USER MOD reduce.3.24.130724 H: found=0, std=0, add=579, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 582 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 65 THR OG1 : rot -150:sc= 0 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= -0.124 X(o=-0.12,f=-0.12) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0905) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 83 LYS NZ :NH3+ 163:sc= 0.0019 (180deg=-0.477) USER MOD Single : A 84 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.0069) USER MOD Single : A 85 GLN : amide:sc= -0.134 X(o=-0.13,f=-0.08) USER MOD Single : A 89 GLN : amide:sc= -0.311 X(o=-0.31,f=0) USER MOD Single : B 168 SER OG : rot -47:sc= 0.0893 USER MOD Single : B 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 174 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 175 ASN : amide:sc= -0.574 K(o=-0.57,f=-1.2) USER MOD Single : B 176 MET CE :methyl 155:sc= -8.21! (180deg=-10.2!) USER MOD Single : B 184 THR OG1 : rot 84:sc= 1.27 USER MOD Single : B 185 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 188 GLN : amide:sc= -3.47! C(o=-3.5!,f=-7.4!) USER MOD Single : B 189 GLN : amide:sc= -0.363 X(o=-0.36,f=0) USER MOD Single : B 191 SER OG : rot 88:sc= 0.24 USER MOD Single : B 192 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 194 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0969) USER MOD Single : B 195 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 196 LYS NZ :NH3+ -155:sc= -0.757 (180deg=-2.48!) USER MOD Single : B 197 GLN : amide:sc= -3.07 K(o=-3.1,f=-0.81) USER MOD Single : B 198 GLN : amide:sc= -0.37 X(o=-0.37,f=-0.1) USER MOD Single : B 199 GLN : amide:sc= -0.411 X(o=-0.41,f=0) USER MOD ----------------------------------------------------------------- ATOM 161 N LEU A 62 -0.043 -18.363 1.959 1.00 0.00 N ATOM 162 CA LEU A 62 -0.367 -17.246 1.021 1.00 0.00 C ATOM 163 C LEU A 62 -1.628 -16.517 1.488 1.00 0.00 C ATOM 164 O LEU A 62 -1.803 -15.339 1.236 1.00 0.00 O ATOM 165 CB LEU A 62 -0.604 -17.916 -0.335 1.00 0.00 C ATOM 166 CG LEU A 62 -0.571 -16.858 -1.439 1.00 0.00 C ATOM 167 CD1 LEU A 62 0.879 -16.469 -1.730 1.00 0.00 C ATOM 168 CD2 LEU A 62 -1.209 -17.428 -2.707 1.00 0.00 C ATOM 0 HA LEU A 62 0.431 -16.505 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.160 -18.672 -0.518 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -1.566 -18.428 -0.336 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.125 -15.977 -1.115 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.903 -15.715 -2.517 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.336 -16.065 -0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 62 1.434 -17.349 -2.054 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -1.187 -16.676 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -0.653 -18.308 -3.030 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.242 -17.707 -2.501 1.00 0.00 H new ATOM 180 N GLU A 63 -2.507 -17.210 2.169 1.00 0.00 N ATOM 181 CA GLU A 63 -3.760 -16.562 2.660 1.00 0.00 C ATOM 182 C GLU A 63 -3.454 -15.669 3.863 1.00 0.00 C ATOM 183 O GLU A 63 -4.085 -14.648 4.065 1.00 0.00 O ATOM 184 CB GLU A 63 -4.678 -17.717 3.068 1.00 0.00 C ATOM 185 CG GLU A 63 -5.474 -18.190 1.849 1.00 0.00 C ATOM 186 CD GLU A 63 -6.664 -17.256 1.622 1.00 0.00 C ATOM 187 OE1 GLU A 63 -6.467 -16.215 1.016 1.00 0.00 O ATOM 188 OE2 GLU A 63 -7.751 -17.596 2.057 1.00 0.00 O ATOM 0 H GLU A 63 -2.410 -18.197 2.406 1.00 0.00 H new ATOM 0 HA GLU A 63 -4.220 -15.929 1.901 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.088 -18.540 3.472 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -5.358 -17.395 3.857 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -4.834 -18.202 0.966 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -5.824 -19.211 2.004 1.00 0.00 H new ATOM 195 N GLU A 64 -2.484 -16.044 4.656 1.00 0.00 N ATOM 196 CA GLU A 64 -2.124 -15.216 5.846 1.00 0.00 C ATOM 197 C GLU A 64 -1.341 -13.984 5.399 1.00 0.00 C ATOM 198 O GLU A 64 -1.501 -12.906 5.940 1.00 0.00 O ATOM 199 CB GLU A 64 -1.254 -16.122 6.721 1.00 0.00 C ATOM 200 CG GLU A 64 -1.324 -15.649 8.174 1.00 0.00 C ATOM 201 CD GLU A 64 -0.061 -16.091 8.916 1.00 0.00 C ATOM 202 OE1 GLU A 64 0.403 -17.188 8.653 1.00 0.00 O ATOM 203 OE2 GLU A 64 0.420 -15.325 9.735 1.00 0.00 O ATOM 0 H GLU A 64 -1.925 -16.888 4.531 1.00 0.00 H new ATOM 0 HA GLU A 64 -3.002 -14.862 6.387 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -1.596 -17.154 