USER MOD reduce.3.24.130724 H: found=0, std=0, add=593, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 594 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 : A 220 SER OG : rot 180:sc= 0 USER MOD Single : A 221 LYS NZ :NH3+ 141:sc= -1.29 (180deg=-3.24!) USER MOD Single : A 222 THR OG1 : rot 180:sc= 0 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 228 ASN : amide:sc= -1.2 K(o=-1.2,f=-0.48) USER MOD Single : A 233 THR OG1 : rot -65:sc= 0.882 USER MOD Single : A 239 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 241 THR OG1 : rot 72:sc= 1.15 USER MOD Single : A 243 SER OG : rot 180:sc= 0 USER MOD Single : A 247 SER OG : rot 180:sc= 0 USER MOD Single : A 259 THR OG1 : rot 42:sc= 0.0859 USER MOD Single : A 272 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 276 HIS : no HE2:sc= -3.07! C(o=-3.1!,f=-5!) USER MOD Single : A 279 TYR OH : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 97:sc= 1.17 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 283 HIS : no HD1:sc= -13.2! C(o=-13!,f=-14!) USER MOD Single : A 284 HIS : no HD1:sc= -3.08! C(o=-3.1!,f=-4.4!) USER MOD Single : A 288 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 90 N SER A 220 -9.292 14.717 -0.855 1.00 0.00 N ATOM 91 CA SER A 220 -8.156 14.737 -1.769 1.00 0.00 C ATOM 92 C SER A 220 -8.310 13.671 -2.850 1.00 0.00 C ATOM 93 O SER A 220 -9.096 12.734 -2.708 1.00 0.00 O ATOM 94 CB SER A 220 -6.852 14.515 -1.000 1.00 0.00 C ATOM 95 OG SER A 220 -6.449 15.695 -0.327 1.00 0.00 O ATOM 0 HA SER A 220 -8.124 15.715 -2.249 1.00 0.00 H new ATOM 0 HB2 SER A 220 -6.984 13.709 -0.279 1.00 0.00 H new ATOM 0 HB3 SER A 220 -6.069 14.200 -1.690 1.00 0.00 H new ATOM 0 HG SER A 220 -5.614 15.526 0.158 1.00 0.00 H new ATOM 101 N LYS A 221 -7.554 13.822 -3.932 1.00 0.00 N ATOM 102 CA LYS A 221 -7.603 12.874 -5.038 1.00 0.00 C ATOM 103 C LYS A 221 -6.305 12.079 -5.132 1.00 0.00 C ATOM 104 O LYS A 221 -6.266 11.000 -5.725 1.00 0.00 O ATOM 105 CB LYS A 221 -7.860 13.609 -6.356 1.00 0.00 C ATOM 106 CG LYS A 221 -9.179 14.360 -6.386 1.00 0.00 C ATOM 107 CD LYS A 221 -9.181 15.441 -7.454 1.00 0.00 C ATOM 108 CE LYS A 221 -8.438 16.685 -6.989 1.00 0.00 C ATOM 109 NZ LYS A 221 -6.967 16.554 -7.176 1.00 0.00 N ATOM 0 H LYS A 221 -6.900 14.593 -4.066 1.00 0.00 H new ATOM 0 HA LYS A 221 -8.421 12.179 -4.851 1.00 0.00 H new ATOM 0 HB2 LYS A 221 -7.047 14.313 -6.535 1.00 0.00 H new ATOM 0 HB3 LYS A 221 -7.843 12.888 -7.174 1.00 0.00 H new ATOM 0 HG2 LYS A 221 -9.993 13.660 -6.574 1.00 0.00 H new ATOM 0 HG3 LYS A 221 -9.365 14.810 -5.411 1.00 0.00 H new ATOM 0 HD2 LYS A 221 -8.717 15.057 -8.363 1.00 0.00 H new ATOM 0 HD3 LYS A 221 -10.209 15.703 -7.707 1.00 0.00 H new ATOM 0 HE2 LYS A 221 -8.799 17.552 -7.543 1.00 0.00 H new ATOM 0 HE3 LYS A 221 -8.656 16.866 -5.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 221 -6.575 17.463 -7.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 221 -6.525 16.285 -6.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 221 -6.771 15.823 -7.889 1.00 0.00 H new ATOM 123 N THR A 222 -5.242 12.617 -4.542 1.00 0.00 N ATOM 124 CA THR A 222 -3.942 11.958 -4.559 1.00 0.00 C ATOM 125 C THR A 222 -3.742 11.105 -3.312 1.00 0.00 C ATOM 126 O THR A 222 -3.038 10.096 -3.344 1.00 0.00 O ATOM 127 CB THR A 222 -2.795 12.981 -4.656 1.00 0.00 C ATOM 128 OG1 THR A 222 -2.878 13.915 -3.574 1.00 0.00 O ATOM 129 CG2 THR A 222 -2.846 13.727 -5.981 1.00 0.00 C ATOM 0 H THR A 222 -5.256 13.508 -4.046 1.00 0.00 H new ATOM 0 HA THR A 222 -3.924 11.318 -5.441 1.00 0.00 H new ATOM 0 HB THR A 222 -1.850 12.441 -4.597 1.00 0.00 H new ATOM 0 HG1 THR A 222 -2.144 14.561 -3.642 1.00 0.00 H new ATOM 0 HG21 THR A 222 -2.026 14.444 -6.027 1.00 0.00 H new ATOM 0 HG22 THR A 222 -2.753 13.017 -6.802 1.00 0.00 H new ATOM 0 HG23 THR A 222 -3.796 14.256 -6.065 1.00 0.00 H new ATOM 137 N VAL A 223 -4.367 11.516 -2.213 1.00 0.00 N ATOM 138 CA VAL A 223 -4.259 10.787 -0.954 1.00 0.00 C ATOM 139 C VAL A 223 -5.394 9.780 -0.803 1.00 0.00 C ATOM 140 O VAL A 223 -6.558 10.157 -0.672 1.00 0.00 O ATOM 141 CB VAL A 223 -4.274 11.745 0.252 1.00 0.00 C ATOM 142 CG1 VAL A 223 -4.175 10.966 1.554 1.00 0.00 C ATOM 143 CG2 VAL A 223 -3.146 12.759 0.140 1.00 0.00 C ATOM 0 H VAL A 223 -4.953 12.350 -2.169 1.00 0.00 H new ATOM 0 HA VAL A 223 -3.307 10.257 -0.976 1.00 0.00 H new ATOM 0 HB VAL A 223 -5.220 12.287 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 223 -4.187 11.660 2.395 1.00 0.00 H new ATOM 0 HG12 VAL A 223 -5.021 10.283 1.635 1.00 0.00 H new ATOM 0 HG13 VAL A 223 -3.246 10.396 1.567 1.00 0.00 H new ATOM 0 HG21 VAL A 223 -3.171 13.428 1.000 1.00 0.00 H new ATOM 0 HG22 VAL A 223 -2.189 12.237 0.114 1.00 0.00 H new ATOM 0 HG23 VAL A 223 -3.268 13.339 -0.775 1.00 0.00 H new ATOM 153 N ILE A 224 -5.045 8.498 -0.823 1.00 0.00 N ATOM 154 CA ILE A 224 -6.034 7.436 -0.687 1.00 0.00 C ATOM 155 C ILE A 224 -5.789 6.615 0.575 1.00 0.00 C ATOM 156 O ILE A 224 -4.647 6.300 0.912 1.00 0.00 O ATOM 157 CB ILE A 224 -6.023 6.496 -1.907 1.00 0.00 C ATOM 158 CG1 ILE A 224 -6.311 7.284 -3.187 1.00 0.00 C ATOM 159 CG2 ILE A 224 -7.041 5.380 -1.726 1.00 0.00 C ATOM 160 CD1 ILE A 224 -5.765 6.628 -4.436 1.00 0.00 C ATOM 0 H ILE A 224 -4.085 8.170 -0.932 1.00 0.00 H new ATOM 0 HA ILE A 224 -7.009 7.920 -0.620 1.00 0.00 H new ATOM 0 HB ILE A 224 -5.033 6.048 -1.993 1.00 0.00 H new ATOM 0 HG12 ILE A 224 -7.389 7.408 -3.293 1.00 0.00 H new ATOM 0 HG13 ILE A 224 -5.883 8.282 -3.094 1.00 0.00 H new ATOM 0 HG21 ILE A 224 -7.021 4.724 -2.597 1.00 0.00 H new ATOM 0 HG22 ILE A 224 -6.796 4.805 -0.833 1.00 0.00 H new ATOM 0 HG23 ILE A 224 -8.037 5.810 -1.618 1.00 0.00 H new ATOM 0 HD11 ILE A 224 -6.006 7.241 -5.304 1.00 0.00 H new ATOM 0 HD12 ILE A 224 -4.683 6.528 -4.351 1.00 0.00 H new ATOM 0 HD13 ILE A 224 -6.212 5.641 -4.554 1.00 0.00 H new ATOM 172 N LEU A 225 -6.868 6.270 1.268 1.00 0.00 N ATOM 173 CA LEU A 225 -6.772 5.483 2.493 1.00 0.00 C ATOM 174 C LEU A 225 -7.325 4.077 2.282 1.00 0.00 C ATOM 175 O LEU A 225 -8.475 3.907 1.878 1.00 0.00 O ATOM 176 CB LEU A 225 -7.527 6.176 3.628 1.00 0.00 C ATOM 177 CG LEU A 225 -7.240 7.666 3.814 1.00 0.00 C ATOM 178 CD1 LEU A 225 -8.359 8.332 4.599 1.00 0.00 C ATOM 179 CD2 LEU A 225 -5.903 7.869 4.512 1.00 0.00 C ATOM 0 H LEU A 225 -7.820 6.523 1.003 1.00 0.00 H new ATOM 0 HA LEU A 225 -5.719 5.402 2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 225 -8.596 6.051 3.456 1.00 0.00 H new ATOM 0 HB3 LEU A 225 -7.292 5.662 4.560 1.00 0.00 H new ATOM 0 HG LEU A 225 -7.188 8.131 2.830 1.00 0.00 H new ATOM 0 HD11 LEU A 225 -8.137 9.392 4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 225 -9.299 8.218 4.060 1.00 0.00 H new ATOM 0 HD13 LEU A 225 -8.444 7.864 5.580 1.00 0.00 H new ATOM 0 HD21 LEU A 225 -5.715 8.936 4.636 1.00 0.00 H new ATOM 0 HD22 LEU A 225 -5.927 7.389 5.490 1.00 0.00 H new ATOM 0 HD23 LEU A 225 -5.108 7.428 3.911 1.00 0.00 H new ATOM 191 N ALA A 226 -6.500 3.074 2.560 1.00 0.00 N ATOM 192 CA ALA A 226 -6.908 1.683 2.405 1.00 0.00 C ATOM 193 C ALA A 226 -7.161 1.031 3.760 1.00 0.00 C ATOM 194 O ALA A 226 -6.353 1.155 4.681 1.00 0.00 O ATOM 195 CB ALA A 226 -5.853 0.906 1.632 1.00 0.00 C ATOM 0 H ALA A 226 -5.544 3.198 2.894 1.00 0.00 H new ATOM 0 HA ALA A 226 -7.841 1.665 1.842 1.00 0.00 H new ATOM 0 HB1 ALA A 226 -6.171 -0.131 1.524 1.00 0.00 H new ATOM 0 HB2 ALA A 226 -5.724 1.351 0.645 1.00 0.00 H new ATOM 0 HB3 ALA A 226 -4.907 0.941 2.172 1.00 0.00 H new ATOM 201 N LYS A 227 -8.288 0.336 3.876 1.00 0.00 N ATOM 202 CA LYS A 227 -8.648 -0.337 5.118 1.00 0.00 C ATOM 203 C LYS A 227 -8.933 -1.815 4.873 1.00 0.00 C ATOM 204 O LYS A 227 -9.111 -2.242 3.733 1.00 0.00 O ATOM 205 CB LYS A 227 -9.872 0.332 5.748 1.00 0.00 C ATOM 206 CG LYS A 227 -9.667 1.804 6.061 1.00 0.00 C ATOM 207 CD LYS A 227 -10.957 2.461 6.522 1.00 0.00 C ATOM 208 CE LYS A 227 -10.703 3.843 7.103 1.00 0.00 C ATOM 209 NZ LYS A 227 -11.848 4.318 7.927 1.00 0.00 N ATOM 0 H LYS A 227 -8.968 0.224 3.124 1.00 0.00 H new ATOM 0 HA LYS A 227 -7.804 -0.257 5.804 1.00 0.00 H new ATOM 0 HB2 LYS A 227 -10.721 0.228 5.072 1.00 0.00 H new ATOM 0 HB3 LYS A 227 -10.130 -0.194 6.667 1.00 0.00 H new ATOM 0 HG2 LYS A 227 -8.907 1.910 6.835 1.00 0.00 H new ATOM 0 HG3 LYS A 227 -9.293 2.317 5.175 1.00 0.00 H new ATOM 0 HD2 LYS A 227 -11.647 2.540 5.682 1.00 0.00 H new ATOM 0 HD3 LYS A 227 -11.438 1.833 7.272 1.00 0.00 H new ATOM 0 HE2 LYS A 227 -9.801 3.820 7.714 1.00 0.00 H new ATOM 0 HE3 LYS A 227 -10.521 4.549 6.