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.851 -0.095 -10.419 1.00 0.00 H new ATOM 0 HD1 PHE A 114 2.821 -1.762 -7.295 1.00 0.00 H new ATOM 0 HD2 PHE A 114 0.052 -1.734 -10.532 1.00 0.00 H new ATOM 0 HE1 PHE A 114 1.332 -3.253 -6.031 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -1.440 -3.223 -9.271 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.802 -3.988 -7.018 1.00 0.00 H new ATOM 589 N GLY A 115 5.081 0.347 -10.565 1.00 0.00 N ATOM 590 CA GLY A 115 5.967 1.338 -11.145 1.00 0.00 C ATOM 591 C GLY A 115 7.191 1.593 -10.288 1.00 0.00 C ATOM 592 O GLY A 115 7.435 0.881 -9.315 1.00 0.00 O ATOM 0 H GLY A 115 5.048 0.346 -9.546 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.282 1.005 -12.134 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.422 2.272 -11.282 1.00 0.00 H new ATOM 596 N SER A 116 7.964 2.612 -10.651 1.00 0.00 N ATOM 597 CA SER A 116 9.173 2.956 -9.912 1.00 0.00 C ATOM 598 C SER A 116 8.838 3.799 -8.686 1.00 0.00 C ATOM 599 O SER A 116 8.009 4.707 -8.751 1.00 0.00 O ATOM 600 CB SER A 116 10.151 3.712 -10.814 1.00 0.00 C ATOM 601 OG SER A 116 11.018 2.817 -11.488 1.00 0.00 O ATOM 0 H SER A 116 7.774 3.214 -11.453 1.00 0.00 H new ATOM 0 HA SER A 116 9.641 2.030 -9.578 1.00 0.00 H new ATOM 0 HB2 SER A 116 9.596 4.304 -11.542 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.737 4.410 -10.216 1.00 0.00 H new ATOM 0 HG SER A 116 11.632 3.324 -12.059 1.00 0.00 H new ATOM 607 N ILE A 117 9.489 3.493 -7.569 1.00 0.00 N ATOM 608 CA ILE A 117 9.262 4.223 -6.328 1.00 0.00 C ATOM 609 C ILE A 117 10.350 5.267 -6.097 1.00 0.00 C ATOM 610 O ILE A 117 11.536 4.992 -6.279 1.00 0.00 O ATOM 611 CB ILE A 117 9.212 3.273 -5.117 1.00 0.00 C ATOM 612 CG1 ILE A 117 7.957 2.401 -5.176 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.252 4.067 -3.819 1.00 0.00 C ATOM 614 CD1 ILE A 117 7.964 1.262 -4.181 1.00 0.00 C ATOM 0 H ILE A 117 10.178 2.744 -7.498 1.00 0.00 H new ATOM 0 HA ILE A 117 8.298 4.722 -6.428 1.00 0.00 H new ATOM 0 HB ILE A 117 10.085 2.622 -5.149 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.082 3.025 -4.995 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.855 1.993 -6.182 1.00 0.00 H new ATOM 0 HG21 ILE A 117 9.216 3.382 -2.972 1.00 0.00 H new ATOM 0 HG22 ILE A 117 10.173 4.648 -3.776 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.396 4.740 -3.778 1.00 0.00 H new ATOM 0 HD11 ILE A 117 7.044 0.687 -4.280 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.819 0.615 -4.375 1.00 0.00 H new ATOM 0 HD13 ILE A 117 8.034 1.663 -3.170 1.00 0.00 H new ATOM 626 N ARG A 118 9.938 6.464 -5.693 1.00 0.00 N ATOM 627 CA ARG A 118 10.877 7.549 -5.436 1.00 0.00 C ATOM 628 C ARG A 118 11.556 7.371 -4.082 1.00 0.00 C ATOM 629 O ARG A 118 12.783 7.298 -3.994 1.00 0.00 O ATOM 630 CB ARG A 118 10.157 8.898 -5.484 1.00 0.00 C ATOM 631 CG ARG A 118 11.066 10.061 -5.845 1.00 0.00 C ATOM 632 CD ARG A 118 11.827 10.570 -4.631 1.00 0.00 C ATOM 633 NE ARG A 118 13.099 9.875 -4.451 1.00 0.00 N ATOM 634 CZ ARG A 118 14.153 10.055 -5.239 1.00 0.00 C ATOM 635 NH1 ARG A 118 14.087 10.905 -6.255 1.00 0.00 N ATOM 636 NH2 ARG A 118 15.275 9.385 -5.011 1.00 0.00 N ATOM 0 H ARG A 118 8.960 6.707 -5.537 1.00 0.00 H new ATOM 0 HA ARG A 118 11.642 7.525 -6.213 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.347 8.842 -6.211 1.00 0.00 H new ATOM 0 HB3 ARG A 118 9.701 9.092 -4.513 1.00 0.00 H new ATOM 0 HG2 ARG A 118 11.772 9.747 -6.614 1.00 0.00 H new ATOM 0 HG3 ARG A 118 10.472 10.870 -6.269 1.00 0.00 H new ATOM 0 HD2 ARG A 118 12.010 11.639 -4.740 1.00 0.00 H new ATOM 0 HD3 ARG A 118 11.214 10.441 -3.739 1.00 0.00 H new ATOM 0 HE ARG A 118 13.182 9.215 -3.678 1.00 0.00 H new ATOM 0 HH11 ARG A 118 13.226 11.422 -6.432 1.00 0.00 H new ATOM 0 HH12 ARG A 118 14.898 11.042 -6.859 1.00 0.00 H new ATOM 0 HH21 ARG A 118 15.329 8.731 -4.230 1.00 0.00 H new ATOM 0 HH22 ARG A 118 16.084 9.524 -5.617 1.00 0.00 H new ATOM 650 N THR A 119 10.751 7.301 -3.026 1.00 0.00 N ATOM 651 CA THR A 119 11.274 7.133 -1.676 1.00 0.00 C ATOM 652 C THR A 119 10.188 6.646 -0.723 1.00 0.00 C ATOM 653 O THR A 119 9.001 6.683 -1.049 1.00 0.00 O ATOM 654 CB THR A 119 11.864 8.448 -1.135 1.00 0.00 C ATOM 655 OG1 THR A 119 12.507 8.216 0.124 1.00 0.00 O ATOM 656 CG2 THR A 119 10.779 9.501 -0.968 1.00 0.00 C ATOM 0 H THR A 119 9.734 7.358 -3.080 1.00 0.00 H new ATOM 0 HA THR A 119 12.065 6.385 -1.734 1.00 0.00 H new ATOM 0 HB THR A 119 12.596 8.814 -1.855 1.00 0.00 H new ATOM 0 HG1 THR A 119 12.881 9.057 0.460 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.221 10.421 -0.585 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.311 9.698 -1.933 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.027 9.140 -0.267 1.00 0.00 H new ATOM 664 N ILE A 120 10.602 6.191 0.455 1.00 0.00 N ATOM 665 CA ILE A 120 9.663 5.699 1.455 1.00 0.00 C ATOM 666 C ILE A 120 10.056 6.164 2.853 1.00 0.00 C ATOM 667 O ILE A 120 11.220 6.077 3.244 1.00 0.00 O ATOM 668 CB ILE A 120 9.582 4.161 1.443 1.00 0.00 C ATOM 669 CG1 ILE A 120 9.181 3.661 0.054 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.595 3.674 2.493 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.450 2.188 -0.160 1.00 0.00 C ATOM 0 H ILE A 120 11.581 6.153 0.740 1.00 0.00 H new ATOM 0 HA ILE A 120 8.686 6.109 1.199 1.00 0.00 H new ATOM 0 HB ILE A 120 10.566 3.758 1.684 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.119 3.854 -0.100 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.722 4.234 -0.699 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.549 2.585 2.472 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.921 4.004 3.479 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.607 4.083 2.281 1.00 0.00 H new ATOM 0 HD11 ILE A 120 9.141 1.904 -1.166 