6.647 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.222 -16.102 6.370 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -1.419 -14.564 8.210 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -2.208 -16.063 8.660 1.00 0.00 H new ATOM 210 N THR A 65 -0.507 -14.137 4.405 1.00 0.00 N ATOM 211 CA THR A 65 0.283 -12.976 3.902 1.00 0.00 C ATOM 212 C THR A 65 -0.642 -12.018 3.151 1.00 0.00 C ATOM 213 O THR A 65 -0.430 -10.820 3.137 1.00 0.00 O ATOM 214 CB THR A 65 1.327 -13.575 2.955 1.00 0.00 C ATOM 215 OG1 THR A 65 2.111 -14.527 3.660 1.00 0.00 O ATOM 216 CG2 THR A 65 2.230 -12.463 2.419 1.00 0.00 C ATOM 0 H THR A 65 -0.339 -15.018 3.919 1.00 0.00 H new ATOM 0 HA THR A 65 0.755 -12.411 4.706 1.00 0.00 H new ATOM 0 HB THR A 65 0.824 -14.064 2.121 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.012 -14.558 3.275 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.973 -12.890 1.745 1.00 0.00 H new ATOM 0 HG22 THR A 65 1.627 -11.733 1.879 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.735 -11.972 3.251 1.00 0.00 H new ATOM 224 N LYS A 66 -1.675 -12.539 2.538 1.00 0.00 N ATOM 225 CA LYS A 66 -2.629 -11.664 1.794 1.00 0.00 C ATOM 226 C LYS A 66 -3.383 -10.766 2.778 1.00 0.00 C ATOM 227 O LYS A 66 -3.789 -9.669 2.442 1.00 0.00 O ATOM 228 CB LYS A 66 -3.596 -12.621 1.092 1.00 0.00 C ATOM 229 CG LYS A 66 -3.051 -12.975 -0.294 1.00 0.00 C ATOM 230 CD LYS A 66 -3.658 -12.035 -1.338 1.00 0.00 C ATOM 231 CE LYS A 66 -3.703 -12.741 -2.695 1.00 0.00 C ATOM 232 NZ LYS A 66 -4.595 -11.897 -3.538 1.00 0.00 N ATOM 0 H LYS A 66 -1.898 -13.534 2.521 1.00 0.00 H new ATOM 0 HA LYS A 66 -2.123 -11.012 1.082 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -3.723 -13.526 1.686 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -4.579 -12.159 1.000 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -1.964 -12.890 -0.301 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -3.292 -14.010 -0.537 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -4.663 -11.739 -1.036 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -3.066 -11.123 -1.410 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -2.707 -12.822 -3.131 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -4.092 -13.755 -2.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -4.676 -12.317 -4.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -5.537 -11.844 -3.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -4.195 -10.940 -3.616 1.00 0.00 H new ATOM 246 N GLU A 67 -3.568 -11.225 3.991 1.00 0.00 N ATOM 247 CA GLU A 67 -4.292 -10.399 5.004 1.00 0.00 C ATOM 248 C GLU A 67 -3.508 -9.119 5.294 1.00 0.00 C ATOM 249 O GLU A 67 -4.075 -8.052 5.434 1.00 0.00 O ATOM 250 CB GLU A 67 -4.377 -11.273 6.257 1.00 0.00 C ATOM 251 CG GLU A 67 -5.358 -10.648 7.252 1.00 0.00 C ATOM 252 CD GLU A 67 -5.035 -11.139 8.664 1.00 0.00 C ATOM 253 OE1 GLU A 67 -5.393 -12.262 8.977 1.00 0.00 O ATOM 254 OE2 GLU A 67 -4.435 -10.383 9.411 1.00 0.00 O ATOM 0 H GLU A 67 -3.249 -12.135 4.323 1.00 0.00 H new ATOM 0 HA GLU A 67 -5.280 -10.098 4.657 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -4.704 -12.278 5.990 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -3.392 -11.369 6.713 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -5.292 -9.561 7.210 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -6.381 -10.916 6.987 1.00 0.00 H new ATOM 261 N GLN A 68 -2.207 -9.221 5.378 1.00 0.00 N ATOM 262 CA GLN A 68 -1.375 -8.010 5.651 1.00 0.00 C ATOM 263 C GLN A 68 -1.307 -7.141 4.396 1.00 0.00 C ATOM 264 O GLN A 68 -1.278 -5.926 4.472 1.00 0.00 O ATOM 265 CB GLN A 68 0.012 -8.548 6.016 1.00 0.00 C ATOM 266 CG GLN A 68 0.947 -7.381 6.348 1.00 0.00 C ATOM 267 CD GLN A 68 0.452 -6.667 7.607 1.00 0.00 C ATOM 268 OE1 GLN A 68 0.409 -7.248 8.673 1.00 0.00 O ATOM 269 NE2 GLN A 68 0.072 -5.421 7.529 1.00 0.00 N ATOM 0 H GLN A 68 -1.684 -10.090 5.269 1.00 0.00 H new ATOM 0 HA GLN A 68 -1.785 -7.392 6.450 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -0.062 -9.222 6.870 1.00 0.00 H new ATOM 0 HB3 GLN A 68 0.418 -9.127 5.187 1.00 0.00 H new ATOM 0 HG2 GLN A 68 1.962 -7.748 6.501 1.00 0.00 H new ATOM 0 HG3 GLN A 68 0.983 -6.682 5.512 1.00 0.00 H new ATOM 0 HE21 GLN A 68 0.108 -4.932 6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -0.261 -4.936 8.362 1.00 0.00 H new ATOM 278 N ILE A 69 -1.293 -7.758 3.245 1.00 0.00 N ATOM 279 CA ILE A 69 -1.241 -6.978 1.972 1.00 0.00 C ATOM 280 C ILE A 69 -2.611 -6.349 