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 -11.635 5.263 8.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 -12.704 4.365 7.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 -12.006 3.658 8.715 1.00 0.00 H new ATOM 223 N ASN A 228 -8.974 -2.592 5.951 1.00 0.00 N ATOM 224 CA ASN A 228 -9.239 -4.022 5.853 1.00 0.00 C ATOM 225 C ASN A 228 -8.047 -4.755 5.245 1.00 0.00 C ATOM 226 O ASN A 228 -8.190 -5.499 4.273 1.00 0.00 O ATOM 227 CB ASN A 228 -10.490 -4.274 5.010 1.00 0.00 C ATOM 228 CG ASN A 228 -11.227 -5.532 5.429 1.00 0.00 C ATOM 229 OD1 ASN A 228 -12.401 -5.483 5.797 1.00 0.00 O ATOM 230 ND2 ASN A 228 -10.538 -6.666 5.376 1.00 0.00 N ATOM 0 H ASN A 228 -8.827 -2.255 6.902 1.00 0.00 H new ATOM 0 HA ASN A 228 -9.405 -4.405 6.860 1.00 0.00 H new ATOM 0 HB2 ASN A 228 -11.160 -3.419 5.095 1.00 0.00 H new ATOM 0 HB3 ASN A 228 -10.207 -4.355 3.960 1.00 0.00 H new ATOM 0 HD21 ASN A 228 -10.980 -7.544 5.647 1.00 0.00 H new ATOM 0 HD22 ASN A 228 -9.567 -6.659 5.064 1.00 0.00 H new ATOM 237 N LEU A 229 -6.870 -4.541 5.824 1.00 0.00 N ATOM 238 CA LEU A 229 -5.652 -5.182 5.340 1.00 0.00 C ATOM 239 C LEU A 229 -5.128 -6.193 6.356 1.00 0.00 C ATOM 240 O LEU A 229 -5.095 -5.940 7.560 1.00 0.00 O ATOM 241 CB LEU A 229 -4.579 -4.130 5.051 1.00 0.00 C ATOM 242 CG LEU A 229 -4.831 -3.231 3.840 1.00 0.00 C ATOM 243 CD1 LEU A 229 -3.915 -2.017 3.878 1.00 0.00 C ATOM 244 CD2 LEU A 229 -4.634 -4.010 2.548 1.00 0.00 C ATOM 0 H LEU A 229 -6.734 -3.929 6.629 1.00 0.00 H new ATOM 0 HA LEU A 229 -5.891 -5.712 4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 229 -4.472 -3.497 5.932 1.00 0.00 H new ATOM 0 HB3 LEU A 229 -3.627 -4.641 4.908 1.00 0.00 H new ATOM 0 HG LEU A 229 -5.863 -2.883 3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 229 -4.108 -1.388 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 229 -4.104 -1.447 4.787 1.00 0.00 H new ATOM 0 HD13 LEU A 229 -2.876 -2.345 3.865 1.00 0.00 H new ATOM 0 HD21 LEU A 229 -4.817 -3.355 1.696 1.00 0.00 H new ATOM 0 HD22 LEU A 229 -3.612 -4.387 2.502 1.00 0.00 H new ATOM 0 HD23 LEU A 229 -5.331 -4.847 2.518 1.00 0.00 H new ATOM 256 N PRO A 230 -4.707 -7.366 5.860 1.00 0.00 N ATOM 257 CA PRO A 230 -4.174 -8.437 6.706 1.00 0.00 C ATOM 258 C PRO A 230 -2.813 -8.086 7.298 1.00 0.00 C ATOM 259 O PRO A 230 -1.922 -7.616 6.592 1.00 0.00 O ATOM 260 CB PRO A 230 -4.050 -9.621 5.744 1.00 0.00 C ATOM 261 CG PRO A 230 -3.905 -9.001 4.397 1.00 0.00 C ATOM 262 CD PRO A 230 -4.717 -7.736 4.435 1.00 0.00 C ATOM 0 HA PRO A 230 -4.815 -8.634 7.565 1.00 0.00 H new ATOM 0 HB2 PRO A 230 -3.188 -10.242 5.989 1.00 0.00 H new ATOM 0 HB3 PRO A 230 -4.929 -10.264 5.792 1.00 0.00 H new ATOM 0 HG2 PRO A 230 -2.859 -8.787 4.176 1.00 0.00 H new ATOM 0 HG3 PRO A 230 -4.265 -9.673 3.617 1.00 0.00 H new ATOM 0 HD2 PRO A 230 -4.275 -6.956 3.814 1.00 0.00 H new ATOM 0 HD3 PRO A 230 -5.731 -7.898 4.069 1.00 0.00 H new ATOM 270 N ALA A 231 -2.660 -8.319 8.598 1.00 0.00 N ATOM 271 CA ALA A 231 -1.407 -8.030 9.283 1.00 0.00 C ATOM 272 C ALA A 231 -0.209 -8.440 8.434 1.00 0.00 C ATOM 273 O ALA A 231 0.842 -7.801 8.475 1.00 0.00 O ATOM 274 CB ALA A 231 -1.368 -8.735 10.631 1.00 0.00 C ATOM 0 H ALA A 231 -3.389 -8.707 9.197 1.00 0.00 H new ATOM 0 HA ALA A 231 -1.351 -6.954 9.446 1.00 0.00 H new ATOM 0 HB1 ALA A 231 -0.426 -8.510 11.132 1.00 0.00 H new ATOM 0 HB2 ALA A 231 -2.198 -8.389 11.247 1.00 0.00 H new ATOM 0 HB3 ALA A 231 -1.452 -9.811 10.481 1.00 0.00 H new ATOM 280 N GLY A 232 -0.374 -9.511 7.664 1.00 0.00 N ATOM 281 CA GLY A 232 0.702 -9.989 6.816 1.00 0.00 C ATOM 282 C GLY A 232 1.247 -8.906 5.905 1.00 0.00 C ATOM 283 O GLY A 232 2.458 -8.796 5.714 1.00 0.00 O ATOM 0 H GLY A 232 -1.234 -10.056 7.612 1.00 0.00 H new ATOM 0 HA2 GLY A 232 1.508 -10.374 7.440 1.00 0.00 H new ATOM 0 HA3 GLY A 232 0.342 -10.821 6.211 1.00 0.00 H new ATOM 287 N THR A 233 0.350 -8.105 5.339 1.00 0.00 N ATOM 288 CA THR A 233 0.746 -7.028 4.441 1.00 0.00 C ATOM 289 C THR A 233 1.917 -6.237 5.014 1.00 0.00 C ATOM 290 O THR A 233 2.219 -6.331 6.205 1.00 0.00 O ATOM 291 CB THR A 233 -0.424 -6.064 4.168 1.00 0.00 C ATOM 292 OG1 THR A 233 -1.594 -6.806 3.805 1.00 0.00 O ATOM 293 CG2 THR A 233 -0.072 -5.087 3.057 1.00 0.00 C ATOM 0 H THR A 233 -0.656 -8.182 5.487 1.00 0.00 H new ATOM 0 HA THR A 233 1.049 -7.494 3.504 1.00 0.00 H new ATOM 0 HB THR A 233 -0.621 -5.498 5.079 1.00 0.00 H new ATOM 0 HG1 THR A 233 -1.440 -7.264 2.952 1.00 0.00 H new ATOM 0 HG21 THR A 233 -0.913 -4.416 2.882 1.00 0.00 H new ATOM 0 HG22 THR A 233 0.802 -4.504 3.348 1.00 0.00 H new ATOM 0 HG23 THR A 233 0.148 -5.639 2.143 1.00 0.00 H new ATOM 301 N LEU A 234 2.572 -5.458 4.161 1.00 0.00 N ATOM 302 CA LEU A 234 3.711 -4.649 4.584 1.00 0.00 C ATOM 303 C LEU A 234 3.799 -3.364 3.767 1.00 0.00 C ATOM 304 O LEU A 234 3.334 -3.307 2.629 1.00 0.00 O ATOM 305 CB LEU A 234 5.008 -5.446 4.442 1.00 0.00 C ATOM 306 CG LEU A 234 5.134 -6.686 5.329 1.00 0.00 C ATOM 307 CD1 LEU A 234 6.320 -7.533 4.896 1.00 0.00 C ATOM 308 CD2 LEU A 234 5.268 -6.285 6.791 1.00 0.00 C ATOM 0 H LEU A 234 2.335 -5.369 3.173 1.00 0.00 H new ATOM 0 HA LEU A 234 3.568 -4.383 5.631 1.00 0.00 H new ATOM 0 HB2 LEU A 234 5.109 -5.756 3.402 1.00 0.00 H new ATOM 0 HB3 LEU A 234 5.845 -4.782 4.659 1.00 0.00 H new ATOM 0 HG LEU A 234 4.228 -7.282 5.218 1.00 0.00 H new ATOM 0 HD11 LEU A 234 6.394 -8.411 5.538 1.00 0.00 H new ATOM 0 HD12 LEU A 234 6.182 -7.850 3.862 1.00 0.00 H new ATOM 0 HD13 LEU A 234 7.235 -6.946 4.977 1.00 0.00 H new ATOM 0 HD21 LEU A 234 5.356 -7.180 7.407 1.00 0.00 H new ATOM 0 HD22 LEU A 234 6.157 -5.667 6.919 1.00 0.00 H new ATOM 0 HD23 LEU A 234 4.387 -5.720 7.096 1.00 0.00 H new ATOM 320 N ALA A 235 4.400 -2.335 4.355 1.00 0.00 N ATOM 321 CA ALA A 235 4.553 -1.052 3.680 1.00 0.00 C ATOM 322 C ALA A 235 5.117 -1.234 2.275 1.00 0.00 C ATOM 323 O ALA A 235 4.660 -0.599 1.325 1.00 0.00 O ATOM 324 CB ALA A 235 5.448 -0.130 4.494 1.00 0.00 C ATOM 0 H ALA A 235 4.789 -2.365 5.297 1.00 0.00 H new ATOM 0 HA ALA A 235 3.566 -0.597 3.591 1.00 0.00 H new ATOM 0 HB1 ALA A 235 5.553 0.824 3.978 1.00 0.00 H new ATOM 0 HB2 ALA A 235 5.003 0.036 5.475 1.00 0.00 H new ATOM 0 HB3 ALA A 235 6.430 -0.588 4.613 1.00 0.00 H new ATOM 330 N ALA A 236 6.113 -2.105 2.151 1.00 0.00 N ATOM 331 CA ALA A 236 6.738 -2.372 0.861 1.00 0.00 C ATOM 332 C ALA A 236 5.741 -2.987 -0.116 1.00 0.00 C ATOM 333 O ALA A 236 5.639 -2.556 -1.264 1.00 0.00 O ATOM 334 CB ALA A 236 7.941 -3.288 1.037 1.00 0.00 C ATOM 0 H ALA A 236 6.504 -2.638 2.928 1.00 0.00 H new ATOM 0 HA ALA A 236 7.075 -1.423 0.445 1.00 0.00 H new ATOM 0 HB1 ALA A 236 8.398 -3.479 0.066 1.00 0.00 H new ATOM 0 HB2 ALA A 236 8.669 -2.811 1.693 1.00 0.00 H new ATOM 0 HB3 ALA A 236 7.619 -4.231 1.478 1.00 0.00 H new ATOM 340 N GLU A 237 5.010 -3.995 0.348 1.00 0.00 N ATOM 341 CA GLU A 237 4.022 -4.669 -0.487 1.00 0.00 C ATOM 342 C GLU A 237 3.067 -3.662 -1.120 1.00 0.00 C ATOM 343 O GLU A 237 2.993 -3.544 -2.343 1.00 0.00 O ATOM 344 CB GLU A 237 3.234 -5.688 0.339 1.00 0.00 C ATOM 345 CG GLU A 237 4.073 -6.859 0.823 1.00 0.00 C ATOM 346 CD GLU A 237 4.809 -7.555 -0.305 1.00 0.00 C ATOM 347 OE1 GLU A 237 4.159 -7.895 -1.316 1.00 0.00 O ATOM 348 OE2 GLU A 237 6.034 -7.760 -0.178 1.00 0.00 O ATOM 0 H GLU A 237 5.083 -4.363 1.297 1.00 0.00 H new ATOM 0 HA GLU A 237 4.552 -5.191 -1.284 1.00 0.00 H new ATOM 0 HB2 GLU A 237 2.797 -5.184 1.201 1.00 0.00 H new ATOM 0 HB3 GLU A 237 2.407 -6.068 -0.261 1.00 0.00 H new ATOM 0 HG2 GLU A 237 4.795 -6.504 1.559 1.00 0.00 H new ATOM 0 HG3 GLU A 237 3.429 -7.578 1.330 1.00 0.00 H new ATOM 355 N ILE A 238 2.336 -2.939 -0.278 1.00 0.00 N ATOM 356 CA ILE A 238 1.386 -1.941 -0.754 1.00 0.00 C ATOM 357 C ILE A 238 2.055 -0.952 -1.701 1.00 0.00 C ATOM 358 O ILE A 238 1.658 -0.820 -2.858 1.00 0.00 O ATOM 359 CB ILE A 238 0.750 -1.166 0.415 1.00 0.00 C ATOM 360 CG1 ILE A 238 -0.046 -2.116 1.313 1.00 0.00 C ATOM 361 CG2 ILE A 238 -0.144 -0.053 -0.111 1.00 0.00 C ATOM 362 CD1 ILE A 238 -1.303 -2.649 0.664 1.00 0.00 C ATOM 0 H ILE A 238 2.383 -3.026 0.737 1.00 0.00 H new ATOM 0 HA ILE A 238 0.604 -2.480 -1.289 1.00 0.00 H new ATOM 0 HB ILE A 238 1.546 -0.716 1.009 1.00 0.00 H new ATOM 0 HG12 ILE A 238 0.591 -2.954 1.596 1.00 0.00 H new ATOM 0 HG13 ILE A 238 -0.314 -1.595 2.232 1.00 0.00 H new ATOM 0 HG21 ILE A 238 -0.586 0.485 0.727 1.00 0.00 H new ATOM 0 HG22 ILE A 238 