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.515 1.991 -0.038 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.888 1.606 0.570 1.00 0.00 H new ATOM 683 N ASP A 121 9.077 6.658 3.603 1.00 0.00 N ATOM 684 CA ASP A 121 9.319 7.135 4.960 1.00 0.00 C ATOM 685 C ASP A 121 9.091 6.021 5.977 1.00 0.00 C ATOM 686 O ASP A 121 8.071 5.331 5.938 1.00 0.00 O ATOM 687 CB ASP A 121 8.410 8.324 5.275 1.00 0.00 C ATOM 688 CG ASP A 121 8.972 9.635 4.760 1.00 0.00 C ATOM 689 OD1 ASP A 121 9.079 9.790 3.526 1.00 0.00 O ATOM 690 OD2 ASP A 121 9.306 10.505 5.591 1.00 0.00 O ATOM 0 H ASP A 121 8.108 6.739 3.294 1.00 0.00 H new ATOM 0 HA ASP A 121 10.359 7.455 5.026 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.428 8.154 4.833 1.00 0.00 H new ATOM 0 HB3 ASP A 121 8.266 8.392 6.353 1.00 0.00 H new ATOM 695 N HIS A 122 10.046 5.850 6.885 1.00 0.00 N ATOM 696 CA HIS A 122 9.949 4.819 7.912 1.00 0.00 C ATOM 697 C HIS A 122 9.755 5.443 9.291 1.00 0.00 C ATOM 698 O HIS A 122 10.575 6.241 9.744 1.00 0.00 O ATOM 699 CB HIS A 122 11.204 3.945 7.907 1.00 0.00 C ATOM 700 CG HIS A 122 10.980 2.573 8.464 1.00 0.00 C ATOM 701 ND1 HIS A 122 10.249 1.605 7.809 1.00 0.00 N ATOM 702 CD2 HIS A 122 11.397 2.009 9.622 1.00 0.00 C ATOM 703 CE1 HIS A 122 10.225 0.504 8.540 1.00 0.00 C ATOM 704 NE2 HIS A 122 10.915 0.723 9.645 1.00 0.00 N ATOM 0 H HIS A 122 10.896 6.412 6.931 1.00 0.00 H new ATOM 0 HA HIS A 122 9.082 4.198 7.688 1.00 0.00 H new ATOM 0 HB2 HIS A 122 11.572 3.858 6.885 1.00 0.00 H new ATOM 0 HB3 HIS A 122 11.984 4.440 8.485 1.00 0.00 H new ATOM 0 HD2 HIS A 122 11.997 2.482 10.385 1.00 0.00 H new ATOM 0 HE1 HIS A 122 9.726 -0.418 8.278 1.00 0.00 H new ATOM 0 HE2 HIS A 122 11.065 0.047 10.394 1.00 0.00 H new ATOM 713 N VAL A 123 8.664 5.073 9.954 1.00 0.00 N ATOM 714 CA VAL A 123 8.361 5.596 11.281 1.00 0.00 C ATOM 715 C VAL A 123 7.590 4.576 12.111 1.00 0.00 C ATOM 716 O VAL A 123 6.504 4.141 11.728 1.00 0.00 O ATOM 717 CB VAL A 123 7.543 6.898 11.198 1.00 0.00 C ATOM 718 CG1 VAL A 123 6.220 6.654 10.489 1.00 0.00 C ATOM 719 CG2 VAL A 123 7.314 7.472 12.589 1.00 0.00 C ATOM 0 H VAL A 123 7.975 4.413 9.594 1.00 0.00 H new ATOM 0 HA VAL A 123 9.315 5.806 11.764 1.00 0.00 H new ATOM 0 HB VAL A 123 8.109 7.626 10.617 1.00 0.00 H new ATOM 0 HG11 VAL A 123 5.656 7.586 10.440 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.410 6.291 9.479 1.00 0.00 H new ATOM 0 HG13 VAL A 123 5.644 5.910 11.039 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.734 8.392 12.512 1.00 0.00 H new ATOM 0 HG22 VAL A 123 6.769 6.749 13.196 1.00 0.00 H new ATOM 0 HG23 VAL A 123 8.275 7.687 13.057 1.00 0.00 H new ATOM 729 N LYS A 124 8.158 4.197 13.250 1.00 0.00 N ATOM 730 CA LYS A 124 7.524 3.229 14.137 1.00 0.00 C ATOM 731 C LYS A 124 6.554 3.918 15.091 1.00 0.00 C ATOM 732 O LYS A 124 5.486 3.389 15.394 1.00 0.00 O ATOM 733 CB LYS A 124 8.585 2.466 14.935 1.00 0.00 C ATOM 734 CG LYS A 124 8.007 1.592 16.034 1.00 0.00 C ATOM 735 CD LYS A 124 7.585 0.233 15.502 1.00 0.00 C ATOM 736 CE LYS A 124 6.953 -0.621 16.591 1.00 0.00 C ATOM 737 NZ LYS A 124 6.636 -1.993 16.106 1.00 0.00 N ATOM 0 H LYS A 124 9.057 4.546 13.581 1.00 0.00 H new ATOM 0 HA LYS A 124 6.963 2.525 13.523 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.162 1.843 14.252 1.00 0.00 H new ATOM 0 HB3 LYS A 124 9.279 3.181 15.378 1.00 0.00 H new ATOM 0 HG2 LYS A 124 8.748 1.461 16.823 1.00 0.00 H new ATOM 0 HG3 LYS A 124 7.148 2.091 16.483 1.00 0.00 H new ATOM 0 HD2 LYS A 124 6.876 0.365 14.685 1.00 0.00 H new ATOM 0 HD3 LYS A 124 8.453 -0.283 15.091 1.00 0.00 H new ATOM 0 HE2 LYS A 124 7.631 -0.684 17.442 1.00 0.00 H new ATOM 0 HE3 LYS A 124 6.041 -0.141 16.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 6.207 -2.543 16.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 5.969 -1.934 15.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 7.510 -2.461 15.792 1.00 0.00 H new ATOM 751 N GLY A 125 6.933 5.104 15.559 1.00 0.00 N ATOM 752 CA GLY A 125 6.084 5.846 16.472 1.00 0.00 C ATOM 753 C GLY A 125 4.642 5.903 16.007 1.00 0.00 C ATOM 754 O GLY A 125 3.726 5.575 16.761 1.00 0.00 O ATOM 0 H GLY A 125 7.812 5.563 15.322 1.00 0.00 H new ATOM 0 HA2 GLY A 125 6.126 5.385 17.459 1.00 0.00 H new ATOM 0 HA3 GLY A 125 6.469 6.860 16.578 1.00 0.00 H new ATOM 758 N ASP A 126 4.440 6.321 14.762 1.00 0.00 N ATOM 759 CA ASP A 126 3.099 6.421 14.197 1.00 0.00 C ATOM 760 C ASP A 126 2.766 5.185 13.367 1.00 0.00 C ATOM 761 O ASP A 126 1.602 4.807 13.237 1.00 0.00 O ATOM 762 CB ASP A 126 2.978 7.678 13.335 1.00 0.00 C ATOM 763 CG ASP A 126 2.577 8.897 14.141 1.00 0.00 C ATOM 764 OD1 ASP A 126 1.401 8.975 14.555 1.00 0.00 O ATOM 765 OD2 ASP A 126 3.439 9.773 14.360 1.00 0.00 O ATOM 0 H ASP A 126 5.188 6.596 14.125 1.00 0.00 H new ATOM 0 HA ASP A 126 2.388 6.486 15.021 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.931 7.870 12.842 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.241 7.507 12.550 1.00 0.00 H new ATOM 770 N SER A 127 3.796 4.559 12.807 1.00 0.00 N ATOM 771 CA SER A 127 3.613 3.369 11.985 1.00 0.00 C ATOM 772 C SER A 127 3.001 3.730 10.635 1.00 0.00 C ATOM 773 O SER A 127 2.069 3.074 10.167 1.00 0.00 O ATOM 774 CB SER A 127 2.722 2.357 12.708 1.00 0.00 C ATOM 775 OG SER A 127 2.999 1.035 12.277 1.00 0.00 O ATOM 0 H SER A 127 4.766 4.856 12.908 1.00 0.00 H new ATOM 0 HA SER A 127 4.592 2.922 11.812 1.00 0.00 H new ATOM 0 HB2 SER A 127 2.879 2.433 13.784 1.00 0.00 H new ATOM 0 HB3 SER A 127 1.674 2.592 12.522 1.00 0.00 H new ATOM 0 HG SER A 127 2.214 0.469 12.433 1.00 0.00 H new ATOM 781 N PHE A 128 3.531 4.778 10.013 1.00 0.00 N ATOM 782 CA PHE A 128 3.037 5.228 8.717 1.00 0.00 C ATOM 783 C PHE A 128 4.157 5.236 7.681 1.00 0.00 C ATOM 784 O PHE A 128 5.316 5.492 8.006 1.00 0.00 O ATOM 785 CB PHE A 128 2.429 