1.699 1.00 0.00 C ATOM 281 O ILE A 69 -2.713 -5.323 1.053 1.00 0.00 O ATOM 282 CB ILE A 69 -0.882 -7.996 0.883 1.00 0.00 C ATOM 283 CG1 ILE A 69 0.459 -8.659 1.217 1.00 0.00 C ATOM 284 CG2 ILE A 69 -0.766 -7.286 -0.468 1.00 0.00 C ATOM 285 CD1 ILE A 69 0.658 -9.889 0.330 1.00 0.00 C ATOM 0 H ILE A 69 -1.315 -8.771 3.130 1.00 0.00 H new ATOM 0 HA ILE A 69 -0.514 -6.167 2.010 1.00 0.00 H new ATOM 0 HB ILE A 69 -1.663 -8.754 0.833 1.00 0.00 H new ATOM 0 HG12 ILE A 69 1.274 -7.952 1.064 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.482 -8.948 2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -0.511 -8.012 -1.240 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -1.717 -6.814 -0.714 1.00 0.00 H new ATOM 0 HG23 ILE A 69 0.013 -6.525 -0.414 1.00 0.00 H new ATOM 0 HD11 ILE A 69 1.612 -10.359 0.569 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.150 -10.599 0.505 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.655 -9.587 -0.717 1.00 0.00 H new ATOM 297 N LEU A 70 -3.663 -6.956 2.193 1.00 0.00 N ATOM 298 CA LEU A 70 -5.030 -6.393 1.971 1.00 0.00 C ATOM 299 C LEU A 70 -5.222 -5.141 2.830 1.00 0.00 C ATOM 300 O LEU A 70 -5.929 -4.224 2.455 1.00 0.00 O ATOM 301 CB LEU A 70 -5.997 -7.497 2.406 1.00 0.00 C ATOM 302 CG LEU A 70 -7.434 -7.054 2.131 1.00 0.00 C ATOM 303 CD1 LEU A 70 -8.301 -8.280 1.843 1.00 0.00 C ATOM 304 CD2 LEU A 70 -7.983 -6.319 3.357 1.00 0.00 C ATOM 0 H LEU A 70 -3.633 -7.816 2.740 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.194 -6.101 0.934 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.780 -8.419 1.866 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.868 -7.711 3.467 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.450 -6.388 1.268 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.325 -7.963 1.647 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -7.911 -8.805 0.971 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -8.286 -8.947 2.705 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.008 -6.002 3.163 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.967 -6.986 4.219 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.366 -5.445 3.563 1.00 0.00 H new ATOM 316 N LYS A 71 -4.594 -5.096 3.980 1.00 0.00 N ATOM 317 CA LYS A 71 -4.734 -3.900 4.867 1.00 0.00 C ATOM 318 C LYS A 71 -4.077 -2.686 4.209 1.00 0.00 C ATOM 319 O LYS A 71 -4.498 -1.561 4.400 1.00 0.00 O ATOM 320 CB LYS A 71 -4.005 -4.267 6.161 1.00 0.00 C ATOM 321 CG LYS A 71 -4.436 -3.315 7.279 1.00 0.00 C ATOM 322 CD LYS A 71 -5.580 -3.945 8.075 1.00 0.00 C ATOM 323 CE LYS A 71 -6.919 -3.525 7.464 1.00 0.00 C ATOM 324 NZ LYS A 71 -7.854 -3.423 8.619 1.00 0.00 N ATOM 0 H LYS A 71 -3.991 -5.835 4.342 1.00 0.00 H new ATOM 0 HA LYS A 71 -5.777 -3.644 5.052 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -4.231 -5.297 6.439 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -2.927 -4.206 6.013 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -3.593 -3.106 7.938 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -4.755 -2.362 6.857 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.489 -5.031 8.066 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -5.529 -3.630 9.117 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.833 -2.573 6.941 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -7.268 -4.258 6.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -8.795 -3.139 8.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -7.921 -4.346 9.094 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -7.499 -2.713 9.291 1.00 0.00 H new ATOM 338 N LEU A 72 -3.048 -2.911 3.432 1.00 0.00 N ATOM 339 CA LEU A 72 -2.356 -1.775 2.751 1.00 0.00 C ATOM 340 C LEU A 72 -3.301 -1.112 1.746 1.00 0.00 C ATOM 341 O LEU A 72 -3.198 0.069 1.472 1.00 0.00 O ATOM 342 CB LEU A 72 -1.161 -2.403 2.030 1.00 0.00 C ATOM 343 CG LEU A 72 0.008 -2.560 3.007 1.00 0.00 C ATOM 344 CD1 LEU A 72 1.159 -3.290 2.313 1.00 0.00 C ATOM 345 CD2 LEU A 72 0.484 -1.177 3.468 1.00 0.00 C ATOM 0 H LEU A 72 -2.657 -3.833 3.240 1.00 0.00 H new ATOM 0 HA LEU A 72 -2.042 -1.003 3.454 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -1.440 -3.375 1.622 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -0.863 -1.778 1.188 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.320 -3.136 3.872 1.00 0.00 H new ATOM 0 HD11 LEU A 72 1.991 -3.402 3.008 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.822 -4.275 1.989 1.00 0.00 H new ATOM 0 HD13 LEU A 72 