0.449 0.636 -0.713 1.00 0.00 H new ATOM 0 HG23 ILE A 238 -0.936 -0.482 -0.725 1.00 0.00 H new ATOM 0 HD11 ILE A 238 -1.816 -3.315 1.358 1.00 0.00 H new ATOM 0 HD12 ILE A 238 -1.960 -1.818 0.406 1.00 0.00 H new ATOM 0 HD13 ILE A 238 -1.041 -3.199 -0.240 1.00 0.00 H new ATOM 374 N GLN A 239 3.074 -0.260 -1.202 1.00 0.00 N ATOM 375 CA GLN A 239 3.800 0.717 -2.005 1.00 0.00 C ATOM 376 C GLN A 239 3.942 0.240 -3.446 1.00 0.00 C ATOM 377 O GLN A 239 3.534 0.929 -4.380 1.00 0.00 O ATOM 378 CB GLN A 239 5.183 0.977 -1.403 1.00 0.00 C ATOM 379 CG GLN A 239 5.917 2.141 -2.048 1.00 0.00 C ATOM 380 CD GLN A 239 7.360 2.244 -1.594 1.00 0.00 C ATOM 381 OE1 GLN A 239 8.269 1.748 -2.260 1.00 0.00 O ATOM 382 NE2 GLN A 239 7.578 2.890 -0.454 1.00 0.00 N ATOM 0 H GLN A 239 3.416 -0.358 -0.246 1.00 0.00 H new ATOM 0 HA GLN A 239 3.230 1.646 -2.004 1.00 0.00 H new ATOM 0 HB2 GLN A 239 5.075 1.173 -0.336 1.00 0.00 H new ATOM 0 HB3 GLN A 239 5.789 0.076 -1.502 1.00 0.00 H new ATOM 0 HG2 GLN A 239 5.888 2.028 -3.132 1.00 0.00 H new ATOM 0 HG3 GLN A 239 5.398 3.070 -1.810 1.00 0.00 H new ATOM 0 HE21 GLN A 239 6.795 3.286 0.066 1.00 0.00 H new ATOM 0 HE22 GLN A 239 8.529 2.990 -0.098 1.00 0.00 H new ATOM 391 N GLU A 240 4.521 -0.944 -3.618 1.00 0.00 N ATOM 392 CA GLU A 240 4.717 -1.512 -4.947 1.00 0.00 C ATOM 393 C GLU A 240 3.377 -1.798 -5.619 1.00 0.00 C ATOM 394 O GLU A 240 3.085 -1.276 -6.696 1.00 0.00 O ATOM 395 CB GLU A 240 5.541 -2.798 -4.860 1.00 0.00 C ATOM 396 CG GLU A 240 6.317 -3.111 -6.129 1.00 0.00 C ATOM 397 CD GLU A 240 6.584 -4.594 -6.298 1.00 0.00 C ATOM 398 OE1 GLU A 240 7.598 -5.080 -5.755 1.00 0.00 O ATOM 399 OE2 GLU A 240 5.779 -5.269 -6.974 1.00 0.00 O ATOM 0 H GLU A 240 4.862 -1.528 -2.855 1.00 0.00 H new ATOM 0 HA GLU A 240 5.258 -0.783 -5.550 1.00 0.00 H new ATOM 0 HB2 GLU A 240 6.240 -2.716 -4.028 1.00 0.00 H new ATOM 0 HB3 GLU A 240 4.875 -3.632 -4.636 1.00 0.00 H new ATOM 0 HG2 GLU A 240 5.759 -2.745 -6.991 1.00 0.00 H new ATOM 0 HG3 GLU A 240 7.266 -2.574 -6.112 1.00 0.00 H new ATOM 406 N THR A 241 2.566 -2.632 -4.976 1.00 0.00 N ATOM 407 CA THR A 241 1.258 -2.990 -5.511 1.00 0.00 C ATOM 408 C THR A 241 0.624 -1.815 -6.247 1.00 0.00 C ATOM 409 O THR A 241 0.238 -1.933 -7.410 1.00 0.00 O ATOM 410 CB THR A 241 0.304 -3.458 -4.396 1.00 0.00 C ATOM 411 OG1 THR A 241 0.888 -4.550 -3.678 1.00 0.00 O ATOM 412 CG2 THR A 241 -1.037 -3.883 -4.975 1.00 0.00 C ATOM 0 H THR A 241 2.792 -3.072 -4.084 1.00 0.00 H new ATOM 0 HA THR A 241 1.417 -3.810 -6.211 1.00 0.00 H new ATOM 0 HB THR A 241 0.139 -2.623 -3.715 1.00 0.00 H new ATOM 0 HG1 THR A 241 1.626 -4.220 -3.124 1.00 0.00 H new ATOM 0 HG21 THR A 241 -1.694 -4.210 -4.169 1.00 0.00 H new ATOM 0 HG22 THR A 241 -1.492 -3.040 -5.495 1.00 0.00 H new ATOM 0 HG23 THR A 241 -0.887 -4.704 -5.676 1.00 0.00 H new ATOM 420 N PHE A 242 0.522 -0.681 -5.563 1.00 0.00 N ATOM 421 CA PHE A 242 -0.066 0.517 -6.152 1.00 0.00 C ATOM 422 C PHE A 242 0.867 1.123 -7.196 1.00 0.00 C ATOM 423 O PHE A 242 0.449 1.436 -8.311 1.00 0.00 O ATOM 424 CB PHE A 242 -0.371 1.549 -5.064 1.00 0.00 C ATOM 425 CG PHE A 242 -1.593 1.223 -4.254 1.00 0.00 C ATOM 426 CD1 PHE A 242 -1.542 0.265 -3.254 1.00 0.00 C ATOM 427 CD2 PHE A 242 -2.792 1.875 -4.492 1.00 0.00 C ATOM 428 CE1 PHE A 242 -2.664 -0.037 -2.507 1.00 0.00 C ATOM 429 CE2 PHE A 242 -3.918 1.577 -3.747 1.00 0.00 C ATOM 430 CZ PHE A 242 -3.854 0.619 -2.754 1.00 0.00 C ATOM 0 H PHE A 242 0.839 -0.566 -4.600 1.00 0.00 H new ATOM 0 HA PHE A 242 -0.996 0.231 -6.643 1.00 0.00 H new ATOM 0 HB2 PHE A 242 0.487 1.626 -4.397 1.00 0.00 H new ATOM 0 HB3 PHE A 242 -0.503 2.526 -5.528 1.00 0.00 H new ATOM 0 HD1 PHE A 242 -0.614 -0.251 -3.056 1.00 0.00 H new ATOM 0 HD2 PHE A 242 -2.848 2.624 -5.268 1.00 0.00 H new ATOM 0 HE1 PHE A 242 -2.611 -0.786 -1.730 1.00 0.00 H new ATOM 0 HE2 PHE A 242 -4.847 2.093 -3.941 1.00 0.00 H new ATOM 0 HZ PHE A 242 -4.733 0.383 -2.172 1.00 0.00 H new ATOM 440 N SER A 243 2.133 1.286 -6.827 1.00 0.00 N ATOM 441 CA SER A 243 3.125 1.858 -7.729 1.00 0.00 C ATOM 442 C SER A 243 3.000 1.257 -9.126 1.00 0.00 C ATOM 443 O SER A 243 3.140 1.956 -10.130 1.00 0.00 O ATOM 444 CB SER A 243 4.536 1.623 -7.186 1.00 0.00 C ATOM 445 OG SER A 243 5.491 2.390 -7.898 1.00 0.00 O ATOM 0 H SER A 243 2.496 1.030 -5.909 1.00 0.00 H new ATOM 0 HA SER A 243 2.943 2.931 -7.795 1.00 0.00 H new ATOM 0 HB2 SER A 243 4.570 1.885 -6.128 1.00 0.00 H new ATOM 0 HB3 SER A 243 4.786 0.565 -7.261 1.00 0.00 H new ATOM 0 HG SER A 243 6.384 2.223 -7.531 1.00 0.00 H new ATOM 451 N ARG A 244 2.735 -0.044 -9.182 1.00 0.00 N ATOM 452 CA ARG A 244 2.592 -0.741 -10.454 1.00 0.00 C ATOM 453 C ARG A 244 1.820 0.112 -11.457 1.00 0.00 C ATOM 454 O ARG A 244 2.255 0.299 -12.594 1.00 0.00 O ATOM 455 CB ARG A 244 1.878 -2.079 -10.250 1.00 0.00 C ATOM 456 CG ARG A 244 2.653 -3.056 -9.383 1.00 0.00 C ATOM 457 CD ARG A 244 3.761 -3.741 -10.168 1.00 0.00 C ATOM 458 NE ARG A 244 3.237 -4.525 -11.283 1.00 0.00 N ATOM 459 CZ ARG A 244 3.881 -5.554 -11.824 1.00 0.00 C ATOM 460 NH1 ARG A 244 5.065 -5.921 -11.354 1.00 0.00 N ATOM 461 NH2 ARG A 244 3.339 -6.219 -12.836 1.00 0.00 N ATOM 0 H ARG A 244 2.615 -0.637 -8.361 1.00 0.00 H new ATOM 0 HA ARG A 244 3.590 -0.927 -10.852 1.00 0.00 H new ATOM 0 HB2 ARG A 244 0.904 -1.896 -9.795 1.00 0.00 H new ATOM 0 HB3 ARG A 244 1.695 -2.536 -11.223 1.00 0.00 H new ATOM 0 HG2 ARG A 244 3.082 -2.527 -8.532 1.00 0.00 H new ATOM 0 HG3 ARG A 244 1.972 -3.807 -8.982 1.00 0.00 H new ATOM 0 HD2 ARG A 244 4.454 -2.990 -10.547 1.00 0.00 H new ATOM 0 HD3 ARG A 244 4.328 -4.392 -9.502 1.00 0.00 H new ATOM 0 HE ARG A 244 2.328 -4.269 -11.667 1.00 0.00 H new ATOM 0 HH11 ARG A 244 5.484 -5.413 -10.575 1.00 0.00 H new ATOM 0 HH12 ARG A 244 5.557 -6.711 -11.771 1.00 0.00 H new ATOM 0 HH21 ARG A 244 2.427 -5.941 -13.199 1.00 0.00 H new ATOM 0 HH22 ARG A 244 3.834 -7.009 -13.251 1.00 0.00 H new ATOM 475 N PHE A 245 0.672 0.626 -11.029 1.00 0.00 N ATOM 476 CA PHE A 245 -0.161 1.458 -11.889 1.00 0.00 C ATOM 477 C PHE A 245 0.590 2.711 -12.327 1.00 0.00 C ATOM 478 O PHE A 245 0.536 3.107 -13.491 1.00 0.00 O ATOM 479 CB PHE A 245 -1.450 1.850 -11.163 1.00 0.00 C ATOM 480 CG PHE A 245 -2.420 0.714 -11.010 1.00 0.00 C ATOM 481 CD1 PHE A 245 -2.190 -0.292 -10.085 1.00 0.00 C ATOM 482 CD2 PHE A 245 -3.564 0.652 -11.789 1.00 0.00 C ATOM 483 CE1 PHE A 245 -3.081 -1.339 -9.943 1.00 0.00 C ATOM 484 CE2 PHE A 245 -4.459 -0.392 -11.651 1.00 0.00 C ATOM 485 CZ PHE A 245 -4.218 -1.388 -10.726 1.00 0.00 C ATOM 0 H PHE A 245 0.297 0.481 -10.092 1.00 0.00 H new ATOM 0 HA PHE A 245 -0.414 0.879 -12.777 1.00 0.00 H new ATOM 0 HB2 PHE A 245 -1.198 2.238 -10.176 1.00 0.00 H new ATOM 0 HB3 PHE A 245 -1.934 2.659 -11.710 1.00 0.00 H new ATOM 0 HD1 PHE A 245 -1.304 -0.257 -9.468 1.00 0.00 H new ATOM 0 HD2 PHE A 245 -3.759 1.429 -12.513 1.00 0.00 H new ATOM 0 HE1 PHE A 245 -2.888 -2.118 -9.220 1.00 0.00 H new ATOM 0 HE2 PHE A 245 -5.346 -0.429 -12.266 1.00 0.00 H new ATOM 0 HZ PHE A 245 -4.917 -2.204 -10.615 1.00 0.00 H new ATOM 495 N GLY A 246 1.292 3.333 -11.385 1.00 0.00 N ATOM 496 CA GLY A 246 2.044 4.536 -11.691 1.00 0.00 C ATOM 497 C GLY A 246 2.884 5.009 -10.521 1.00 0.00 C ATOM 498 O GLY A 246 2.590 4.691 -9.369 1.00 0.00 O ATOM 0 H GLY A 246 1.353 3.025 -10.415 1.00 0.00 H new ATOM 0 HA2 GLY A 246 2.692 4.348 -12.547 1.00 0.00 H new ATOM 0 HA3 GLY A 246 1.354 5.328 -11.982 1.00 0.00 H new ATOM 502 N SER A 247 3.932 5.771 -10.817 1.00 0.00 N ATOM 503 CA SER A 247 4.820 6.285 -9.781 1.00 0.00 C ATOM 504 C SER A 247 4.024 6.753 -8.566 1.00 0.00 C ATOM 505 O SER A 247 2.923 7.289 -8.699 1.00 0.00 O ATOM 506 CB SER A 247 5.663 7.439 -10.328 1.00 0.00 C ATOM 507 OG SER A 247 6.699 6.960 -11.167 1.00 0.00 O ATOM 0 H SER A 247 4.187 6.046 -11.766 1.00 0.00 H new ATOM 0 HA SER A 247 5.482 5.476 -9.471 1.00 0.00 H new ATOM 0 HB2 SER A 247 5.027 8.126 -10.886 1.00 0.00 H new ATOM 0 HB3 SER A 247 6.093 8.004 -9.501 1.00 0.00 H new ATOM 0 HG SER A 247 7.222 7.717 -11.505 1.00 0.00 H new ATOM 513 N LEU A 248 4.589 6.546 -7.382 1.00 0.00 N ATOM 514 CA LEU A 248 3.933 6.946 -6.141 1.00 0.00 C ATOM 515 C LEU A 248 4.748 8.010 -5.413 1.00 0.00 C ATOM 516 O LEU A 248 5.943 8.166 -5.658 1.00 0.00 O ATOM 517 CB LEU A 248 3.732 5.732 -5.233 1.00 0.00 C ATOM 518 CG LEU A 248 2.530 4.844 -5.556 1.00 0.00 C ATOM 519 CD1 LEU A 248 2.591 3.551 -4.757 1.00 0.00 C ATOM 520 CD2 LEU A 248 1.229 5.584 -5.278 1.00 0.00 C