6.627 8.837 1.00 0.00 C ATOM 786 CG PHE A 128 3.452 7.726 8.861 1.00 0.00 C ATOM 787 CD1 PHE A 128 4.202 8.016 7.732 1.00 0.00 C ATOM 788 CD2 PHE A 128 3.665 8.468 10.011 1.00 0.00 C ATOM 789 CE1 PHE A 128 5.145 9.027 7.750 1.00 0.00 C ATOM 790 CE2 PHE A 128 4.606 9.480 10.035 1.00 0.00 C ATOM 791 CZ PHE A 128 5.348 9.759 8.904 1.00 0.00 C ATOM 0 H PHE A 128 4.303 5.331 10.386 1.00 0.00 H new ATOM 0 HA PHE A 128 2.266 4.531 8.388 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.750 6.792 8.001 1.00 0.00 H new ATOM 0 HB3 PHE A 128 1.832 6.678 9.747 1.00 0.00 H new ATOM 0 HD1 PHE A 128 4.048 7.446 6.828 1.00 0.00 H new ATOM 0 HD2 PHE A 128 3.089 8.253 10.899 1.00 0.00 H new ATOM 0 HE1 PHE A 128 5.722 9.244 6.863 1.00 0.00 H new ATOM 0 HE2 PHE A 128 4.761 10.052 10.938 1.00 0.00 H new ATOM 0 HZ PHE A 128 6.085 10.548 8.922 1.00 0.00 H new ATOM 801 N ALA A 129 3.801 4.952 6.432 1.00 0.00 N ATOM 802 CA ALA A 129 4.774 4.928 5.347 1.00 0.00 C ATOM 803 C ALA A 129 4.211 5.579 4.089 1.00 0.00 C ATOM 804 O ALA A 129 3.099 5.268 3.662 1.00 0.00 O ATOM 805 CB ALA A 129 5.204 3.497 5.056 1.00 0.00 C ATOM 0 H ALA A 129 2.846 4.735 6.147 1.00 0.00 H new ATOM 0 HA ALA A 129 5.646 5.502 5.661 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.931 3.494 4.244 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.655 3.064 5.949 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.334 2.907 4.767 1.00 0.00 H new ATOM 811 N TYR A 130 4.984 6.485 3.501 1.00 0.00 N ATOM 812 CA TYR A 130 4.561 7.183 2.293 1.00 0.00 C ATOM 813 C TYR A 130 5.364 6.715 1.083 1.00 0.00 C ATOM 814 O TYR A 130 6.594 6.780 1.078 1.00 0.00 O ATOM 815 CB TYR A 130 4.718 8.694 2.470 1.00 0.00 C ATOM 816 CG TYR A 130 3.571 9.339 3.215 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.403 9.701 2.554 1.00 0.00 C ATOM 818 CD2 TYR A 130 3.654 9.585 4.580 1.00 0.00 C ATOM 819 CE1 TYR A 130 1.353 10.291 3.230 1.00 0.00 C ATOM 820 CE2 TYR A 130 2.608 10.173 5.264 1.00 0.00 C ATOM 821 CZ TYR A 130 1.460 10.525 4.585 1.00 0.00 C ATOM 822 OH TYR A 130 0.416 11.111 5.263 1.00 0.00 O ATOM 0 H TYR A 130 5.907 6.753 3.842 1.00 0.00 H new ATOM 0 HA TYR A 130 3.510 6.951 2.120 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.646 8.894 3.005 1.00 0.00 H new ATOM 0 HB3 TYR A 130 4.810 9.159 1.488 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.315 9.518 1.493 1.00 0.00 H new ATOM 0 HD2 TYR A 130 4.551 9.312 5.115 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.453 10.568 2.701 1.00 0.00 H new ATOM 0 HE2 TYR A 130 2.689 10.356 6.325 1.00 0.00 H new ATOM 0 HH TYR A 130 0.652 11.204 6.210 1.00 0.00 H new ATOM 832 N ILE A 131 4.660 6.244 0.059 1.00 0.00 N ATOM 833 CA ILE A 131 5.306 5.767 -1.157 1.00 0.00 C ATOM 834 C ILE A 131 5.047 6.713 -2.324 1.00 0.00 C ATOM 835 O ILE A 131 3.898 6.999 -2.660 1.00 0.00 O ATOM 836 CB ILE A 131 4.820 4.356 -1.536 1.00 0.00 C ATOM 837 CG1 ILE A 131 5.102 3.372 -0.398 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.489 3.893 -2.822 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.571 1.980 -0.658 1.00 0.00 C ATOM 0 H ILE A 131 3.642 6.183 0.048 1.00 0.00 H new ATOM 0 HA ILE A 131 6.376 5.731 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 131 3.743 4.391 -1.702 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.178 3.317 -0.234 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.659 3.755 0.521 1.00 0.00 H new ATOM 0 HG21 ILE A 131 5.135 2.894 -3.077 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.242 4.582 -3.629 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.570 3.871 -2.682 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.807 1.336 0.190 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.490 2.022 -0.792 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.033 1.577 -1.559 1.00 0.00 H new ATOM 851 N GLN A 132 6.123 7.193 -2.940 1.00 0.00 N ATOM 852 CA GLN A 132 6.011 8.106 -4.071 1.00 0.00 C ATOM 853 C GLN A 132 6.302 7.385 -5.383 1.00 0.00 C ATOM 854 O GLN A 132 7.150 6.494 -5.439 1.00 0.00 O ATOM 855 CB GLN A 132 6.971 9.284 -3.900 1.00 0.00 C ATOM 856 CG GLN A 132 7.134 10.125 -5.156 1.00 0.00 C ATOM 857 CD GLN A 132 5.915 10.977 -5.450 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.005 11.085 -4.627 1.00 0.00 O ATOM 859 NE2 GLN A 132 5.890 11.589 -6.628 1.00 0.00 N ATOM 0 H GLN A 132 7.081 6.965 -2.675 1.00 0.00 H new ATOM 0 HA GLN A 132 4.988 8.481 -4.102 1.00 0.00 H new ATOM 0 HB2 GLN A 132 6.611 9.920 -3.091 1.00 0.00 H new ATOM 0 HB3 GLN A 132 7.947 8.905 -3.598 1.00 0.00 H new ATOM 0 HG2 GLN A 132 8.006 10.770 -5.046 1.00 0.00 H new ATOM 0 HG3 GLN A 132 7.328 9.469 -6.005 1.00 0.00 H new ATOM 0 HE21 GLN A 132 6.666 11.472 -7.280 1.00 0.00 H new ATOM 0 HE22 GLN A 132 5.095 12.176 -6.881 1.00 0.00 H new ATOM 868 N TYR A 133 5.593 7.776 -6.437 1.00 0.00 N ATOM 869 CA TYR A 133 5.774 7.164 -7.748 1.00 0.00 C ATOM 870 C TYR A 133 6.214 8.202 -8.777 1.00 0.00 C ATOM 871 O TYR A 133 5.768 9.348 -8.748 1.00 0.00 O ATOM 872 CB TYR A 133 4.476 6.496 -8.205 1.00 0.00 C ATOM 873 CG TYR A 133 4.302 5.089 -7.681 1.00 0.00 C ATOM 874 CD1 TYR A 133 3.720 4.855 -6.442 1.00 0.00 C ATOM 875 CD2 TYR A 133 4.720 3.992 -8.426 1.00 0.00 C ATOM 876 CE1 TYR A 133 3.560 3.570 -5.958 1.00 0.00 C ATOM 877 CE2 TYR A 133 4.563 2.705 -7.951 1.00 0.00 C ATOM 878 CZ TYR A 133 3.983 2.499 -6.717 1.00 0.00 C ATOM 879 OH TYR A 133 3.824 1.218 -6.240 1.00 0.00 O ATOM 0 H TYR A 133 4.889 8.513 -6.409 1.00 0.00 H new ATOM 0 HA TYR A 133 6.555 6.408 -7.664 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.631 7.103 -7.880 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.452 6.474 -9.295 1.00 0.00 H new ATOM 0 HD1 TYR A 133 3.387 5.692 -5.846 1.00 0.00 H new ATOM 0 HD2 TYR A 133 5.175 4.149 -9.393 1.00 0.00 H new ATOM 