1.485 -2.715 1.447 1.00 0.00 H new ATOM 0 HD21 LEU A 72 1.316 -1.292 4.163 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.810 -0.598 2.604 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.335 -0.657 3.965 1.00 0.00 H new ATOM 357 N GLU A 73 -4.220 -1.867 1.198 1.00 0.00 N ATOM 358 CA GLU A 73 -5.179 -1.284 0.209 1.00 0.00 C ATOM 359 C GLU A 73 -6.097 -0.275 0.900 1.00 0.00 C ATOM 360 O GLU A 73 -6.470 0.731 0.326 1.00 0.00 O ATOM 361 CB GLU A 73 -5.986 -2.470 -0.322 1.00 0.00 C ATOM 362 CG GLU A 73 -6.357 -2.223 -1.785 1.00 0.00 C ATOM 363 CD GLU A 73 -5.112 -2.381 -2.661 1.00 0.00 C ATOM 364 OE1 GLU A 73 -4.338 -1.439 -2.733 1.00 0.00 O ATOM 365 OE2 GLU A 73 -4.953 -3.439 -3.246 1.00 0.00 O ATOM 0 H GLU A 73 -4.348 -2.860 1.392 1.00 0.00 H new ATOM 0 HA GLU A 73 -4.668 -0.754 -0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -5.404 -3.388 -0.234 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -6.888 -2.606 0.275 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -7.128 -2.927 -2.100 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -6.772 -1.222 -1.902 1.00 0.00 H new ATOM 372 N GLU A 74 -6.456 -0.535 2.130 1.00 0.00 N ATOM 373 CA GLU A 74 -7.345 0.411 2.869 1.00 0.00 C ATOM 374 C GLU A 74 -6.541 1.625 3.329 1.00 0.00 C ATOM 375 O GLU A 74 -7.045 2.729 3.394 1.00 0.00 O ATOM 376 CB GLU A 74 -7.862 -0.377 4.074 1.00 0.00 C ATOM 377 CG GLU A 74 -9.241 -0.957 3.754 1.00 0.00 C ATOM 378 CD GLU A 74 -9.077 -2.241 2.938 1.00 0.00 C ATOM 379 OE1 GLU A 74 -8.820 -3.271 3.537 1.00 0.00 O ATOM 380 OE2 GLU A 74 -9.214 -2.170 1.727 1.00 0.00 O ATOM 0 H GLU A 74 -6.172 -1.362 2.655 1.00 0.00 H new ATOM 0 HA GLU A 74 -8.162 0.780 2.249 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -7.167 -1.180 4.322 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -7.923 0.273 4.947 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -9.782 -1.166 4.677 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -9.832 -0.231 3.195 1.00 0.00 H new ATOM 387 N LYS A 75 -5.287 1.422 3.640 1.00 0.00 N ATOM 388 CA LYS A 75 -4.429 2.558 4.091 1.00 0.00 C ATOM 389 C LYS A 75 -4.000 3.389 2.880 1.00 0.00 C ATOM 390 O LYS A 75 -3.798 4.585 2.979 1.00 0.00 O ATOM 391 CB LYS A 75 -3.214 1.903 4.766 1.00 0.00 C ATOM 392 CG LYS A 75 -3.102 2.385 6.216 1.00 0.00 C ATOM 393 CD LYS A 75 -2.569 3.818 6.240 1.00 0.00 C ATOM 394 CE LYS A 75 -2.077 4.158 7.649 1.00 0.00 C ATOM 395 NZ LYS A 75 -3.316 4.371 8.447 1.00 0.00 N ATOM 0 H LYS A 75 -4.819 0.516 3.601 1.00 0.00 H new ATOM 0 HA LYS A 75 -4.948 3.231 4.774 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -3.314 0.818 4.741 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -2.305 2.152 4.219 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -4.077 2.341 6.701 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.437 1.729 6.778 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -1.755 3.926 5.523 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -3.353 4.514 5.940 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -1.475 3.349 8.063 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -1.452 5.051 7.644 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.063 4.707 9.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.914 5.080 7.977 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.838 3.475 8.524 1.00 0.00 H new ATOM 409 N LEU A 76 -3.869 2.762 1.738 1.00 0.00 N ATOM 410 CA LEU A 76 -3.466 3.511 0.511 1.00 0.00 C ATOM 411 C LEU A 76 -4.674 4.250 -0.064 1.00 0.00 C ATOM 412 O LEU A 76 -4.543 5.300 -0.665 1.00 0.00 O ATOM 413 CB LEU A 76 -2.970 2.444 -0.467 1.00 0.00 C ATOM 414 CG LEU A 76 -2.401 3.120 -1.715 1.00 0.00 C ATOM 415 CD1 LEU A 76 -1.072 3.794 -1.372 1.00 0.00 C ATOM 416 CD2 LEU A 76 -2.173 2.070 -2.805 1.00 0.00 C ATOM 0 H LEU A 76 -4.024 1.763 1.603 1.00 0.00 H new ATOM 0 HA LEU A 76 -2.698 4.258 0.713 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -2.205 1.829 0.007 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -3.789 1.779 -0.742 1.00 0.00 H new ATOM 0 HG LEU A 76 -3.106 3.870 -2.073 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -0.668 4.275 -2.262 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -1.233 4.543 -0.596 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -0.366 3.045 -1.012 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -1.767 2.551 -3.695 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -1.469 1.319 -2.446 