ATOM 0 H LEU A 248 5.499 6.104 -7.254 1.00 0.00 H new ATOM 0 HA LEU A 248 2.960 7.369 -6.393 1.00 0.00 H new ATOM 0 HB2 LEU A 248 4.633 5.119 -5.275 1.00 0.00 H new ATOM 0 HB3 LEU A 248 3.633 6.084 -4.206 1.00 0.00 H new ATOM 0 HG LEU A 248 2.563 4.594 -6.616 1.00 0.00 H new ATOM 0 HD11 LEU A 248 1.727 2.932 -5.000 1.00 0.00 H new ATOM 0 HD12 LEU A 248 3.505 3.012 -5.006 1.00 0.00 H new ATOM 0 HD13 LEU A 248 2.584 3.781 -3.692 1.00 0.00 H new ATOM 0 HD21 LEU A 248 0.385 4.936 -5.514 1.00 0.00 H new ATOM 0 HD22 LEU A 248 1.188 5.865 -4.226 1.00 0.00 H new ATOM 0 HD23 LEU A 248 1.182 6.481 -5.895 1.00 0.00 H new ATOM 532 N GLY A 249 4.092 8.740 -4.516 1.00 0.00 N ATOM 533 CA GLY A 249 4.772 9.779 -3.764 1.00 0.00 C ATOM 534 C GLY A 249 5.073 9.360 -2.339 1.00 0.00 C ATOM 535 O GLY A 249 6.140 8.815 -2.057 1.00 0.00 O ATOM 0 H GLY A 249 3.102 8.631 -4.297 1.00 0.00 H new ATOM 0 HA2 GLY A 249 5.703 10.038 -4.268 1.00 0.00 H new ATOM 0 HA3 GLY A 249 4.155 10.678 -3.753 1.00 0.00 H new ATOM 539 N ARG A 250 4.131 9.617 -1.437 1.00 0.00 N ATOM 540 CA ARG A 250 4.302 9.266 -0.032 1.00 0.00 C ATOM 541 C ARG A 250 3.588 7.957 0.292 1.00 0.00 C ATOM 542 O ARG A 250 2.514 7.676 -0.240 1.00 0.00 O ATOM 543 CB ARG A 250 3.769 10.386 0.864 1.00 0.00 C ATOM 544 CG ARG A 250 4.642 11.630 0.868 1.00 0.00 C ATOM 545 CD ARG A 250 6.037 11.331 1.394 1.00 0.00 C ATOM 546 NE ARG A 250 6.003 10.727 2.723 1.00 0.00 N ATOM 547 CZ ARG A 250 7.006 10.803 3.591 1.00 0.00 C ATOM 548 NH1 ARG A 250 8.116 11.453 3.271 1.00 0.00 N ATOM 549 NH2 ARG A 250 6.900 10.228 4.782 1.00 0.00 N ATOM 0 H ARG A 250 3.242 10.067 -1.654 1.00 0.00 H new ATOM 0 HA ARG A 250 5.367 9.135 0.157 1.00 0.00 H new ATOM 0 HB2 ARG A 250 2.766 10.657 0.534 1.00 0.00 H new ATOM 0 HB3 ARG A 250 3.679 10.012 1.884 1.00 0.00 H new ATOM 0 HG2 ARG A 250 4.712 12.030 -0.144 1.00 0.00 H new ATOM 0 HG3 ARG A 250 4.177 12.400 1.484 1.00 0.00 H new ATOM 0 HD2 ARG A 250 6.548 10.660 0.704 1.00 0.00 H new ATOM 0 HD3 ARG A 250 6.616 12.254 1.430 1.00 0.00 H new ATOM 0 HE ARG A 250 5.163 10.219 3.000 1.00 0.00 H new ATOM 0 HH11 ARG A 250 8.202 11.896 2.356 1.00 0.00 H new ATOM 0 HH12 ARG A 250 8.884 11.510 3.939 1.00 0.00 H new ATOM 0 HH21 ARG A 250 6.048 9.727 5.032 1.00 0.00 H new ATOM 0 HH22 ARG A 250 7.671 10.287 5.447 1.00 0.00 H new ATOM 563 N VAL A 251 4.193 7.161 1.168 1.00 0.00 N ATOM 564 CA VAL A 251 3.615 5.882 1.563 1.00 0.00 C ATOM 565 C VAL A 251 3.908 5.576 3.028 1.00 0.00 C ATOM 566 O VAL A 251 5.061 5.383 3.415 1.00 0.00 O ATOM 567 CB VAL A 251 4.151 4.730 0.693 1.00 0.00 C ATOM 568 CG1 VAL A 251 3.717 3.386 1.258 1.00 0.00 C ATOM 569 CG2 VAL A 251 3.685 4.889 -0.746 1.00 0.00 C ATOM 0 H VAL A 251 5.082 7.379 1.617 1.00 0.00 H new ATOM 0 HA VAL A 251 2.538 5.964 1.419 1.00 0.00 H new ATOM 0 HB VAL A 251 5.240 4.766 0.704 1.00 0.00 H new ATOM 0 HG11 VAL A 251 4.105 2.585 0.630 1.00 0.00 H new ATOM 0 HG12 VAL A 251 4.106 3.274 2.270 1.00 0.00 H new ATOM 0 HG13 VAL A 251 2.628 3.335 1.280 1.00 0.00 H new ATOM 0 HG21 VAL A 251 4.073 4.067 -1.347 1.00 0.00 H new ATOM 0 HG22 VAL A 251 2.596 4.880 -0.779 1.00 0.00 H new ATOM 0 HG23 VAL A 251 4.052 5.835 -1.145 1.00 0.00 H new ATOM 579 N LEU A 252 2.857 5.532 3.839 1.00 0.00 N ATOM 580 CA LEU A 252 3.000 5.249 5.263 1.00 0.00 C ATOM 581 C LEU A 252 1.998 4.191 5.711 1.00 0.00 C ATOM 582 O LEU A 252 0.787 4.370 5.574 1.00 0.00 O ATOM 583 CB LEU A 252 2.808 6.529 6.079 1.00 0.00 C ATOM 584 CG LEU A 252 3.689 7.715 5.685 1.00 0.00 C ATOM 585 CD1 LEU A 252 3.089 9.017 6.194 1.00 0.00 C ATOM 586 CD2 LEU A 252 5.102 7.532 6.218 1.00 0.00 C ATOM 0 H LEU A 252 1.896 5.689 3.535 1.00 0.00 H new ATOM 0 HA LEU A 252 4.006 4.865 5.433 1.00 0.00 H new ATOM 0 HB2 LEU A 252 1.765 6.834 5.998 1.00 0.00 H new ATOM 0 HB3 LEU A 252 2.992 6.298 7.128 1.00 0.00 H new ATOM 0 HG LEU A 252 3.737 7.761 4.597 1.00 0.00 H new ATOM 0 HD11 LEU A 252 3.729 9.850 5.904 1.00 0.00 H new ATOM 0 HD12 LEU A 252 2.098 9.154 5.762 1.00 0.00 H new ATOM 0 HD13 LEU A 252 3.010 8.981 7.281 1.00 0.00 H new ATOM 0 HD21 LEU A 252 5.714 8.386 5.927 1.00 0.00 H new ATOM 0 HD22 LEU A 252 5.074 7.459 7.305 1.00 0.00 H new ATOM 0 HD23 LEU A 252 5.532 6.620 5.804 1.00 0.00 H new ATOM 598 N LEU A 253 2.509 3.090 6.250 1.00 0.00 N ATOM 599 CA LEU A 253 1.658 2.002 6.722 1.00 0.00 C ATOM 600 C LEU A 253 2.113 1.511 8.092 1.00 0.00 C ATOM 601 O LEU A 253 3.047 0.719 8.216 1.00 0.00 O ATOM 602 CB LEU A 253 1.674 0.845 5.721 1.00 0.00 C ATOM 603 CG LEU A 253 1.215 -0.511 6.257 1.00 0.00 C ATOM 604 CD1 LEU A 253 -0.181 -0.407 6.849 1.00 0.00 C ATOM 605 CD2 LEU A 253 1.252 -1.560 5.154 1.00 0.00 C ATOM 0 H LEU A 253 3.508 2.926 6.371 1.00 0.00 H new ATOM 0 HA LEU A 253 0.640 2.382 6.812 1.00 0.00 H new ATOM 0 HB2 LEU A 253 1.040 1.113 4.876 1.00 0.00 H new ATOM 0 HB3 LEU A 253 2.688 0.737 5.337 1.00 0.00 H new ATOM 0 HG LEU A 253 1.900 -0.818 7.047 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -0.490 -1.382 7.225 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -0.176 0.313 7.667 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -0.879 -0.077 6.079 1.00 0.00 H new ATOM 0 HD21 LEU A 253 0.922 -2.519 5.553 1.00 0.00 H new ATOM 0 HD22 LEU A 253 0.590 -1.258 4.342 1.00 0.00 H new ATOM 0 HD23 LEU A 253 2.270 -1.655 4.776 1.00 0.00 H new ATOM 617 N PRO A 254 1.436 1.988 9.147 1.00 0.00 N ATOM 618 CA PRO A 254 1.750 1.608 10.527 1.00 0.00 C ATOM 619 C PRO A 254 1.387 0.158 10.827 1.00 0.00 C ATOM 620 O PRO A 254 0.438 -0.383 10.260 1.00 0.00 O ATOM 621 CB PRO A 254 0.888 2.559 11.362 1.00 0.00 C ATOM 622 CG PRO A 254 -0.248 2.922 10.469 1.00 0.00 C ATOM 623 CD PRO A 254 0.310 2.935 9.073 1.00 0.00 C ATOM 0 HA PRO A 254 2.817 1.682 10.737 1.00 0.00 H new ATOM 0 HB2 PRO A 254 0.536 2.077 12.274 1.00 0.00 H new ATOM 0 HB3 PRO A 254 1.451 3.442 11.665 1.00 0.00 H new ATOM 0 HG2 PRO A 254 -1.060 2.200 10.558 1.00 0.00 H new ATOM 0 HG3 PRO A 254 -0.657 3.897 10.735 1.00 0.00 H new ATOM 0 HD2 PRO A 254 -0.433 2.620 8.340 1.00 0.00 H new ATOM 0 HD3 PRO A 254 0.642 3.932 8.782 1.00 0.00 H new ATOM 631 N GLU A 255 2.148 -0.466 11.721 1.00 0.00 N ATOM 632 CA GLU A 255 1.905 -1.854 12.094 1.00 0.00 C ATOM 633 C GLU A 255 0.712 -1.963 13.039 1.00 0.00 C ATOM 634 O GLU A 255 -0.036 -2.938 13.002 1.00 0.00 O ATOM 635 CB GLU A 255 3.149 -2.453 12.754 1.00 0.00 C ATOM 636 CG GLU A 255 3.563 -1.741 14.031 1.00 0.00 C ATOM 637 CD GLU A 255 4.364 -0.482 13.764 1.00 0.00 C ATOM 638 OE1 GLU A 255 5.300 -0.539 12.939 1.00 0.00 O ATOM 639 OE2 GLU A 255 4.056 0.560 14.380 1.00 0.00 O ATOM 0 H GLU A 255 2.937 -0.032 12.200 1.00 0.00 H new ATOM 0 HA GLU A 255 1.679 -2.413 11.186 1.00 0.00 H new ATOM 0 HB2 GLU A 255 2.961 -3.503 12.978 1.00 0.00 H new ATOM 0 HB3 GLU A 255 3.977 -2.421 12.046 1.00 0.00 H new ATOM 0 HG2 GLU A 255 2.672 -1.485 14.605 1.00 0.00 H new ATOM 0 HG3 GLU A 255 4.154 -2.420 14.646 1.00 0.00 H new ATOM 646 N GLY A 256 0.542 -0.952 13.886 1.00 0.00 N ATOM 647 CA GLY A 256 -0.561 -0.953 14.830 1.00 0.00 C ATOM 648 C GLY A 256 -1.912 -0.969 14.143 1.00 0.00 C ATOM 649 O GLY A 256 -2.853 -1.598 14.624 1.00 0.00 O ATOM 0 H GLY A 256 1.148 -0.133 13.935 1.00 0.00 H new ATOM 0 HA2 GLY A 256 -0.477 -1.823 15.481 1.00 0.00 H new ATOM 0 HA3 GLY A 256 -0.491 -0.071 15.467 1.00 0.00 H new ATOM 653 N GLY A 257 -2.008 -0.273 13.014 1.00 0.00 N ATOM 654 CA GLY A 257 -3.259 -0.222 12.279 1.00 0.00 C ATOM 655 C GLY A 257 -3.118 -0.736 10.859 1.00 0.00 C ATOM 656 O GLY A 257 -2.376 -0.168 10.057 1.00 0.00 O ATOM 0 H GLY A 257 -1.243 0.256 12.596 1.00 0.00 H new ATOM 0 HA2 GLY A 257 -4.010 -0.813 12.803 1.00 0.00 H new ATOM 0 HA3 GLY A 257 -3.622 0.806 12.256 1.00 0.00 H new ATOM 660 N ILE A 258 -3.831 -1.813 10.549 1.00 0.00 N ATOM 661 CA ILE A 258 -3.781 -2.403 9.217 1.00 0.00 C ATOM 662 C ILE A 258 -3.926 -1.336 8.137 1.00 0.00 C ATOM 663 O ILE A 258 -3.337 -1.441 7.061 1.00 0.00 O ATOM 664 CB ILE A 258 -4.885 -3.461 9.028 1.00 0.00 C ATOM 665 CG1 ILE A 258 -6.254 -2.867 9.366 1.00 0.00 C ATOM 666 CG2 ILE A 258 -4.603 -4.681 9.892 1.00 0.00 C ATOM 667 CD1 ILE A 258 -7.413 -3.745 8.949 1.00 0.00 C ATOM 0 H ILE A 258 -4.450 -2.295 11.201 1.00 0.00 H new ATOM 0 HA ILE A 258 -2.807 -2.884 9.122 1.00 0.00 H new ATOM 0 HB ILE A 258 -4.893 -3.774 7.984 1.00 0.00 H new ATOM 0 HG12 ILE A 258 -6.310 -2.692 10.440 1.00 0.00 H new ATOM 0 HG13 ILE A 258 -6.350 -1.897 8.879 1.00 0.00 H new ATOM 0 HG21 ILE A 258 -5.392 -5.419 9.747 1.00 0.00 H new ATOM 0 HG22 ILE A 258 -3.644 -5.114 9.608 1.00 0.00 H new ATOM 0 HG23 ILE A 258 -4.571 -4.385 10.940 1.00 0.00 H new ATOM 0 HD11 ILE A 258 -8.352 -3.261 9.220 1.00 0.00 H new ATOM 0 HD12 ILE A 258 -7.382 -3.900 7.871 1.00 0.00 H new ATOM 0 HD13 ILE A 258 -7.341 -4.707 9.456 1.00 0.00 H new ATOM 679 N THR A 259 -4.712 -0.305 8.433 1.00 0.00 N ATOM 680 CA THR A 259 -4.934 0.782 7.488 1.00 0.00 C ATOM 681 C THR A 259 -3.614 1.314 6.942 1.00 0.00 C ATOM 682 O THR A 259 -2.705 1.645 7.702 1.00 0.00 O ATOM 683 CB THR A 259 -5.711 1.942 8.140 1.00 0.00 C ATOM 684 OG1 THR A 259 -5.018 2.402 9.305 1.00 0.00 O ATOM 685 CG2 THR A 259 -7.118 1.505 8.520 1.00 0.00 C ATOM 0 H THR A 259 -5.205 -0.200 9.320 1.00 0.00 H new ATOM 0 HA THR A 259 -5.525 0.373 6.668 1.00 0.00 H new ATOM 0 HB THR A 259 -5.783 2.754 7.416 1.00 0.00 H new ATOM 0 HG1 THR A 259 -4.057 2.443 9.119 1.00 0.00 H new ATOM 0 HG21 THR A 259 -7.647 2.340 8.978 1.00 0.00 H new ATOM 0 HG22 THR A 259 -7.653 1.183 7.626 1.00 0.00 H new ATOM 0 HG23 THR A 259 -7.063 0.678 9.228 1.00 0.00 H new ATOM 693 N ALA A 260 -3.516 1.393 5.619 1.00 0.00 N ATOM 694 CA ALA A 260 -2.307 1.887 4.971 1.00 0.00 C ATOM 695 C ALA A 260 -2.588 3.164 4.186 1.00 0.00 C ATOM 696 O ALA A 260 -3.523 3.220 3.387 1.00 0.00 O ATOM 697 CB ALA A 260 -1.726 0.820 4.055 1.00 0.00 C ATOM 0 H ALA A 260 -4.259 1.121 4.975 1.00 0.00 H new ATOM 0 HA ALA A 260 -1.578 2.121 5.747 1.00 0.00 H new ATOM 0 HB1 ALA A 260 -0.824 1.202 3.578 1.00 0.00 H new ATOM 0 HB2 ALA A 260 -1.480 -0.066 4.639 1.00 0.00 H new ATOM 0 HB3 ALA A 260 -2.458 0.559 3.291 1.00 0.00 H new ATOM 703 N ILE A 261 -1.773 4.187 4.420 1.00 0.00 N ATOM 704 CA ILE A 261 -1.935 5.463 3.735 1.00 0.00 C ATOM 705 C ILE A 261 -1.006 5.561 2.529 1.00 0.00 C ATOM 706 O ILE A 261 0.195 5.310 2.635 1.00 0.00 O ATOM 707 CB ILE A 261 -1.658 6.648 4.679 1.00 0.00 C ATOM 708 CG1 ILE A 261 -2.598 6.598 5.885 1.00 0.00 C ATOM 709 CG2 ILE A 261 -1.814 7.966 3.934 1.00 0.00 C ATOM 710 CD1 ILE A 261 -2.080 7.356 7.087 1.00 0.00 C ATOM 0 H ILE A 261 -0.994 4.157 5.078 1.00 0.00 H new ATOM 0 HA ILE A 261 -2.971 5.511 3.399 1.00 0.00 H new ATOM 0 HB ILE A 261 -0.632 6.575 5.039 1.00 0.00 H new ATOM 0 HG12 ILE A 261 -3.567 7.007 5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 261 -2.762 5.557 6.165 1.00 0.00 H new ATOM 0 HG21 ILE A 261 -1.615 8.794 4.614 1.00 0.00 H new ATOM 0 HG22 ILE A 261 -1.108 8.001 3.104 1.00 0.00 H new ATOM 0 HG23 ILE A 261 -2.831 8.048 3.549 1.00 0.00 H new ATOM 0 HD11 ILE A 261 -2.798 7.277 7.904 1.00 0.00 H new ATOM 0 HD12 ILE A 261 -1.126 6.933 7.400 1.00 0.00 H new ATOM 0 HD13 ILE A 261 -1.943 8.405 6.824 1.00 0.00 H new ATOM 722 N VAL A 262 -1.570 5.930 1.383 1.00 0.00 N ATOM 723 CA VAL A 262 -0.792 6.064 0.157 1.00 0.00 C ATOM 724 C VAL A 262 -1.167 7.336 -0.595 1.00 0.00 C ATOM 725 O VAL A 262 -2.343 7.593 -0.852 1.00 0.00 O ATOM 726 CB VAL A 262 -0.995 4.853 -0.772 1.00 0.00 C ATOM 727 CG1 VAL A 262 -0.191 5.020 -2.052 1.00 0.00 C ATOM 728 CG2 VAL A 262 -0.614 3.565 -0.058 1.00 0.00 C ATOM 0 H VAL A 262 -2.562 6.141 1.278 1.00 0.00 H new ATOM 0 HA VAL A 262 0.256 6.115 0.451 1.00 0.00 H new ATOM 0 HB VAL A 262 -2.050 4.796 -1.040 1.00 0.00 H new ATOM 0 HG11 VAL A 262 -0.347 4.154 -2.696 1.00 0.00 H new ATOM 0 HG12 VAL A 262 -0.516 5.922 -2.571 1.00 0.00 H new ATOM 0 HG13 VAL A 262 0.868 5.104 -1.808 1.00 0.00 H new ATOM 0 HG21 VAL A 262 -0.764 2.719 -0.729 1.00 0.00 H new ATOM 0 HG22 VAL A 262 0.433 3.611 0.241 1.00 0.00 H new ATOM 0 HG23 VAL A 262 -1.238 3.441 0.827 1.00 0.00 H new ATOM 738 N GLU A 263 -0.159 8.129 -0.946 1.00 0.00 N ATOM 739 CA GLU A 263 -0.385 9.375 -1.669 1.00 0.00 C ATOM 740 C GLU A 263 0.235 9.315 -3.062 1.00 0.00 C ATOM 741 O GLU A 263 1.456 9.354 -3.213 1.00 0.00 O ATOM 742 CB GLU A 263 0.199 10.555 -0.889 1.00 0.00 C ATOM 743 CG GLU A 263 0.066 11.886 -1.610 1.00 0.00 C ATOM 744 CD GLU A 263 0.194 13.072 -0.674 1.00 0.00 C ATOM 745 OE1 GLU A 263 1.252 13.201 -0.022 1.00 0.00 O ATOM 746 OE2 GLU A 263 -0.762 13.871 -0.592 1.00 0.00 O ATOM 0 H GLU A 263 0.820 7.931 -0.742 1.00 0.00 H new ATOM 0 HA GLU A 263 -1.461 9.515 -1.775 1.00 0.00 H new ATOM 0 HB2 GLU A 263 -0.300 10.623 0.078 1.00 0.00 H new ATOM 0 HB3 GLU A 263 1.253 10.362 -0.691 1.00 0.00 H new ATOM 0 HG2 GLU A 263 0.831 11.954 -2.383 1.00 0.00 H new ATOM 0 HG3 GLU A 263 -0.900 11.928 -2.113 1.00 0.00 H new ATOM 753 N PHE A 264 -0.616 9.220 -4.078 1.00 0.00 N ATOM 754 CA PHE A 264 -0.154 9.153 -5.459 1.00 0.00 C ATOM 755 C PHE A 264 0.428 10.492 -5.903 1.00 0.00 C ATOM 756 O PHE A 264 -0.096 11.553 -5.561 1.00 0.00 O ATOM 757 CB PHE A 264 -1.303 8.751 -6.385 1.00 0.00 C ATOM 758 CG PHE A 264 -1.479 7.265 -6.512 1.00 0.00 C ATOM 759 CD1 PHE A 264 -2.158 6.549 -5.540 1.00 0.00 C ATOM 760 CD2 PHE A 264 -0.966 6.584 -7.605 1.00 0.00 C ATOM 761 CE1 PHE A 264 -2.320 5.181 -5.654 1.00 0.00 C ATOM 762 CE2 PHE A 264 -1.126 5.216 -7.724 1.00 0.00 C ATOM 763 CZ PHE A 264 -1.805 4.514 -6.748 1.00 0.00 C ATOM 0 H PHE A 264 -1.630 9.188 -3.971 1.00 0.00 H new ATOM 0 HA PHE A 264 0.630 8.398 -5.517 1.00 0.00 H new ATOM 0 HB2 PHE A 264 -2.229 9.188 -6.012 1.00 0.00 H new ATOM 0 HB3 PHE A 264 -1.127 9.174 -7.374 1.00 0.00 H new ATOM 0 HD1 PHE A 264 -2.565 7.065 -4.683 1.00 0.00 H new ATOM 0 HD2 PHE A 264 -0.435 7.128 -8.372 1.00 0.00 H new ATOM 0 HE1 PHE A 264 -2.849 4.634 -4.888 1.00 0.00 H new ATOM 0 HE2 PHE A 264 -0.720 4.697 -8.580 1.00 0.00 H new ATOM 0 HZ PHE A 264 -1.933 3.446 -6.840 1.00 0.00 H new ATOM 773 N LEU A 265 1.513 10.435 -6.667 1.00 0.00 N ATOM 774 CA LEU A 265 2.168 11.642 -7.159 1.00 0.00 C ATOM 775 C LEU A 265 1.244 12.422 -8.089 1.00 0.00 C ATOM 776 O LEU A 265 1.325 13.647 -8.175 1.00 0.00 O ATOM 777 CB LEU A 265 3.462 11.282 -7.891 1.00 0.00 C ATOM 778 CG LEU A 265 4.674 10.990 -7.006 1.00 0.00 C ATOM 779 CD1 LEU A 265 5.833 10.472 -7.844 1.00 0.00 C ATOM 780 CD2 LEU A 265 5.085 12.237 -6.236 1.00 0.00 C ATOM 0 H LEU A 265 1.958 9.565 -6.960 1.00 0.00 H new ATOM 0 HA LEU A 265 2.406 12.272 -6.302 1.00 0.00 H new ATOM 0 HB2 LEU A 265 3.273 10.408 -8.514 1.00 0.00 H new ATOM 0 HB3 LEU A 265 3.716 12.102 -8.562 1.00 0.00 H new ATOM 0 HG LEU A 265 4.398 10.218 -6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 265 6.687 10.269 -7.198 1.00 0.00 H new ATOM 0 HD12 LEU A 265 5.535 9.554 -8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 265 6.109 11.221 -8.586 1.00 0.00 H new ATOM 0 HD21 LEU A 265 5.949 12.011 -5.611 1.00 0.00 H new ATOM 0 HD22 LEU A 265 5.343 13.030 -6.938 1.00 0.00 H new ATOM 0 HD23 LEU A 265 4.258 12.565 -5.606 1.00 0.00 H new ATOM 792 N GLU A 266 0.365 11.703 -8.781 1.00 0.00 N ATOM 793 CA GLU A 266 -0.575 12.329 -9.703 1.00 0.00 C ATOM 794 C GLU A 266 -2.015 12.015 -9.309 1.00 0.00 C ATOM 795 O GLU A 266 -2.346 10.899 -8.908 1.00 0.00 O ATOM 796 CB GLU A 266 -0.312 11.856 -11.134 1.00 0.00 C ATOM 797 CG GLU A 266 -1.321 12.378 -12.143 1.00 0.00 C ATOM 798 CD GLU A 266 -0.892 13.689 -12.773 1.00 0.00 C ATOM 799 OE1 GLU A 266 0.325 13.875 -12.983 1.00 0.00 O ATOM 800 OE2 GLU A 266 -1.772 14.528 -13.055 1.00 0.00 O ATOM 0 H GLU A 266 0.285 10.688 -8.720 1.00 0.00 H new ATOM 0 HA GLU A 266 -0.430 13.408 -9.652 1.00 0.00 H new ATOM 0 HB2 GLU A 266 0.687 12.173 -11.435 1.00 0.00 H new ATOM 0 HB3 GLU A 266 -0.321 10.766 -11.155 1.00 0.00 H new ATOM 0 HG2 GLU A 266 -1.465 11.633 -12.926 1.00 0.00 H new ATOM 0 HG3 GLU A 266 -2.284 12.514 -11.651 1.00 0.00 H new ATOM 807 N PRO A 267 -2.893 13.023 -9.424 1.00 0.00 N ATOM 808 CA PRO A 267 -4.312 12.880 -9.084 1.00 0.00 C ATOM 809 C PRO A 267 -5.057 11.988 -10.071 1.00 0.00 C ATOM 810 O PRO A 267 -5.856 11.138 -9.675 1.00 0.00 O ATOM 811 CB PRO A 267 -4.840 14.315 -9.155 1.00 0.00 C ATOM 812 CG PRO A 267 -3.917 15.012 -10.094 1.00 0.00 C ATOM 813 CD PRO A 267 -2.568 14.380 -9.894 1.00 0.00 C ATOM 0 HA PRO A 267 -4.453 12.407 -8.112 1.00 0.00 H new ATOM 0 HB2 PRO A 267 -5.868 14.341 -9.517 1.00 0.00 H new ATOM 0 HB3 PRO A 267 -4.836 14.787 -8.173 1.00 0.00 H new ATOM 0 HG2 PRO A 267 -4.252 14.900 -11.125 1.00 0.00 H new ATOM 0 HG3 PRO A 267 -3.882 16.081 -9.885 1.00 0.00 H new ATOM 0 HD2 PRO A 267 -1.994 14.358 -10.820 1.00 0.00 H new ATOM 0 HD3 PRO A 267 -1.973 14.927 -9.163 1.00 0.00 H new ATOM 821 N LEU A 268 -4.791 12.187 -11.357 1.00 0.00 N ATOM 822 CA LEU A 268 -5.436 11.400 -12.403 1.00 0.00 C ATOM 823 C LEU A 268 -5.122 9.916 -12.240 1.00 0.00 C ATOM 824 O LEU A 268 -6.006 9.068 -12.357 1.00 0.00 O ATOM 825 CB LEU A 268 -4.985 11.880 -13.783 1.00 0.00 C ATOM 826 CG LEU A 268 -5.356 13.318 -14.148 1.00 0.00 C ATOM 827 CD1 LEU A 268 -4.540 13.794 -15.339 1.00 0.00 C ATOM 828 CD2 LEU A 268 -6.846 13.425 -14.443 1.00 0.00 C ATOM 0 H LEU A 268 -4.133 12.887 -11.701 1.00 0.00 H new ATOM 0 HA LEU A 268 -6.514 11.537 -12.313 1.00 0.00 H new ATOM 0 HB2 LEU A 268 -3.901 11.779 -13.845 1.00 0.00 H new ATOM 0 HB3 LEU A 268 -5.410 11.214 -14.534 1.00 0.00 H new ATOM 0 HG LEU A 268 -5.127 13.960 -13.297 1.00 0.00 H new ATOM 0 HD11 LEU A 268 -4.818 14.819 -15.584 1.00 0.00 H new ATOM 0 HD12 LEU A 268 -3.479 13.755 -15.092 1.00 0.00 H new ATOM 0 HD13 LEU A 268 -4.737 13.150 -16.196 1.00 0.00 H new ATOM 0 HD21 LEU A 268 -7.093 14.455 -14.701 1.00 0.00 H new ATOM 0 HD22 LEU A 268 -7.100 12.771 -15.277 1.00 0.00 H new ATOM 0 HD23 LEU A 268 -7.414 13.126 -13.562 1.00 0.00 H new ATOM 840 N GLU A 269 -3.857 9.611 -11.967 1.00 0.00 N ATOM 841 CA GLU A 269 -3.427 8.229 -11.787 1.00 0.00 C ATOM 842 C GLU A 269 -4.117 7.598 -10.582 1.00 0.00 C ATOM 843 O GLU A 269 -4.628 6.481 -10.661 1.00 0.00 O ATOM 844 CB GLU A 269 -1.908 8.164 -11.611 1.00 0.00 C ATOM 845 CG GLU A 269 -1.137 8.330 -12.910 1.00 0.00 C ATOM 846 CD GLU A 269 0.260 8.876 -12.693 1.00 0.00 C ATOM 847 OE1 GLU A 269 0.888 8.514 -11.676 1.00 0.00 O ATOM 848 OE2 GLU A 269 0.726 9.666 -13.541 1.00 0.00 O ATOM 0 H GLU A 269 -3.113 10.301 -11.866 1.00 0.00 H new ATOM 0 HA GLU A 269 -3.707 7.668 -12.679 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -1.598 8.941 -10.913 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -1.643 7.207 -11.161 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -1.072 7.366 -13.415 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -1.686 9.000 -13.571 1.00 0.00 H new ATOM 855 N ALA A 270 -4.128 8.321 -9.467 1.00 0.00 N ATOM 856 CA ALA A 270 -4.756 7.833 -8.245 1.00 0.00 C ATOM 857 C ALA A 270 -6.179 7.356 -8.513 1.00 0.00 C ATOM 858 O ALA A 270 -6.546 6.236 -8.158 1.00 0.00 O ATOM 859 CB ALA A 270 -4.752 8.919 -7.180 1.00 0.00 C ATOM 0 H ALA A 270 -3.709 9.247 -9.385 1.00 0.00 H new ATOM 0 HA ALA A 270 -4.178 6.983 -7.882 1.00 0.00 H new ATOM 0 HB1 ALA A 270 -5.224 8.541 -6.273 1.00 0.00 H new ATOM 0 HB2 ALA A 270 -3.725 9.210 -6.960 1.00 0.00 H new ATOM 0 HB3 ALA A 270 -5.305 9.786 -7.542 1.00 0.00 H new ATOM 865 N ARG A 271 -6.977 8.214 -9.140 1.00 0.00 N ATOM 866 CA ARG A 271 -8.362 7.881 -9.453 1.00 0.00 C ATOM 867 C ARG A 271 -8.438 6.612 -10.297 1.00 0.00 C ATOM 868 O ARG A 271 -9.245 5.722 -10.029 1.00 0.00 O ATOM 869 CB ARG A 271 -9.033 9.040 -10.193 1.00 0.00 C ATOM 870 CG ARG A 271 -9.642 10.082 -9.268 1.00 0.00 C ATOM 871 CD ARG A 271 -10.393 11.149 -10.049 1.00 0.00 C ATOM 872 NE ARG A 271 -11.384 11.834 -9.224 1.00 0.00 N ATOM 873 CZ ARG A 271 -11.837 13.055 -9.483 1.00 0.00 C ATOM 874 NH1 ARG A 271 -11.390 13.722 -10.538 1.00 0.00 N ATOM 875 NH2 ARG A 271 -12.740 13.612 -8.685 1.00 0.00 N ATOM 0 H ARG A 271 -6.689 9.145 -9.441 1.00 0.00 H new ATOM 0 HA ARG A 271 -8.888 7.705 -8.515 1.00 0.00 H new ATOM 0 HB2 ARG A 271 -8.298 9.523 -10.837 1.00 0.00 H new ATOM 0 HB3 ARG A 271 -9.813 8.642 -10.842 1.00 0.00 H new ATOM 0 HG2 ARG A 271 -10.322 9.596 -8.568 1.00 0.00 H new ATOM 0 HG3 ARG A 271 -8.855 10.549 -8.676 1.00 0.00 H new ATOM 0 HD2 ARG A 271 -9.684 11.877 -10.443 1.00 0.00 H new ATOM 0 HD3 ARG A 271 -10.888 10.691 -10.905 1.00 0.00 H new ATOM 0 HE ARG A 271 -11.748 11.348 -8.404 1.00 0.00 H new ATOM 0 HH11 ARG A 271 -10.696 13.297 -11.153 1.00 0.00 H new ATOM 0 HH12 ARG A 271 -11.740 14.660 -10.734 1.00 0.00 H new ATOM 0 HH21 ARG A 271 -13.086 13.102 -7.872 1.00 0.00 H new ATOM 0 HH22 ARG A 271 -13.088 14.550 -8.885 1.00 0.00 H new ATOM 889 N LYS A 272 -7.593 6.537 -11.320 1.00 0.00 N ATOM 890 CA LYS A 272 -7.563 5.378 -12.204 1.00 0.00 C ATOM 891 C LYS A 272 -7.408 4.088 -11.406 1.00 0.00 C ATOM 892 O LYS A 272 -8.274 3.214 -11.445 1.00 0.00 O ATOM 893 CB LYS A 272 -6.418 5.508 -13.211 1.00 0.00 C ATOM 894 CG LYS A 272 -6.275 4.307 -14.129 1.00 0.00 C ATOM 895 CD LYS A 272 -4.863 4.188 -14.677 1.00 0.00 C ATOM 896 CE LYS A 272 -4.702 2.944 -15.538 1.00 0.00 C ATOM 897 NZ LYS A 272 -3.270 2.643 -15.813 1.00 0.00 N ATOM 0 H LYS A 272 -6.920 7.266 -11.557 1.00 0.00 H new ATOM 0 HA LYS A 272 -8.510 5.339 -12.743 1.00 0.00 H new ATOM 0 HB2 LYS A 272 -6.578 6.400 -13.816 1.00 0.00 H new ATOM 0 HB3 LYS A 272 -5.484 5.653 -12.669 1.00 0.00 H new ATOM 0 HG2 LYS A 272 -6.532 3.399 -13.584 1.00 0.00 H new ATOM 0 HG3 LYS A 272 -6.981 4.394 -14.955 1.00 0.00 H new ATOM 0 HD2 LYS A 272 -4.625 5.073 -15.267 1.00 0.00 H new ATOM 0 HD3 LYS A 272 -4.153 4.154 -13.851 1.00 0.00 H new ATOM 0 HE2 LYS A 272 -5.162 2.093 -15.036 1.00 0.00 H new ATOM 0 HE3 LYS A 272 -5.232 3.083 -16.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 272 -3.202 1.789 -16.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 272 -2.837 3.445 -16.314 1.00 0.00 H new ATOM 0 HZ3 LYS A 272 -2.770 2.485 -14.915 1.00 0.00 H new ATOM 911 N ALA A 273 -6.300 3.976 -10.680 1.00 0.00 N ATOM 912 CA ALA A 273 -6.034 2.795 -9.869 1.00 0.00 C ATOM 913 C ALA A 273 -7.163 2.545 -8.875 1.00 0.00 C ATOM 914 O ALA A 273 -7.651 1.422 -8.744 1.00 0.00 O ATOM 915 CB ALA A 273 -4.708 2.944 -9.138 1.00 0.00 C ATOM 0 H ALA A 273 -5.572 4.689 -10.637 1.00 0.00 H new ATOM 0 HA ALA A 273 -5.975 1.934 -10.535 1.00 0.00 H new ATOM 0 HB1 ALA A 273 -4.522 2.054 -8.536 1.00 0.00 H new ATOM 0 HB2 ALA A 273 -3.904 3.065 -9.864 1.00 0.00 H new ATOM 0 HB3 ALA A 273 -4.746 3.819 -8.490 1.00 0.00 H new ATOM 921 N PHE A 274 -7.574 3.598 -8.177 1.00 0.00 N ATOM 922 CA PHE A 274 -8.645 3.492 -7.193 1.00 0.00 C ATOM 923 C PHE A 274 -9.843 2.745 -7.771 1.00 0.00 C ATOM 924 O PHE A 274 -10.422 1.877 -7.117 1.00 0.00 O ATOM 925 CB PHE A 274 -9.075 4.884 -6.725 1.00 0.00 C ATOM 926 CG PHE A 274 -10.007 4.859 -5.547 1.00 0.00 C ATOM 927 CD1 PHE A 274 -11.258 4.271 -5.648 1.00 0.00 C ATOM 928 CD2 PHE A 274 -9.633 5.424 -4.338 1.00 0.00 C ATOM 929 CE1 PHE A 274 -12.117 4.245 -4.566 1.00 0.00 C ATOM 930 CE2 PHE A 274 -10.488 5.401 -3.253 1.00 0.00 C ATOM 931 CZ PHE A 274 -11.732 4.812 -3.367 1.00 0.00 C ATOM 0 H PHE A 274 -7.182 4.535 -8.274 1.00 0.00 H new ATOM 0 HA PHE A 274 -8.266 2.930 -6.340 1.00 0.00 H new ATOM 0 HB2 PHE A 274 -8.188 5.461 -6.464 1.00 0.00 H new ATOM 0 HB3 PHE A 274 -9.561 5.403 -7.552 1.00 0.00 H new ATOM 0 HD1 PHE A 274 -11.565 3.828 -6.584 1.00 0.00 H new ATOM 0 HD2 PHE A 274 -8.662 5.888 -4.243 1.00 0.00 H new ATOM 0 HE1 PHE A 274 -13.088 3.782 -4.658 1.00 0.00 H new ATOM 0 HE2 PHE A 274 -10.184 5.843 -2.316 1.00 0.00 H new ATOM 0 HZ PHE A 274 -12.402 4.795 -2.520 1.00 0.00 H new ATOM 941 N ARG A 275 -10.209 3.089 -9.002 1.00 0.00 N ATOM 942 CA ARG A 275 -11.339 2.452 -9.668 1.00 0.00 C ATOM 943 C ARG A 275 -11.071 0.967 -9.893 1.00 0.00 C ATOM 944 O ARG A 275 -11.839 0.112 -9.451 1.00 0.00 O ATOM 945 CB ARG A 275 -11.622 3.139 -11.005 1.00 0.00 C ATOM 946 CG ARG A 275 -12.357 4.462 -10.867 1.00 0.00 C ATOM 947 CD ARG A 275 -12.891 4.946 -12.206 1.00 0.00 C ATOM 948 NE ARG A 275 -14.052 5.818 -12.050 1.00 0.00 N ATOM 949 CZ ARG A 275 -15.269 5.375 -11.755 1.00 0.00 C ATOM 950 NH1 ARG A 275 -15.484 4.078 -11.586 1.00 0.00 N ATOM 951 NH2 ARG A 275 -16.275 6.231 -11.629 1.00 0.00 N ATOM 0 H ARG A 275 -9.740 3.804 -9.558 1.00 0.00 H new ATOM 0 HA ARG A 275 -12.212 2.552 -9.024 1.00 0.00 H new ATOM 0 HB2 ARG A 275 -10.678 3.310 -11.523 1.00 0.00 H new ATOM 0 HB3 ARG A 275 -12.212 2.469 -11.630 1.00 0.00 H new ATOM 0 HG2 ARG A 275 -13.183 4.349 -10.164 1.00 0.00 H new ATOM 0 HG3 ARG A 275 -11.684 5.211 -10.450 1.00 0.00 H new ATOM 0 HD2 ARG A 275 -12.104 5.482 -12.738 1.00 0.00 H new ATOM 0 HD3 ARG A 275 -13.163 4.087 -12.820 1.00 0.00 H new ATOM 0 HE ARG A 275 -13.921 6.822 -12.174 1.00 0.00 H new ATOM 0 HH11 ARG A 275 -14.714 3.417 -11.682 1.00 0.00 H new ATOM 0 HH12 ARG A 275 -16.420 3.741 -11.360 1.00 0.00 H new ATOM 0 HH21 ARG A 275 -16.114 7.230 -11.759 1.00 0.00 H new ATOM 0 HH22 ARG A 275 -17.209 5.890 -11.402 1.00 0.00 H new ATOM 965 N HIS A 276 -9.976 0.667 -10.585 1.00 0.00 N ATOM 966 CA HIS A 276 -9.606 -0.715 -10.869 1.00 0.00 C ATOM 967 C HIS A 276 -9.566 -1.541 -9.587 1.00 0.00 C ATOM 968 O HIS A 276 -10.270 -2.543 -9.459 1.00 0.00 O ATOM 969 CB HIS A 276 -8.247 -0.769 -11.568 1.00 0.00 C ATOM 