0 HE1 TYR A 133 3.107 3.406 -4.992 1.00 0.00 H new ATOM 0 HE2 TYR A 133 4.893 1.864 -8.543 1.00 0.00 H new ATOM 0 HH TYR A 133 4.188 0.580 -6.889 1.00 0.00 H new ATOM 889 N GLU A 134 7.093 7.789 -9.685 1.00 0.00 N ATOM 890 CA GLU A 134 7.595 8.682 -10.723 1.00 0.00 C ATOM 891 C GLU A 134 6.487 9.049 -11.706 1.00 0.00 C ATOM 892 O GLU A 134 6.591 10.036 -12.435 1.00 0.00 O ATOM 893 CB GLU A 134 8.759 8.028 -11.470 1.00 0.00 C ATOM 894 CG GLU A 134 10.107 8.238 -10.800 1.00 0.00 C ATOM 895 CD GLU A 134 10.712 9.591 -11.119 1.00 0.00 C ATOM 896 OE1 GLU A 134 11.418 9.698 -12.144 1.00 0.00 O ATOM 897 OE2 GLU A 134 10.481 10.543 -10.344 1.00 0.00 O ATOM 0 H GLU A 134 7.472 6.843 -9.723 1.00 0.00 H new ATOM 0 HA GLU A 134 7.948 9.594 -10.243 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.569 6.958 -11.557 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.800 8.428 -12.483 1.00 0.00 H new ATOM 0 HG2 GLU A 134 9.991 8.141 -9.721 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.793 7.453 -11.118 1.00 0.00 H new ATOM 904 N SER A 135 5.428 8.246 -11.722 1.00 0.00 N ATOM 905 CA SER A 135 4.302 8.484 -12.619 1.00 0.00 C ATOM 906 C SER A 135 2.976 8.276 -11.893 1.00 0.00 C ATOM 907 O SER A 135 2.709 7.198 -11.360 1.00 0.00 O ATOM 908 CB SER A 135 4.385 7.554 -13.831 1.00 0.00 C ATOM 909 OG SER A 135 5.461 7.916 -14.679 1.00 0.00 O ATOM 0 H SER A 135 5.326 7.425 -11.125 1.00 0.00 H new ATOM 0 HA SER A 135 4.351 9.518 -12.959 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.513 6.525 -13.495 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.449 7.594 -14.389 1.00 0.00 H new ATOM 0 HG SER A 135 5.493 7.306 -15.445 1.00 0.00 H new ATOM 915 N LEU A 136 2.149 9.315 -11.877 1.00 0.00 N ATOM 916 CA LEU A 136 0.850 9.248 -11.218 1.00 0.00 C ATOM 917 C LEU A 136 0.095 7.987 -11.627 1.00 0.00 C ATOM 918 O LEU A 136 -0.200 7.131 -10.793 1.00 0.00 O ATOM 919 CB LEU A 136 0.019 10.486 -11.558 1.00 0.00 C ATOM 920 CG LEU A 136 -1.196 10.745 -10.667 1.00 0.00 C ATOM 921 CD1 LEU A 136 -2.182 11.672 -11.363 1.00 0.00 C ATOM 922 CD2 LEU A 136 -1.870 9.434 -10.289 1.00 0.00 C ATOM 0 H LEU A 136 2.355 10.214 -12.313 1.00 0.00 H new ATOM 0 HA LEU A 136 1.018 9.215 -10.142 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.670 11.359 -11.513 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.324 10.397 -12.589 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.854 11.232 -9.753 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -3.040 11.845 -10.713 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -1.695 12.623 -11.582 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -2.518 11.214 -12.293 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -2.733 9.638 -9.655 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.197 8.919 -11.192 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -1.163 8.804 -9.749 1.00 0.00 H new ATOM 934 N ASP A 137 -0.211 7.879 -12.915 1.00 0.00 N ATOM 935 CA ASP A 137 -0.928 6.721 -13.436 1.00 0.00 C ATOM 936 C ASP A 137 -0.534 5.454 -12.682 1.00 0.00 C ATOM 937 O ASP A 137 -1.390 4.668 -12.278 1.00 0.00 O ATOM 938 CB ASP A 137 -0.646 6.549 -14.929 1.00 0.00 C ATOM 939 CG ASP A 137 -1.210 7.686 -15.759 1.00 0.00 C ATOM 940 OD1 ASP A 137 -0.564 8.752 -15.820 1.00 0.00 O ATOM 941 OD2 ASP A 137 -2.299 7.510 -16.346 1.00 0.00 O ATOM 0 H ASP A 137 0.026 8.579 -13.618 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.995 6.891 -13.293 1.00 0.00 H new ATOM 0 HB2 ASP A 137 0.431 6.486 -15.088 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -1.074 5.606 -15.271 1.00 0.00 H new ATOM 946 N ALA A 138 0.769 5.262 -12.498 1.00 0.00 N ATOM 947 CA ALA A 138 1.276 4.092 -11.793 1.00 0.00 C ATOM 948 C ALA A 138 0.818 4.086 -10.339 1.00 0.00 C ATOM 949 O ALA A 138 0.382 3.058 -9.820 1.00 0.00 O ATOM 950 CB ALA A 138 2.795 4.046 -11.871 1.00 0.00 C ATOM 0 H ALA A 138 1.492 5.902 -12.828 1.00 0.00 H new ATOM 0 HA ALA A 138 0.872 3.203 -12.277 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.160 3.167 -11.340 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.104 3.994 -12.915 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.210 4.944 -11.414 1.00 0.00 H new ATOM 956 N ALA A 139 0.921 5.239 -9.686 1.00 0.00 N ATOM 957 CA ALA A 139 0.516 5.366 -8.292 1.00 0.00 C ATOM 958 C ALA A 139 -0.918 4.889 -8.091 1.00 0.00 C ATOM 959 O ALA A 139 -1.185 4.037 -7.244 1.00 0.00 O ATOM 960 CB ALA A 139 0.664 6.808 -7.828 1.00 0.00 C ATOM 0 H ALA A 139 1.282 6.098 -10.100 1.00 0.00 H new ATOM 0 HA ALA A 139 1.169 4.733 -7.691 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.358 6.888 -6.785 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.705 7.117 -7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 139 0.035 7.454 -8.441 1.00 0.00 H new ATOM 966 N GLN A 140 -1.837 5.444 -8.875 1.00 0.00 N ATOM 967 CA GLN A 140 -3.245 5.075 -8.781 1.00 0.00 C ATOM 968 C GLN A 140 -3.411 3.559 -8.782 1.00 0.00 C ATOM 969 O GLN A 140 -4.096 3.000 -7.926 1.00 0.00 O ATOM 970 CB GLN A 140 -4.033 5.688 -9.940 1.00 0.00 C ATOM 971 CG GLN A 140 -4.392 7.149 -9.726 1.00 0.00 C ATOM 972 CD GLN A 140 -5.338 7.679 -10.786 1.00 0.00 C ATOM 973 OE1 GLN A 140 -6.524 7.887 -10.528 1.00 0.00 O ATOM 974 NE2 GLN A 140 -4.817 7.900 -11.987 1.00 0.00 N ATOM 0 H GLN A 140 -1.632 6.150 -9.582 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.635 5.464 -7.841 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.448 5.597 -10.855 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -4.949 5.116 -10.089 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.850 7.266 -8.744 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.481 7.747 -9.726 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -3.829 7.714 -12.156 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -5.405 