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -3.120 1.590 -3.052 1.00 0.00 H new ATOM 428 N LEU A 77 -5.851 3.710 0.126 1.00 0.00 N ATOM 429 CA LEU A 77 -7.079 4.378 -0.398 1.00 0.00 C ATOM 430 C LEU A 77 -7.461 5.544 0.514 1.00 0.00 C ATOM 431 O LEU A 77 -8.002 6.539 0.071 1.00 0.00 O ATOM 432 CB LEU A 77 -8.165 3.299 -0.376 1.00 0.00 C ATOM 433 CG LEU A 77 -8.383 2.757 -1.791 1.00 0.00 C ATOM 434 CD1 LEU A 77 -7.331 1.690 -2.097 1.00 0.00 C ATOM 435 CD2 LEU A 77 -9.780 2.137 -1.889 1.00 0.00 C ATOM 0 H LEU A 77 -6.014 2.834 0.622 1.00 0.00 H new ATOM 0 HA LEU A 77 -6.937 4.784 -1.400 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.873 2.489 0.293 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -9.095 3.714 0.012 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.294 3.572 -2.510 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -7.486 1.304 -3.105 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -6.336 2.129 -2.026 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.420 0.875 -1.379 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -9.937 1.751 -2.896 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -9.868 1.322 -1.170 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -10.531 2.896 -1.671 1.00 0.00 H new ATOM 447 N ALA A 78 -7.173 5.427 1.786 1.00 0.00 N ATOM 448 CA ALA A 78 -7.507 6.530 2.737 1.00 0.00 C ATOM 449 C ALA A 78 -6.518 7.684 2.563 1.00 0.00 C ATOM 450 O ALA A 78 -6.843 8.832 2.803 1.00 0.00 O ATOM 451 CB ALA A 78 -7.378 5.914 4.131 1.00 0.00 C ATOM 0 H ALA A 78 -6.721 4.615 2.207 1.00 0.00 H new ATOM 0 HA ALA A 78 -8.505 6.934 2.568 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -7.609 6.667 4.884 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -8.074 5.080 4.226 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -6.359 5.555 4.277 1.00 0.00 H new ATOM 457 N LEU A 79 -5.314 7.385 2.145 1.00 0.00 N ATOM 458 CA LEU A 79 -4.296 8.459 1.945 1.00 0.00 C ATOM 459 C LEU A 79 -4.587 9.217 0.649 1.00 0.00 C ATOM 460 O LEU A 79 -4.402 10.417 0.567 1.00 0.00 O ATOM 461 CB LEU A 79 -2.954 7.727 1.856 1.00 0.00 C ATOM 462 CG LEU A 79 -1.886 8.508 2.624 1.00 0.00 C ATOM 463 CD1 LEU A 79 -2.230 8.532 4.118 1.00 0.00 C ATOM 464 CD2 LEU A 79 -0.528 7.832 2.423 1.00 0.00 C ATOM 0 H LEU A 79 -4.992 6.441 1.933 1.00 0.00 H new ATOM 0 HA LEU A 79 -4.301 9.192 2.751 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -3.049 6.722 2.268 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.658 7.617 0.813 1.00 0.00 H new ATOM 0 HG LEU A 79 -1.848 9.532 2.251 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.465 9.090 4.659 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -3.198 9.012 4.261 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -2.271 7.511 4.498 1.00 0.00 H new ATOM 0 HD21 LEU A 79 0.238 8.384 2.968 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.572 6.809 2.796 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.281 7.821 1.361 1.00 0.00 H new ATOM 476 N GLN A 80 -5.049 8.523 -0.361 1.00 0.00 N ATOM 477 CA GLN A 80 -5.364 9.200 -1.656 1.00 0.00 C ATOM 478 C GLN A 80 -6.640 10.029 -1.507 1.00 0.00 C ATOM 479 O GLN A 80 -6.808 11.048 -2.150 1.00 0.00 O ATOM 480 CB GLN A 80 -5.569 8.070 -2.666 1.00 0.00 C ATOM 481 CG GLN A 80 -5.561 8.643 -4.083 1.00 0.00 C ATOM 482 CD GLN A 80 -4.123 8.703 -4.603 1.00 0.00 C ATOM 483 OE1 GLN A 80 -3.583 7.708 -5.045 1.00 0.00 O ATOM 484 NE2 GLN A 80 -3.476 9.835 -4.566 1.00 0.00 N ATOM 0 H GLN A 80 -5.221 7.518 -0.345 1.00 0.00 H new ATOM 0 HA GLN A 80 -4.572 9.879 -1.973 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -4.780 7.325 -2.559 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -6.514 7.563 -2.473 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -6.171 8.023 -4.740 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -6.002 9.640 -4.086 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -3.930 10.670 -4.195 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -2.516 9.885 -4.908 1.00 0.00 H new ATOM 493 N GLU A 81 -7.536 9.598 -0.655 1.00 0.00 N ATOM 494 CA GLU A 81 -8.804 10.360 -0.448 1.00 0.00 C ATOM 495 C GLU A 81 -8.511 11.666 0.296 1.00 0.00 C ATOM 496 O GLU A 81 -9.217 12.646 0.147 1.00 0.00 O ATOM 497 CB GLU A 81 -9.693 9.447 0.400 1.00 0.00 C ATOM 498 CG GLU A 81 -10.466 8.495 -0.515 1.00 0.00 C ATOM 499 CD GLU A 81 -11.711 9.202 -1.053 1.00 0.00 C ATOM 500 OE1 GLU A 81 -12.555 9.566 -0.250 1.00 0.00 O ATOM 501 OE2 GLU A 81 -11.801 