970 CG HIS A 276 -8.164 0.103 -12.783 1.00 0.00 C ATOM 971 ND1 HIS A 276 -9.075 0.043 -13.816 1.00 0.00 N ATOM 972 CD2 HIS A 276 -7.271 1.061 -13.125 1.00 0.00 C ATOM 973 CE1 HIS A 276 -8.745 0.925 -14.743 1.00 0.00 C ATOM 974 NE2 HIS A 276 -7.654 1.556 -14.347 1.00 0.00 N ATOM 0 H HIS A 276 -9.330 1.362 -10.959 1.00 0.00 H new ATOM 0 HA HIS A 276 -10.362 -1.139 -11.530 1.00 0.00 H new ATOM 0 HB2 HIS A 276 -7.472 -0.469 -10.862 1.00 0.00 H new ATOM 0 HB3 HIS A 276 -8.036 -1.799 -11.855 1.00 0.00 H new ATOM 0 HD1 HIS A 276 -9.878 -0.584 -13.858 1.00 0.00 H new ATOM 0 HD2 HIS A 276 -6.417 1.377 -12.545 1.00 0.00 H new ATOM 0 HE1 HIS A 276 -9.276 1.100 -15.667 1.00 0.00 H new ATOM 983 N LEU A 277 -8.736 -1.116 -8.641 1.00 0.00 N ATOM 984 CA LEU A 277 -8.602 -1.817 -7.369 1.00 0.00 C ATOM 985 C LEU A 277 -9.947 -1.915 -6.657 1.00 0.00 C ATOM 986 O LEU A 277 -10.341 -2.986 -6.197 1.00 0.00 O ATOM 987 CB LEU A 277 -7.589 -1.100 -6.473 1.00 0.00 C ATOM 988 CG LEU A 277 -6.220 -0.826 -7.095 1.00 0.00 C ATOM 989 CD1 LEU A 277 -5.291 -0.181 -6.078 1.00 0.00 C ATOM 990 CD2 LEU A 277 -5.612 -2.112 -7.635 1.00 0.00 C ATOM 0 H LEU A 277 -8.146 -0.289 -8.731 1.00 0.00 H new ATOM 0 HA LEU A 277 -8.246 -2.826 -7.575 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -8.020 -0.149 -6.159 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -7.444 -1.697 -5.573 1.00 0.00 H new ATOM 0 HG LEU A 277 -6.352 -0.133 -7.926 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -4.321 0.007 -6.539 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -5.720 0.762 -5.740 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -5.165 -0.849 -5.226 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -4.638 -1.897 -8.074 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -5.494 -2.828 -6.822 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -6.268 -2.533 -8.397 1.00 0.00 H new ATOM 1002 N ALA A 278 -10.650 -0.789 -6.573 1.00 0.00 N ATOM 1003 CA ALA A 278 -11.953 -0.749 -5.921 1.00 0.00 C ATOM 1004 C ALA A 278 -12.742 -2.025 -6.194 1.00 0.00 C ATOM 1005 O ALA A 278 -12.837 -2.476 -7.335 1.00 0.00 O ATOM 1006 CB ALA A 278 -12.738 0.469 -6.386 1.00 0.00 C ATOM 0 H ALA A 278 -10.338 0.107 -6.948 1.00 0.00 H new ATOM 0 HA ALA A 278 -11.792 -0.675 -4.845 1.00 0.00 H new ATOM 0 HB1 ALA A 278 -13.709 0.487 -5.891 1.00 0.00 H new ATOM 0 HB2 ALA A 278 -12.186 1.375 -6.135 1.00 0.00 H new ATOM 0 HB3 ALA A 278 -12.882 0.419 -7.465 1.00 0.00 H new ATOM 1012 N TYR A 279 -13.307 -2.603 -5.139 1.00 0.00 N ATOM 1013 CA TYR A 279 -14.085 -3.829 -5.264 1.00 0.00 C ATOM 1014 C TYR A 279 -13.186 -5.013 -5.605 1.00 0.00 C ATOM 1015 O TYR A 279 -13.495 -5.807 -6.493 1.00 0.00 O ATOM 1016 CB TYR A 279 -15.162 -3.667 -6.339 1.00 0.00 C ATOM 1017 CG TYR A 279 -15.965 -2.393 -6.204 1.00 0.00 C ATOM 1018 CD1 TYR A 279 -15.558 -1.222 -6.832 1.00 0.00 C ATOM 1019 CD2 TYR A 279 -17.130 -2.359 -5.447 1.00 0.00 C ATOM 1020 CE1 TYR A 279 -16.288 -0.055 -6.711 1.00 0.00 C ATOM 1021 CE2 TYR A 279 -17.867 -1.198 -5.322 1.00 0.00 C ATOM 1022 CZ TYR A 279 -17.442 -0.048 -5.956 1.00 0.00 C ATOM 1023 OH TYR A 279 -18.173 1.111 -5.832 1.00 0.00 O ATOM 0 H TYR A 279 -13.240 -2.241 -4.188 1.00 0.00 H new ATOM 0 HA TYR A 279 -14.564 -4.024 -4.305 1.00 0.00 H new ATOM 0 HB2 TYR A 279 -14.689 -3.686 -7.321 1.00 0.00 H new ATOM 0 HB3 TYR A 279 -15.839 -4.520 -6.294 1.00 0.00 H new ATOM 0 HD1 TYR A 279 -14.655 -1.224 -7.425 1.00 0.00 H new ATOM 0 HD2 TYR A 279 -17.465 -3.256 -4.948 1.00 0.00 H new ATOM 0 HE1 TYR A 279 -15.957 0.846 -7.205 1.00 0.00 H new ATOM 0 HE2 TYR A 279 -18.771 -1.190 -4.731 1.00 0.00 H new ATOM 0 HH TYR A 279 -18.957 0.945 -5.268 1.00 0.00 H new ATOM 1033 N SER A 280 -12.071 -5.125 -4.890 1.00 0.00 N ATOM 1034 CA SER A 280 -11.123 -6.210 -5.117 1.00 0.00 C ATOM 1035 C SER A 280 -10.534 -6.701 -3.798 1.00 0.00 C ATOM 1036 O SER A 280 -10.709 -6.074 -2.754 1.00 0.00 O ATOM 1037 CB SER A 280 -10.002 -5.749 -6.050 1.00 0.00 C ATOM 1038 OG SER A 280 -10.519 -5.330 -7.301 1.00 0.00 O ATOM 0 H SER A 280 -11.802 -4.478 -4.149 1.00 0.00 H new ATOM 0 HA SER A 280 -11.658 -7.036 -5.585 1.00 0.00 H new ATOM 0 HB2 SER A 280 -9.453 -4.929 -5.587 1.00 0.00 H new ATOM 0 HB3 SER A 280 -9.292 -6.563 -6.200 1.00 0.00 H new ATOM 0 HG SER A 280 -10.621 -4.355 -7.303 1.00 0.00 H new ATOM 1044 N LYS A 281 -9.833 -7.829 -3.854 1.00 0.00 N ATOM 1045 CA LYS A 281 -9.215 -8.406 -2.666 1.00 0.00 C ATOM 1046 C LYS A 281 -7.696 -8.439 -2.805 1.00 0.00 C ATOM 1047 O LYS A 281 -7.167 -8.734 -3.876 1.00 0.00 O ATOM 1048 CB LYS A 281 -9.747 -9.821 -2.426 1.00 0.00 C ATOM 1049 CG LYS A 281 -9.215 -10.846 -3.413 1.00 0.00 C ATOM 1050 CD LYS A 281 -10.178 -12.010 -3.581 1.00 0.00 C ATOM 1051 CE LYS A 281 -11.217 -11.724 -4.654 1.00 0.00 C ATOM 1052 NZ LYS A 281 -11.816 -12.976 -5.194 1.00 0.00 N ATOM 0 H LYS A 281 -9.679 -8.362 -4.710 1.00 0.00 H new ATOM 0 HA LYS A 281 -9.471 -7.779 -1.812 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -9.485 -10.132 -1.415 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -10.835 -9.805 -2.482 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -9.047 -10.369 -4.379 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -8.250 -11.218 -3.068 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -9.621 -12.909 -3.843 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -10.678 -12.210 -2.633 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -12.004 -11.095 -4.239 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -10.755 -11.163 -5.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.519 -12.738 -5.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -11.069 -13.566 -5.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -12.279 -13.500 -4.424 1.00 0.00 H new ATOM 1066 N PHE A 282 -7.001 -8.137 -1.713 1.00 0.00 N ATOM 1067 CA PHE A 282 -5.543 -8.132 -1.713 1.00 0.00 C ATOM 1068 C PHE A 282 -4.995 -9.548 -1.557 1.00 0.00 C ATOM 1069 O PHE A 282 -4.364 -10.086 -2.467 1.00 0.00 O ATOM 1070 CB PHE A 282 -5.014 -7.242 -0.587 1.00 0.00 C ATOM 1071 CG PHE A 282 -3.592 -7.537 -0.206 1.00 0.00 C ATOM 1072 CD1 PHE A 282 -2.543 -7.082 -0.988 1.00 0.00 C ATOM 1073 CD2 PHE A 282 -3.304 -8.270 0.934 1.00 0.00 C ATOM 1074 CE1 PHE A 282 -1.232 -7.352 -0.641 1.00 0.00 C ATOM 1075 CE2 PHE A 282 -1.996 -8.542 1.287 1.00 0.00 C ATOM 1076 CZ PHE A 282 -0.959 -8.084 0.498 1.00 0.00 C ATOM 0 H PHE A 282 -7.424 -7.893 -0.817 1.00 0.00 H new ATOM 0 HA PHE A 282 -5.206 -7.733 -2.670 1.00 0.00 H new ATOM 0 HB2 PHE A 282 -5.090 -6.199 -0.893 1.00 0.00 H new ATOM 0 HB3 PHE A 282 -5.649 -7.364 0.290 1.00 0.00 H new ATOM 0 HD1 PHE A 282 -2.752 -6.509 -1.880 1.00 0.00 H new ATOM 0 HD2 PHE A 282 -4.111 -8.633 1.554 1.00 0.00 H new ATOM 0 HE1 PHE A 282 -0.423 -6.991 -1.259 1.00 0.00 H new ATOM 0 HE2 PHE A 282 -1.785 -9.112 2.179 1.00 0.00 H new ATOM 0 HZ PHE A 282 0.064 -8.298 0.771 1.00 0.00 H new ATOM 1086 N HIS A 283 -5.239 -10.146 -0.395 1.00 0.00 N ATOM 1087 CA HIS A 283 -4.771 -11.499 -0.118 1.00 0.00 C ATOM 1088 C HIS A 283 -5.945 -12.441 0.130 1.00 0.00 C ATOM 1089 O HIS A 283 -6.291 -13.256 -0.725 1.00 0.00 O ATOM 1090 CB HIS A 283 -3.837 -11.500 1.093 1.00 0.00 C ATOM 1091 CG HIS A 283 -2.406 -11.226 0.746 1.00 0.00 C ATOM 1092 ND1 HIS A 283 -1.370 -11.387 1.642 1.00 0.00 N ATOM 1093 CD2 HIS A 283 -1.841 -10.800 -0.408 1.00 0.00 C ATOM 1094 CE1 HIS A 283 -0.230 -11.070 1.055 1.00 0.00 C ATOM 1095 NE2 HIS A 283 -0.488 -10.711 -0.190 1.00 0.00 N ATOM 0 H HIS A 283 -5.758 -9.715 0.370 1.00 0.00 H new ATOM 0 HA HIS A 283 -4.223 -11.853 -0.991 1.00 0.00 H new ATOM 0 HB2 HIS A 283 -4.179 -10.750 1.806 1.00 0.00 H new ATOM 0 HB3 HIS A 283 -3.903 -12.467 1.591 1.00 0.00 H new ATOM 0 HD2 HIS A 283 -2.358 -10.573 -1.329 1.00 0.00 H new ATOM 0 HE1 HIS A 283 0.747 -11.099 1.515 1.00 0.00 H new ATOM 0 HE2 HIS A 283 0.205 -10.416 -0.878 1.00 0.00 H new ATOM 1104 N HIS A 284 -6.554 -12.323 1.305 1.00 0.00 N ATOM 1105 CA HIS A 284 -7.691 -13.164 1.666 1.00 0.00 C ATOM 1106 C HIS A 284 -8.873 -12.314 2.121 1.00 0.00 C ATOM 1107 O HIS A 284 -9.987 -12.815 2.278 1.00 0.00 O ATOM 1108 CB HIS A 284 -7.296 -14.144 2.771 1.00 0.00 C ATOM 1109 CG HIS A 284 -6.463 -13.525 3.851 1.00 0.00 C ATOM 1110 ND1 HIS A 284 -7.003 -12.963 4.988 1.00 0.00 N ATOM 1111 CD2 HIS A 284 -5.122 -13.384 3.963 1.00 0.00 C ATOM 1112 CE1 HIS A 284 -6.030 -12.501 5.753 1.00 0.00 C ATOM 1113 NE2 HIS A 284 -4.878 -12.744 