8.256 -12.740 1.00 0.00 H new ATOM 983 N ALA A 141 -2.782 2.901 -9.749 1.00 0.00 N ATOM 984 CA ALA A 141 -2.859 1.449 -9.861 1.00 0.00 C ATOM 985 C ALA A 141 -2.708 0.785 -8.497 1.00 0.00 C ATOM 986 O ALA A 141 -3.580 0.033 -8.062 1.00 0.00 O ATOM 987 CB ALA A 141 -1.796 0.936 -10.821 1.00 0.00 C ATOM 0 H ALA A 141 -2.213 3.350 -10.467 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.842 1.191 -10.255 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -1.865 -0.149 -10.895 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -1.951 1.377 -11.806 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.808 1.212 -10.452 1.00 0.00 H new ATOM 993 N ALA A 142 -1.596 1.067 -7.826 1.00 0.00 N ATOM 994 CA ALA A 142 -1.331 0.497 -6.511 1.00 0.00 C ATOM 995 C ALA A 142 -2.384 0.939 -5.500 1.00 0.00 C ATOM 996 O ALA A 142 -2.920 0.121 -4.751 1.00 0.00 O ATOM 997 CB ALA A 142 0.059 0.892 -6.035 1.00 0.00 C ATOM 0 H ALA A 142 -0.864 1.687 -8.172 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.379 -0.589 -6.596 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.243 0.459 -5.052 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.804 0.522 -6.740 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.127 1.978 -5.972 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.675 2.235 -5.484 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.663 2.785 -4.563 1.00 0.00 C ATOM 1005 C CYS A 143 -4.913 1.912 -4.521 1.00 0.00 C ATOM 1006 O CYS A 143 -5.552 1.775 -3.479 1.00 0.00 O ATOM 1007 CB CYS A 143 -4.035 4.210 -4.974 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.750 5.200 -3.640 1.00 0.00 S ATOM 0 H CYS A 143 -2.241 2.924 -6.098 1.00 0.00 H new ATOM 0 HA CYS A 143 -3.223 2.805 -3.566 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -3.143 4.713 -5.348 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.745 4.165 -5.799 1.00 0.00 H new ATOM 0 HG CYS A 143 -5.264 6.287 -4.134 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.256 1.325 -5.663 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.430 0.465 -5.757 1.00 0.00 C ATOM 1016 C ALA A 144 -6.070 -0.989 -5.467 1.00 0.00 C ATOM 1017 O ALA A 144 -6.497 -1.556 -4.461 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.065 0.588 -7.134 1.00 0.00 C ATOM 0 H ALA A 144 -4.738 1.429 -6.536 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.150 0.791 -5.006 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -7.940 -0.059 -7.190 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.366 1.621 -7.305 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.344 0.290 -7.895 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.282 -1.587 -6.354 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.863 -2.974 -6.193 1.00 0.00 C ATOM 1026 C LYS A 145 -4.456 -3.256 -4.751 1.00 0.00 C ATOM 1027 O LYS A 145 -4.979 -4.171 -4.116 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.698 -3.289 -7.134 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.138 -3.729 -8.520 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.318 -2.541 -9.451 1.00 0.00 C ATOM 1031 CE LYS A 145 -4.339 -2.974 -10.909 1.00 0.00 C ATOM 1032 NZ LYS A 145 -5.453 -3.921 -11.191 1.00 0.00 N ATOM 0 H LYS A 145 -4.920 -1.132 -7.192 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.709 -3.614 -6.445 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.067 -2.405 -7.226 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -3.085 -4.074 -6.690 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.398 -4.411 -8.938 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -5.075 -4.281 -8.447 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.248 -2.026 -9.210 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.509 -1.828 -9.294 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.439 -2.096 -11.547 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -3.389 -3.445 -11.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -5.495 -4.113 -12.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -5.290 -4.811 -10.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -6.352 -3.502 -10.880 1.00 0.00 H new ATOM 1046 N MET A 146 -3.520 -2.463 -4.239 1.00 0.00 N ATOM 1047 CA MET A 146 -3.045 -2.627 -2.870 1.00 0.00 C ATOM 1048 C MET A 146 -4.199 -2.524 -1.878 1.00 0.00 C ATOM 1049 O MET A 146 -4.221 -3.221 -0.864 1.00 0.00 O ATOM 1050 CB MET A 146 -1.984 -1.573 -2.546 1.00 0.00 C ATOM 1051 CG MET A 146 -0.726 -1.698 -3.390 1.00 0.00 C ATOM 1052 SD MET A 146 -0.024 -3.358 -3.348 1.00 0.00 S ATOM 1053 CE MET A 146 0.638 -3.404 -1.684 1.00 0.00 C ATOM 0 H MET A 146 -3.076 -1.701 -4.751 1.00 0.00 H new ATOM 0 HA MET A 146 -2.601 -3.619 -2.783 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.412 -0.581 -2.692 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.715 -1.652 -1.493 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.957 -1.431 -4.421 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.017 -0.984 -3.035 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.711 -3.590 -1.724 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.454 -2.449 -1.193 1.00 0.00 H new ATOM 0 HE3 MET A 146 0.152 -4.201 -1.121 1.00 0.00 H new ATOM 1063 N ARG A 147 -5.155 -1.651 -2.178 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.312 -1.457 -1.311 1.00 0.00 C ATOM 1065 C ARG A 147 -6.968 -2.793 -0.974 1.00 0.00 C ATOM 1066 O ARG A 147 -7.651 -3.389 -1.806 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.329 -0.532 -1.982 1.00 0.00 C ATOM 1068 CG ARG A 147 -8.221 0.207 -0.998 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.564 0.558 -1.620 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.280 -0.628 -2.082 1.00 0.00 N ATOM 1071 CZ ARG A 147 -11.362 -0.580 -2.852 