9.365 -2.258 1.00 0.00 O ATOM 0 H GLU A 81 -7.444 8.751 -0.094 1.00 0.00 H new ATOM 0 HA GLU A 81 -9.284 10.625 -1.390 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -9.084 8.879 1.103 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -10.387 10.044 0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -9.832 8.173 -1.341 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -10.753 7.598 0.035 1.00 0.00 H new ATOM 508 N GLU A 82 -7.472 11.684 1.094 1.00 0.00 N ATOM 509 CA GLU A 82 -7.124 12.926 1.850 1.00 0.00 C ATOM 510 C GLU A 82 -6.641 14.009 0.881 1.00 0.00 C ATOM 511 O GLU A 82 -6.967 15.172 1.028 1.00 0.00 O ATOM 512 CB GLU A 82 -5.999 12.514 2.810 1.00 0.00 C ATOM 513 CG GLU A 82 -6.311 13.022 4.220 1.00 0.00 C ATOM 514 CD GLU A 82 -5.618 14.367 4.447 1.00 0.00 C ATOM 515 OE1 GLU A 82 -5.984 15.320 3.780 1.00 0.00 O ATOM 516 OE2 GLU A 82 -4.731 14.421 5.284 1.00 0.00 O ATOM 0 H GLU A 82 -6.850 10.892 1.254 1.00 0.00 H new ATOM 0 HA GLU A 82 -7.979 13.337 2.388 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -5.895 11.429 2.819 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -5.048 12.923 2.468 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -7.388 13.130 4.348 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.973 12.298 4.961 1.00 0.00 H new ATOM 523 N LYS A 83 -5.873 13.632 -0.110 1.00 0.00 N ATOM 524 CA LYS A 83 -5.373 14.638 -1.096 1.00 0.00 C ATOM 525 C LYS A 83 -6.534 15.154 -1.948 1.00 0.00 C ATOM 526 O LYS A 83 -6.527 16.282 -2.404 1.00 0.00 O ATOM 527 CB LYS A 83 -4.360 13.888 -1.964 1.00 0.00 C ATOM 528 CG LYS A 83 -3.720 14.860 -2.957 1.00 0.00 C ATOM 529 CD LYS A 83 -2.439 14.243 -3.522 1.00 0.00 C ATOM 530 CE LYS A 83 -2.017 15.003 -4.781 1.00 0.00 C ATOM 531 NZ LYS A 83 -1.624 16.356 -4.298 1.00 0.00 N ATOM 0 H LYS A 83 -5.571 12.672 -0.279 1.00 0.00 H new ATOM 0 HA LYS A 83 -4.921 15.503 -0.610 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -3.593 13.435 -1.337 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -4.854 13.077 -2.499 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -4.417 15.082 -3.765 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -3.494 15.805 -2.463 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -1.644 14.283 -2.777 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -2.603 13.191 -3.757 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -1.187 14.506 -5.283 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -2.834 15.062 -5.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -1.061 16.836 -5.029 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -2.478 16.914 -4.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -1.058 16.264 -3.430 1.00 0.00 H new ATOM 545 N HIS A 84 -7.531 14.334 -2.158 1.00 0.00 N ATOM 546 CA HIS A 84 -8.705 14.769 -2.976 1.00 0.00 C ATOM 547 C HIS A 84 -9.514 15.818 -2.211 1.00 0.00 C ATOM 548 O HIS A 84 -10.138 16.682 -2.799 1.00 0.00 O ATOM 549 CB HIS A 84 -9.537 13.503 -3.195 1.00 0.00 C ATOM 550 CG HIS A 84 -10.520 13.734 -4.310 1.00 0.00 C ATOM 551 ND1 HIS A 84 -11.738 13.077 -4.370 1.00 0.00 N ATOM 552 CD2 HIS A 84 -10.477 14.547 -5.415 1.00 0.00 C ATOM 553 CE1 HIS A 84 -12.374 13.501 -5.476 1.00 0.00 C ATOM 554 NE2 HIS A 84 -11.650 14.399 -6.151 1.00 0.00 N ATOM 0 H HIS A 84 -7.584 13.381 -1.799 1.00 0.00 H new ATOM 0 HA HIS A 84 -8.404 15.221 -3.921 1.00 0.00 H new ATOM 0 HB2 HIS A 84 -8.885 12.664 -3.439 1.00 0.00 H new ATOM 0 HB3 HIS A 84 -10.066 13.240 -2.279 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -9.658 15.202 -5.674 1.00 0.00 H new ATOM 0 HE1 HIS A 84 -13.351 13.158 -5.782 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -11.902 14.873 -7.018 1.00 0.00 H new ATOM 562 N GLN A 85 -9.501 15.749 -0.904 1.00 0.00 N ATOM 563 CA GLN A 85 -10.265 16.744 -0.091 1.00 0.00 C ATOM 564 C GLN A 85 -9.639 18.133 -0.246 1.00 0.00 C ATOM 565 O GLN A 85 -10.330 19.133 -0.281 1.00 0.00 O ATOM 566 CB GLN A 85 -10.146 16.261 1.357 1.00 0.00 C ATOM 567 CG GLN A 85 -11.409 16.645 2.129 1.00 0.00 C ATOM 568 CD GLN A 85 -12.551 15.702 1.741 1.00 0.00 C ATOM 569 OE1 GLN A 85 -12.601 14.574 2.189 1.00 0.00 O ATOM 570 NE2 GLN A 85 -13.476 16.121 0.922 1.00 0.00 N ATOM 0 H GLN A 85 -8.995 15.047 -0.365 1.00 0.00 H new ATOM 0 HA GLN A 85 -11.306 16.821 -0.405 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -10.007 15.180 1.381 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -9.270 16.705 1.829 