5.154 1.00 0.00 N ATOM 0 H HIS A 284 -6.280 -11.653 2.024 1.00 0.00 H new ATOM 0 HA HIS A 284 -7.991 -13.727 0.782 1.00 0.00 H new ATOM 0 HB2 HIS A 284 -8.200 -14.562 3.215 1.00 0.00 H new ATOM 0 HB3 HIS A 284 -6.745 -14.974 2.329 1.00 0.00 H new ATOM 0 HD2 HIS A 284 -4.381 -13.713 3.249 1.00 0.00 H new ATOM 0 HE1 HIS A 284 -6.155 -12.008 6.706 1.00 0.00 H new ATOM 0 HE2 HIS A 284 -3.957 -12.497 5.517 1.00 0.00 H new ATOM 1122 N VAL A 285 -8.623 -11.026 2.332 1.00 0.00 N ATOM 1123 CA VAL A 285 -9.667 -10.106 2.770 1.00 0.00 C ATOM 1124 C VAL A 285 -9.902 -9.010 1.736 1.00 0.00 C ATOM 1125 O VAL A 285 -9.013 -8.650 0.964 1.00 0.00 O ATOM 1126 CB VAL A 285 -9.312 -9.456 4.120 1.00 0.00 C ATOM 1127 CG1 VAL A 285 -9.274 -10.502 5.223 1.00 0.00 C ATOM 1128 CG2 VAL A 285 -7.983 -8.721 4.024 1.00 0.00 C ATOM 0 H VAL A 285 -7.707 -10.595 2.207 1.00 0.00 H new ATOM 0 HA VAL A 285 -10.578 -10.693 2.887 1.00 0.00 H new ATOM 0 HB VAL A 285 -10.086 -8.730 4.368 1.00 0.00 H new ATOM 0 HG11 VAL A 285 -9.022 -10.024 6.169 1.00 0.00 H new ATOM 0 HG12 VAL A 285 -10.251 -10.978 5.306 1.00 0.00 H new ATOM 0 HG13 VAL A 285 -8.522 -11.255 4.985 1.00 0.00 H new ATOM 0 HG21 VAL A 285 -7.748 -8.268 4.987 1.00 0.00 H new ATOM 0 HG22 VAL A 285 -7.197 -9.425 3.752 1.00 0.00 H new ATOM 0 HG23 VAL A 285 -8.052 -7.943 3.264 1.00 0.00 H new ATOM 1138 N PRO A 286 -11.128 -8.466 1.719 1.00 0.00 N ATOM 1139 CA PRO A 286 -11.508 -7.402 0.786 1.00 0.00 C ATOM 1140 C PRO A 286 -10.819 -6.079 1.101 1.00 0.00 C ATOM 1141 O PRO A 286 -10.554 -5.767 2.263 1.00 0.00 O ATOM 1142 CB PRO A 286 -13.021 -7.278 0.987 1.00 0.00 C ATOM 1143 CG PRO A 286 -13.260 -7.772 2.372 1.00 0.00 C ATOM 1144 CD PRO A 286 -12.236 -8.847 2.611 1.00 0.00 C ATOM 0 HA PRO A 286 -11.217 -7.636 -0.238 1.00 0.00 H new ATOM 0 HB2 PRO A 286 -13.353 -6.246 0.872 1.00 0.00 H new ATOM 0 HB3 PRO A 286 -13.568 -7.872 0.255 1.00 0.00 H new ATOM 0 HG2 PRO A 286 -13.155 -6.965 3.097 1.00 0.00 H new ATOM 0 HG3 PRO A 286 -14.271 -8.166 2.477 1.00 0.00 H new ATOM 0 HD2 PRO A 286 -11.920 -8.877 3.654 1.00 0.00 H new ATOM 0 HD3 PRO A 286 -12.626 -9.835 2.368 1.00 0.00 H new ATOM 1152 N LEU A 287 -10.530 -5.305 0.061 1.00 0.00 N ATOM 1153 CA LEU A 287 -9.871 -4.014 0.228 1.00 0.00 C ATOM 1154 C LEU A 287 -10.891 -2.880 0.242 1.00 0.00 C ATOM 1155 O LEU A 287 -11.723 -2.768 -0.659 1.00 0.00 O ATOM 1156 CB LEU A 287 -8.856 -3.789 -0.894 1.00 0.00 C ATOM 1157 CG LEU A 287 -7.601 -4.661 -0.848 1.00 0.00 C ATOM 1158 CD1 LEU A 287 -6.906 -4.667 -2.201 1.00 0.00 C ATOM 1159 CD2 LEU A 287 -6.653 -4.174 0.238 1.00 0.00 C ATOM 0 H LEU A 287 -10.741 -5.549 -0.907 1.00 0.00 H new ATOM 0 HA LEU A 287 -9.350 -4.021 1.185 1.00 0.00 H new ATOM 0 HB2 LEU A 287 -9.356 -3.957 -1.848 1.00 0.00 H new ATOM 0 HB3 LEU A 287 -8.549 -2.743 -0.875 1.00 0.00 H new ATOM 0 HG LEU A 287 -7.899 -5.682 -0.611 1.00 0.00 H new ATOM 0 HD11 LEU A 287 -6.015 -5.293 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 287 -7.584 -5.063 -2.957 1.00 0.00 H new ATOM 0 HD13 LEU A 287 -6.620 -3.650 -2.468 1.00 0.00 H new ATOM 0 HD21 LEU A 287 -5.765 -4.806 0.256 1.00 0.00 H new ATOM 0 HD22 LEU A 287 -6.361 -3.144 0.031 1.00 0.00 H new ATOM 0 HD23 LEU A 287 -7.153 -4.222 1.206 1.00 0.00 H new ATOM 1171 N TYR A 288 -10.819 -2.039 1.268 1.00 0.00 N ATOM 1172 CA TYR A 288 -11.736 -0.913 1.399 1.00 0.00 C ATOM 1173 C TYR A 288 -10.998 0.412 1.231 1.00 0.00 C ATOM 1174 O TYR A 288 -10.344 0.894 2.156 1.00 0.00 O ATOM 1175 CB TYR A 288 -12.433 -0.952 2.760 1.00 0.00 C ATOM 1176 CG TYR A 288 -13.601 -1.911 2.815 1.00 0.00 C ATOM 1177 CD1 TYR A 288 -14.871 -1.512 2.419 1.00 0.00 C ATOM 1178 CD2 TYR A 288 -13.434 -3.215 3.263 1.00 0.00 C ATOM 1179 CE1 TYR A 288 -15.942 -2.384 2.468 1.00 0.00 C ATOM 1180 CE2 TYR A 288 -14.498 -4.095 3.314 1.00 0.00 C ATOM 1181 CZ TYR A 288 -15.750 -3.674 2.916 1.00 0.00 C ATOM 1182 OH TYR A 288 -16.813 -4.547 2.966 1.00 0.00 O ATOM 0 H TYR A 288 -10.135 -2.116 2.021 1.00 0.00 H new ATOM 0 HA TYR A 288 -12.486 -0.994 0.612 1.00 0.00 H new ATOM 0 HB2 TYR A 288 -11.707 -1.233 3.523 1.00 0.00 H new ATOM 0 HB3 TYR A 288 -12.784 0.050 3.008 1.00 0.00 H new ATOM 0 HD1 TYR A 288 -15.024 -0.503 2.067 1.00 0.00 H new ATOM 0 HD2 TYR A 288 -12.455 -3.547 3.577 1.00 0.00 H new ATOM 0 HE1 TYR A 288 -16.923 -2.057 2.157 1.00 0.00 H new ATOM 0 HE2 TYR A 288 -14.350 -5.106 3.663 1.00 0.00 H new ATOM 0 HH TYR A 288 -16.508 -5.415 3.304 1.00 0.00 H new ATOM 1192 N LEU A 289 -11.110 0.996 0.043 1.00 0.00 N ATOM 1193 CA LEU A 289 -10.455 2.267 -0.249 1.00 0.00 C ATOM 1194 C LEU A 289 -11.351 3.441 0.132 1.00 0.00 C ATOM 1195 O LEU A 289 -12.564 3.400 -0.071 1.00 0.00 O ATOM 1196 CB LEU A 289 -10.094 2.347 -1.734 1.00 0.00 C ATOM 1197 CG LEU A 289 -9.130 1.278 -2.249 1.00 0.00 C ATOM 1198 CD1 LEU A 289 -8.954 1.399 -3.754 1.00 0.00 C ATOM 1199 CD2 LEU A 289 -7.787 1.385 -1.542 1.00 0.00 C ATOM 0 H LEU A 289 -11.648 0.610 -0.733 1.00 0.00 H new ATOM 0 HA LEU A 289 -9.542 2.323 0.344 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -11.014 2.288 -2.315 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -9.657 3.326 -1.929 1.00 0.00 H new ATOM 0 HG LEU A 289 -9.555 0.298 -2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -8.265 0.630 -4.103 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -9.919 1.271 -4.245 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -8.552 2.383 -3.995 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -7.114 0.616 -1.921 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -7.356 2.369 -1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -7.928 1.247 -0.470 1.00 0.00 H new ATOM 1211 N GLU A 290 -10.743 4.487 0.683 1.00 0.00 N ATOM 1212 CA GLU A 290 -11.487 5.673 1.091 1.00 0.00 C ATOM 1213 C GLU A 290 -10.643 6.932 0.914 1.00 0.00 C ATOM 1214 O GLU A 290 -9.565 7.057 1.495 1.00 0.00 O ATOM 1215 CB GLU A 290 -11.932 5.547 2.550 1.00 0.00 C ATOM 1216 CG GLU A 290 -13.226 6.283 2.857 1.00 0.00 C ATOM 1217 CD GLU A 290 -13.305 6.746 4.299 1.00 0.00 C ATOM 1218 OE1 GLU A 290 -13.806 5.974 5.144 1.00 0.00 O ATOM 1219 OE2 GLU A 290 -12.865 7.880 4.582 1.00 0.00 O ATOM 0 H GLU A 290 -9.739 4.537 0.857 1.00 0.00 H new ATOM 0 HA GLU A 290 -12.368 5.754 0.455 1.00 0.00 H new ATOM 0 HB2 GLU A 290 -12.057 4.492 2.793 1.00 0.00 H new ATOM 0 HB3 GLU A 290 -11.143 5.931 3.196 1.00 0.00 H new ATOM 0 HG2 GLU A 290 -13.314 7.146 2.197 1.00 0.00 H new ATOM 0 HG3 GLU A 290 -14.071 5.629 2.642 1.00 0.00 H new ATOM 1226 N TRP A 291 -11.140 7.862 0.106 1.00 0.00 N ATOM 1227 CA TRP A 291 -10.432 9.111 -0.149 1.00 0.00 C ATOM 1228 C TRP A 291 -10.117 9.834 1.155 1.00 0.00 C ATOM 1229 O TRP A 291 -10.865 9.735 2.127 1.00 0.00 O ATOM 1230 CB TRP A 291 -11.264 10.016 -1.060 1.00 0.00 C ATOM 1231 CG TRP A 291 -11.421 9.476 -2.449 1.00 0.00 C ATOM 1232 CD1 TRP A 291 -12.581 9.070 -3.045 1.00 0.00 C ATOM 1233 CD2 TRP A 291 -10.383 9.283 -3.416 1.00 0.00 C ATOM 1234 NE1 TRP A 291 -12.327 8.636 -4.323 1.00 0.00 N ATOM 1235 CE2 TRP A 291 -10.986 8.757 -4.575 1.00 0.00 C ATOM 1236 CE3 TRP A 291 -9.003 9.504 -3.416 1.00 0.00 C ATOM 1237 CZ2 TRP A 291 -10.255 8.449 -5.720 1.00 0.00 C ATOM 1238 CZ3 TRP A 291 -8.279 9.198 -4.553 1.00 0.00 C ATOM 1239 CH2 TRP A 291 -8.906 8.676 -5.692 1.00 0.00 C ATOM 0 H TRP A 291 -12.030 7.775 -0.384 1.00 0.00 H new ATOM 0 HA TRP A 291 -9.492 8.872 -0.646 1.00 0.00 H new ATOM 0 HB2 TRP A 291 -12.251 10.156 -0.618 1.00 0.00 H new ATOM 0 HB3 TRP A 291 -10.795 10.999 -1.111 1.00 0.00 H new ATOM 0 HD1 TRP A 291 -13.555 9.088 -2.579 1.00 0.00 H new ATOM 0 HE1 TRP A 291 -13.024 8.281 -4.978 1.00 0.00 H new ATOM 0 HE3 TRP A 291 -8.511 9.907 -2.543 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 -10.736 8.045 -6.599 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 -7.212 9.364 -4.564 1.00 0.00 H new ATOM 0 HH2 TRP A 291 -8.313 8.448 -6.565 1.00 0.00 H new ATOM 1250 N ALA A 292 -9.004 10.561 1.170 1.00 0.00 N ATOM 1251 CA ALA A 292 -8.592 11.303 2.355 1.00 0.00 C ATOM 1252 C ALA A 292 -8.828 12.799 2.176 1.00 0.00 C ATOM 1253 O ALA A 292 -8.683 13.349 1.084 1.00 0.00 O ATOM 1254 CB ALA A 292 -7.127 11.031 2.665 1.00 0.00 C ATOM 0 H ALA A 292 -8.372 10.652 0.375 1.00 0.00 H new ATOM 0 HA ALA A 292 -9.199 10.964 3.195 1.00 0.00 H new ATOM 0 HB1 ALA A 292 -6.833 11.592 3.552 1.00 0.00 H new ATOM 0 HB2 ALA A 292 -6.985 9.965 2.845 1.00 0.00 H new ATOM 0 HB3 ALA A 292 -6.513 11.341 1.820 1.00 0.00 H new