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -11.850 0.589 -3.243 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -11.957 -1.704 -3.232 1.00 0.00 N ATOM 0 H ARG A 147 -5.152 -1.067 -3.014 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.968 -0.997 -0.385 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.797 0.196 -2.595 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.953 -1.120 -2.655 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -8.378 -0.410 -0.113 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -7.723 1.118 -0.667 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -10.175 1.088 -0.889 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.409 1.237 -2.458 1.00 0.00 H new ATOM 0 HE ARG A 147 -9.930 -1.543 -1.798 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.395 1.454 -2.953 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -12.681 0.623 -3.834 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.584 -2.605 -2.933 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.787 -1.667 -3.823 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.756 -3.257 0.254 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.333 -4.519 0.680 1.00 0.00 C ATOM 1089 C GLY A 148 -6.402 -5.691 0.444 1.00 0.00 C ATOM 1090 O GLY A 148 -6.851 -6.811 0.201 1.00 0.00 O ATOM 0 H GLY A 148 -6.195 -2.782 0.961 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.580 -4.463 1.740 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.267 -4.687 0.144 1.00 0.00 H new ATOM 1094 N PHE A 149 -5.100 -5.434 0.513 1.00 0.00 N ATOM 1095 CA PHE A 149 -4.102 -6.477 0.302 1.00 0.00 C ATOM 1096 C PHE A 149 -4.044 -7.423 1.498 1.00 0.00 C ATOM 1097 O PHE A 149 -4.142 -7.011 2.654 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.726 -5.854 0.062 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.849 -6.668 -0.846 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -2.083 -6.698 -2.212 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.792 -7.403 -0.335 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -1.279 -7.448 -3.049 1.00 0.00 C ATOM 1103 CE2 PHE A 149 0.016 -8.153 -1.168 1.00 0.00 C ATOM 1104 CZ PHE A 149 -0.227 -8.175 -2.527 1.00 0.00 C ATOM 0 H PHE A 149 -4.711 -4.513 0.713 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.392 -7.050 -0.579 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.856 -4.860 -0.367 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.223 -5.725 1.020 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.902 -6.129 -2.626 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.597 -7.390 0.727 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -1.473 -7.466 -4.111 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.837 -8.721 -0.756 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.404 -8.759 -3.180 1.00 0.00 H new ATOM 1114 N PRO A 150 -3.880 -8.724 1.215 1.00 0.00 N ATOM 1115 CA PRO A 150 -3.804 -9.756 2.252 1.00 0.00 C ATOM 1116 C PRO A 150 -2.516 -9.670 3.064 1.00 0.00 C ATOM 1117 O PRO A 150 -2.247 -10.520 3.913 1.00 0.00 O ATOM 1118 CB PRO A 150 -3.848 -11.063 1.457 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.321 -10.704 0.110 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.755 -9.287 -0.140 1.00 0.00 C ATOM 0 HA PRO A 150 -4.607 -9.658 2.982 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.238 -11.834 1.928 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -4.863 -11.454 1.394 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.235 -10.790 0.080 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -3.715 -11.374 -0.654 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.023 -8.742 -0.736 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.700 -9.246 -0.681 1.00 0.00 H new ATOM 1128 N LEU A 151 -1.723 -8.638 2.797 1.00 0.00 N ATOM 1129 CA LEU A 151 -0.462 -8.440 3.503 1.00 0.00 C ATOM 1130 C LEU A 151 -0.563 -8.925 4.946 1.00 0.00 C ATOM 1131 O LEU A 151 -1.051 -8.209 5.819 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.066 -6.963 3.476 1.00 0.00 C ATOM 1133 CG LEU A 151 1.426 -6.664 3.635 1.00 0.00 C ATOM 1134 CD1 LEU A 151 1.957 -7.270 4.925 1.00 0.00 C ATOM 1135 CD2 LEU A 151 2.205 -7.187 2.437 1.00 0.00 C ATOM 0 H LEU A 151 -1.931 -7.926 2.097 1.00 0.00 H new ATOM 0 HA LEU A 151 0.305 -9.025 2.996 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.403 -6.534 2.532 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -0.606 -6.448 4.271 1.00 0.00 H new ATOM 0 HG LEU A 151 1.558 -5.583 3.685 1.00 0.00 H new ATOM 0 HD11 LEU A 151 3.020 -7.047 5.021 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.419 -6.847 5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 151 1.813 -8.350 4.906 1.00 0.00 H new ATOM 0 HD21 LEU A 151 3.264 -6.966 2.567 1.00 0.00 H new ATOM 0 HD22 LEU A 151 2.067 -8.265 2.356 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.842 -6.705 1.529 1.00 0.00 H new ATOM 1147 N GLY A 152 -0.097 -10.146 5.189 1.00 0.00 N ATOM 1148 CA GLY A 152 -0.143 -10.705 6.527 1.00 0.00 C ATOM 1149 C GLY A 152 -1.184 -11.798 6.664 1.00 0.00 C ATOM 1150 O GLY A 152 -1.143 -12.797 5.949 1.00 0.00 O ATOM 0 H GLY A 152 0.312 -10.758 4.483 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.837 -11.107 6.783 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.358 -9.911 7.242 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.122 -11.608 7.588 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.164 -12.595 7.801 1.00 0.00 C ATOM 1156 C GLY A 153 -4.479 -12.195 7.162 1.00 0.00 C ATOM 1157 O GLY A 153 -4.593 -11.147 6.527 1.00 0.00 O ATOM 0 H GLY A 153 -2.178 -10.788 8.192 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.842 -13.553 7.393 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.312 -12.738 8.871 1.00 0.00 H new ATOM 