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -11.224 16.587 3.202 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -11.684 17.676 1.908 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -13.433 17.068 0.546 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -14.242 15.501 0.658 1.00 0.00 H new ATOM 579 N LEU A 86 -8.335 18.195 -0.345 1.00 0.00 N ATOM 580 CA LEU A 86 -7.652 19.516 -0.506 1.00 0.00 C ATOM 581 C LEU A 86 -8.140 20.206 -1.783 1.00 0.00 C ATOM 582 O LEU A 86 -8.298 21.411 -1.825 1.00 0.00 O ATOM 583 CB LEU A 86 -6.159 19.192 -0.607 1.00 0.00 C ATOM 584 CG LEU A 86 -5.522 19.284 0.780 1.00 0.00 C ATOM 585 CD1 LEU A 86 -4.274 18.402 0.829 1.00 0.00 C ATOM 586 CD2 LEU A 86 -5.129 20.736 1.064 1.00 0.00 C ATOM 0 H LEU A 86 -7.713 17.387 -0.321 1.00 0.00 H new ATOM 0 HA LEU A 86 -7.861 20.191 0.324 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.020 18.192 -1.017 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -5.671 19.887 -1.290 1.00 0.00 H new ATOM 0 HG LEU A 86 -6.236 18.945 1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -3.820 18.468 1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -4.551 17.368 0.625 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -3.559 18.741 0.079 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -4.675 20.803 2.053 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -4.415 21.073 0.313 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -6.017 21.367 1.029 1.00 0.00 H new ATOM 598 N PHE A 87 -8.386 19.444 -2.821 1.00 0.00 N ATOM 599 CA PHE A 87 -8.873 20.051 -4.098 1.00 0.00 C ATOM 600 C PHE A 87 -10.239 20.694 -3.873 1.00 0.00 C ATOM 601 O PHE A 87 -10.453 21.849 -4.192 1.00 0.00 O ATOM 602 CB PHE A 87 -8.981 18.887 -5.087 1.00 0.00 C ATOM 603 CG PHE A 87 -7.731 18.824 -5.934 1.00 0.00 C ATOM 604 CD1 PHE A 87 -6.592 18.168 -5.453 1.00 0.00 C ATOM 605 CD2 PHE A 87 -7.713 19.422 -7.200 1.00 0.00 C ATOM 606 CE1 PHE A 87 -5.434 18.110 -6.238 1.00 0.00 C ATOM 607 CE2 PHE A 87 -6.555 19.364 -7.985 1.00 0.00 C ATOM 608 CZ PHE A 87 -5.416 18.708 -7.504 1.00 0.00 C ATOM 0 H PHE A 87 -8.271 18.431 -2.839 1.00 0.00 H new ATOM 0 HA PHE A 87 -8.205 20.828 -4.469 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -9.115 17.949 -4.547 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -9.857 19.017 -5.723 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.606 17.707 -4.477 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -8.592 19.928 -7.571 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -4.555 17.604 -5.867 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -6.541 19.825 -8.961 1.00 0.00 H new ATOM 0 HZ PHE A 87 -4.523 18.663 -8.110 1.00 0.00 H new ATOM 618 N LEU A 88 -11.159 19.955 -3.312 1.00 0.00 N ATOM 619 CA LEU A 88 -12.518 20.519 -3.044 1.00 0.00 C ATOM 620 C LEU A 88 -12.404 21.692 -2.066 1.00 0.00 C ATOM 621 O LEU A 88 -13.219 22.596 -2.068 1.00 0.00 O ATOM 622 CB LEU A 88 -13.317 19.373 -2.419 1.00 0.00 C ATOM 623 CG LEU A 88 -14.123 18.660 -3.505 1.00 0.00 C ATOM 624 CD1 LEU A 88 -14.439 17.233 -3.055 1.00 0.00 C ATOM 625 CD2 LEU A 88 -15.432 19.417 -3.746 1.00 0.00 C ATOM 0 H LEU A 88 -11.030 18.984 -3.027 1.00 0.00 H new ATOM 0 HA LEU A 88 -12.998 20.894 -3.948 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -12.643 18.669 -1.931 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -13.986 19.759 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 88 -13.542 18.630 -4.427 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -15.014 16.726 -3.830 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -13.509 16.692 -2.880 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -15.020 17.262 -2.133 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -16.008 18.910 -4.520 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -16.011 19.446 -2.823 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -15.210 20.435 -4.067 1.00 0.00 H new ATOM 637 N GLN A 89 -11.393 21.681 -1.234 1.00 0.00 N ATOM 638 CA GLN A 89 -11.206 22.788 -0.253 1.00 0.00 C ATOM 639 C GLN A 89 -10.018 23.670 -0.661 1.00 0.00 C ATOM 640 O GLN A 89 -9.454 24.373 0.156 1.00 0.00 O ATOM 641 CB GLN A 89 -10.919 22.084 1.075 1.00 0.00 C ATOM 642 CG GLN A 89 -11.062 23.078 2.229 1.00 0.00 C ATOM 643 CD GLN A 89 -10.952 22.334 3.563 1.00 0.00 C ATOM 644 OE1 GLN A 89 -11.664 22.637 4.500 1.00 0.00 O ATOM 645 NE2 GLN A 89 -10.084 21.366 3.689 1.00 0.00 N ATOM 0 H GLN A 89 -10.686 20.947 -1.194 1.00 0.00 H new ATOM 0 HA