1161 N PRO A 154 -5.504 -13.045 7.327 1.00 0.00 N ATOM 1162 CA PRO A 154 -6.836 -12.798 6.767 1.00 0.00 C ATOM 1163 C PRO A 154 -7.552 -11.646 7.464 1.00 0.00 C ATOM 1164 O PRO A 154 -8.590 -11.175 6.999 1.00 0.00 O ATOM 1165 CB PRO A 154 -7.575 -14.115 7.014 1.00 0.00 C ATOM 1166 CG PRO A 154 -6.883 -14.724 8.184 1.00 0.00 C ATOM 1167 CD PRO A 154 -5.440 -14.314 8.072 1.00 0.00 C ATOM 0 HA PRO A 154 -6.790 -12.511 5.717 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -8.631 -13.943 7.224 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -7.525 -14.766 6.142 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -7.317 -14.373 9.120 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -6.982 -15.809 8.174 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -4.982 -14.182 9.052 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -4.849 -15.062 7.543 1.00 0.00 H new ATOM 1175 N ASP A 155 -6.992 -11.197 8.582 1.00 0.00 N ATOM 1176 CA ASP A 155 -7.576 -10.098 9.342 1.00 0.00 C ATOM 1177 C ASP A 155 -6.799 -8.806 9.115 1.00 0.00 C ATOM 1178 O ASP A 155 -7.377 -7.719 9.089 1.00 0.00 O ATOM 1179 CB ASP A 155 -7.600 -10.438 10.834 1.00 0.00 C ATOM 1180 CG ASP A 155 -8.795 -11.290 11.214 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -9.932 -10.778 11.155 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -8.593 -12.470 11.571 1.00 0.00 O ATOM 0 H ASP A 155 -6.134 -11.577 8.982 1.00 0.00 H new ATOM 0 HA ASP A 155 -8.598 -9.951 8.994 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -6.683 -10.965 11.099 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -7.616 -9.515 11.414 1.00 0.00 H new ATOM 1187 N ARG A 156 -5.486 -8.931 8.953 1.00 0.00 N ATOM 1188 CA ARG A 156 -4.630 -7.773 8.730 1.00 0.00 C ATOM 1189 C ARG A 156 -4.627 -7.374 7.257 1.00 0.00 C ATOM 1190 O ARG A 156 -4.157 -8.124 6.401 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.202 -8.071 9.191 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.103 -8.457 10.658 1.00 0.00 C ATOM 1193 CD ARG A 156 -3.102 -7.231 11.557 1.00 0.00 C ATOM 1194 NE ARG A 156 -4.455 -6.805 11.905 1.00 0.00 N ATOM 1195 CZ ARG A 156 -4.719 -5.819 12.755 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -3.728 -5.160 13.340 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -5.977 -5.490 13.021 1.00 0.00 N ATOM 0 H ARG A 156 -4.992 -9.823 8.972 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.027 -6.942 9.313 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -2.794 -8.879 8.583 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -2.581 -7.193 9.012 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.940 -9.103 10.923 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -2.192 -9.032 10.824 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -2.546 -7.450 12.468 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -2.583 -6.414 11.055 1.00 0.00 H new ATOM 0 HE ARG A 156 -5.240 -7.291 11.472 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -2.760 -5.410 13.138 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -3.934 -4.403 13.992 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -6.742 -5.994 12.573 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -6.179 -4.733 13.674 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.155 -6.188 6.970 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.215 -5.690 5.601 1.00 0.00 C ATOM 1213 C ARG A 157 -4.562 -4.315 5.493 1.00 0.00 C ATOM 1214 O ARG A 157 -4.641 -3.504 6.417 1.00 0.00 O ATOM 1215 CB ARG A 157 -6.668 -5.615 5.127 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.174 -6.908 4.509 1.00 0.00 C ATOM 1217 CD ARG A 157 -8.483 -6.695 3.765 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.096 -7.958 3.363 1.00 0.00 N ATOM 1219 CZ ARG A 157 -9.737 -8.764 4.202 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -9.849 -8.440 5.482 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -10.269 -9.897 3.760 1.00 0.00 N ATOM 0 H ARG A 157 -5.547 -5.555 7.667 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.667 -6.384 4.964 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.304 -5.353 5.972 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -6.762 -4.812 4.396 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -6.424 -7.302 3.823 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -7.316 -7.655 5.290 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -9.175 -6.142 4.400 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -8.302 -6.082 2.882 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.028 -8.237 2.384 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -9.442 -7.570 5.825 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -10.342 -9.061 6.124 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -10.186 -10.149 2.775 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -10.761 -10.515 4.405 1.00 0.00 H new ATOM 1235 N LEU A 158 -3.916 -4.060 4.361 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.248 -2.784 4.132 1.00 0.00 C ATOM 1237 C LEU A 158 -4.263 -1.681 3.850 1.00 0.00 C ATOM 1238 O LEU A 158 -5.301 -1.922 3.234 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.268 -2.901 2.964 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.175 -3.961 3.108 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.261 -3.954 1.892 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.374 -3.732 4.381 1.00 0.00 C ATOM 0 H LEU A 158 -3.841 -4.720 3.587 1.00 0.00 H new ATOM 0 HA LEU A 158 -2.697 -2.523 5.036 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -2.837 -3.115 2.059 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.790 -1.932 2.819 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.651 -4.939 3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.510 -4.715 2.012 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -0.845 -4.168 0.997 1.00 0.00 H new ATOM 0 HD13 LEU A 158 0.207 -2.975 1.794 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.399 -4.496 4.467 1.00 0.00 H new ATOM 0 HD22 LEU A 158 0.091 -2.747 4.346 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.038 -3.789 5.244 1.00 0.00 H new ATOM 1254 N ARG A 159 -3.955 -0.470 4.304 1.00 0.00 N ATOM 1255 CA ARG A 159 -4.840 0.670 4.100 1.00 0.00 C ATOM 1256 C ARG A 159 -4.154 1.749 3.268 1.00 0.00 C ATOM 1257 O ARG A 159 -3.216 2.401 3.729 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.278 1.251 5.446 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.452 0.517 6.074 1.00 0.00 C ATOM 1260 CD ARG A 159 -6.009 -0.778 6.738 1.00 0.00 C ATOM 1261 NE ARG A 159 -6.898 -1.165 7.830 1.00 0.00 N ATOM 1262 CZ ARG A 159 -6.919 -0.557 9.011 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -6.104 0.462 9.250 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -7.757 -0.967 9.954 1.00 0.00 N ATOM 0 H ARG A 159 -3.099 -0.254 4.815 1.00 0.00 H new ATOM 0 HA ARG A 159 -5.720 0.322 3.559 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -4.434 1.225 6.135 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -5.546 2.299 5.310 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -6.932 1.160 6.812 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -7.197 0.299 5.309 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -5.980 -1.575 5.995 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -4.995 -0.661 7.120 1.00 0.00 H new ATOM 0 HE ARG A 159 -7.538 -1.945 7.678 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -5.460 0.780 8.526 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -6.122 0.927 10.157 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -8.386 -1.749 9.773 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -7.773 -0.500 10.861 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.626 1.932 2.039 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.059 2.932 1.143 1.00 0.00 C ATOM 1280 C VAL A 160 -5.087 4.002 0.792 1.00 0.00 C ATOM 1281 O VAL A 160 -6.193 3.693 0.348 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.539 2.290 -0.157 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -2.647 3.263 -0.914 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.794 0.999 0.148 1.00 0.00 C ATOM 0 H VAL A 160 -5.400 1.400 1.641 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.225 3.393 1.671 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.393 2.050 -0.790 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.289 2.792 -1.829 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.216 4.158 -1.165 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -1.796 3.537 -0.290 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.433 0.559 -0.782 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.947 1.213 0.800 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.467 0.299 0.644 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.714 5.261 0.993 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.603 6.378 0.696 1.00 0.00 C ATOM 1296 C ASP A 161 -4.836 7.525 0.044 1.00 0.00 C ATOM 1297 O ASP A 161 -3.753 7.897 0.497 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.286 6.867 1.974 1.00 0.00 C ATOM 1299 CG ASP A 161 -7.300 7.962 1.706 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -8.029 7.862 0.697 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -7.365 8.919 2.506 1.00 0.00 O ATOM 0 H ASP A 161 -3.802 5.534 1.360 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.363 6.029 -0.003 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -6.782 6.028 2.461 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -5.531 7.237 2.667 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.403 8.079 -1.021 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.772 9.182 -1.737 1.00 0.00 C ATOM 1308 C PHE A 162 -4.493 10.352 -0.798 1.00 0.00 C ATOM 1309 O PHE A 162 -5.387 10.826 -0.097 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.662 9.643 -2.894 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.677 8.691 -4.055 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.566 8.559 -4.873 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.800 7.928 -4.329 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.577 7.684 -5.943 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.817 7.051 -5.397 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.704 6.928 -6.205 1.00 0.00 C ATOM 0 H PHE A 162 -6.299 7.783 -1.408 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.823 8.826 -2.137 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.681 9.774 -2.529 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.319 10.619 -3.239 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.682 9.146 -4.672 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.673 8.020 -3.700 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.705 7.591 -6.574 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.700 6.463 -5.599 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.714 6.243 -7.040 1.00 0.00 H new ATOM 1326 N ALA A 163 -3.246 10.811 -0.789 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.849 11.926 0.062 1.00 0.00 C ATOM 1328 C ALA A 163 -2.702 13.210 -0.747 1.00 0.00 C ATOM 1329 O ALA A 163 -2.228 13.190 -1.883 1.00 0.00 O ATOM 1330 CB ALA A 163 -1.548 11.602 0.783 1.00 0.00 C ATOM 0 H ALA A 163 -2.493 10.428 -1.361 1.00 0.00 H new ATOM 0 HA ALA A 163 -3.633 12.083 0.802 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -1.263 12.443 1.415 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -1.686 10.714 1.400 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.763 11.416 0.050 1.00 0.00 H new