GLN A 89 -12.076 23.442 -0.195 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -11.609 21.251 1.212 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -9.912 21.666 1.066 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -10.288 23.842 2.162 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -12.022 23.590 2.165 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -9.486 21.111 2.903 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -10.004 20.865 4.574 1.00 0.00 H new ATOM 654 N LEU A 90 -9.632 23.639 -1.917 1.00 0.00 N ATOM 655 CA LEU A 90 -8.477 24.478 -2.375 1.00 0.00 C ATOM 656 C LEU A 90 -8.731 25.958 -2.059 1.00 0.00 C ATOM 657 O LEU A 90 -9.870 26.296 -1.783 1.00 0.00 O ATOM 658 CB LEU A 90 -8.396 24.262 -3.892 1.00 0.00 C ATOM 659 CG LEU A 90 -7.204 23.364 -4.225 1.00 0.00 C ATOM 660 CD1 LEU A 90 -7.248 22.981 -5.706 1.00 0.00 C ATOM 661 CD2 LEU A 90 -5.904 24.118 -3.933 1.00 0.00 C ATOM 662 OXT LEU A 90 -7.782 26.723 -2.098 1.00 0.00 O ATOM 0 H LEU A 90 -10.067 23.070 -2.643 1.00 0.00 H new ATOM 0 HA LEU A 90 -7.550 24.201 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -9.318 23.807 -4.253 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -8.294 25.221 -4.400 1.00 0.00 H new ATOM 0 HG LEU A 90 -7.248 22.461 -3.616 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -6.398 22.341 -5.942 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -8.174 22.446 -5.916 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -7.203 23.883 -6.317 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -5.052 23.480 -4.170 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -5.862 25.020 -4.543 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -5.871 24.391 -2.878 1.00 0.00 H new ATOM 675 N GLY B 166 -11.129 29.352 -0.196 1.00 0.00 N ATOM 676 CA GLY B 166 -9.676 29.021 -0.217 1.00 0.00 C ATOM 677 C GLY B 166 -8.915 29.994 0.685 1.00 0.00 C ATOM 678 O GLY B 166 -9.014 31.197 0.538 1.00 0.00 O ATOM 0 HA2 GLY B 166 -9.521 27.997 0.123 1.00 0.00 H new ATOM 0 HA3 GLY B 166 -9.294 29.080 -1.236 1.00 0.00 H new ATOM 684 N LEU B 167 -8.160 29.478 1.623 1.00 0.00 N ATOM 685 CA LEU B 167 -7.384 30.367 2.558 1.00 0.00 C ATOM 686 C LEU B 167 -6.583 31.436 1.790 1.00 0.00 C ATOM 687 O LEU B 167 -6.815 32.620 1.961 1.00 0.00 O ATOM 688 CB LEU B 167 -6.445 29.453 3.386 1.00 0.00 C ATOM 689 CG LEU B 167 -5.794 28.340 2.527 1.00 0.00 C ATOM 690 CD1 LEU B 167 -4.266 28.487 2.547 1.00 0.00 C ATOM 691 CD2 LEU B 167 -6.183 26.962 3.086 1.00 0.00 C ATOM 0 H LEU B 167 -8.044 28.478 1.786 1.00 0.00 H new ATOM 0 HA LEU B 167 -8.066 30.910 3.212 1.00 0.00 H new ATOM 0 HB2 LEU B 167 -5.663 30.059 3.843 1.00 0.00 H new ATOM 0 HB3 LEU B 167 -7.011 28.997 4.199 1.00 0.00 H new ATOM 0 HG LEU B 167 -6.149 28.431 1.500 1.00 0.00 H new ATOM 0 HD11 LEU B 167 -3.817 27.700 1.941 1.00 0.00 H new ATOM 0 HD12 LEU B 167 -3.989 29.460 2.142 1.00 0.00 H new ATOM 0 HD13 LEU B 167 -3.906 28.405 3.573 1.00 0.00 H new ATOM 0 HD21 LEU B 167 -5.724 26.181 2.480 1.00 0.00 H new ATOM 0 HD22 LEU B 167 -5.834 26.875 4.115 1.00 0.00 H new ATOM 0 HD23 LEU B 167 -7.267 26.852 3.060 1.00 0.00 H new ATOM 703 N SER B 168 -5.653 31.044 0.952 1.00 0.00 N ATOM 704 CA SER B 168 -4.855 32.054 0.189 1.00 0.00 C ATOM 705 C SER B 168 -4.426 31.508 -1.180 1.00 0.00 C ATOM 706 O SER B 168 -3.557 32.065 -1.824 1.00 0.00 O ATOM 707 CB SER B 168 -3.631 32.324 1.061 1.00 0.00 C ATOM 708 OG SER B 168 -3.041 33.557 0.674 1.00 0.00 O ATOM 0 H SER B 168 -5.413 30.071 0.764 1.00 0.00 H new ATOM 0 HA SER B 168 -5.434 32.956 -0.011 1.00 0.00 H new ATOM 0 HB2 SER B 168 -3.919 32.360 2.112 1.00 0.00 H new ATOM 0 HB3 SER B 168 -2.910 31.514 0.956 1.00 0.00 H new ATOM 0 HG SER B 168 -2.960 33.589 -0.302 1.00 0.00 H new ATOM 714 N LYS B 169 -5.019 30.423 -1.634 1.00 0.00 N ATOM 715 CA LYS B 169 -4.638 29.837 -2.963 1.00 0.00 C ATOM 716 C LYS B 169 -3.116 29.673 -3.072 1.00 0.00 C ATOM 717 O LYS B 169 -2.557 29.680 -4.152 1.00 0.00 O ATOM 718 CB LYS B 169 -5.146 30.835 -4.004 1.00 0.00 C ATOM 719 CG LYS B 169 -5.225 30.147 -5.368 1.00 0.00 C ATOM 720 CD LYS B 169 -6.323 29.081 -5.339 1.00 0.00 C ATOM 721 CE LYS B 169 -6.770 28.768 -6.769 1.00 0.00 C ATOM 722 NZ LYS B 169 -8.182 28.315 -6.639 1.00 0.00 N ATOM 0 H LYS B 169 -5.753 29.917 -1.138 1.00 0.00 H new ATOM 0 HA LYS B 169 -5.068 28.845 -3.104 1.00 0.00 H new ATOM 0 HB2 LYS B 169 -6.128 31.210 -3.716 1.00 0.00 H new ATOM 0 HB3 LYS B 169 -4.479 31.695 -4.056 1.00 0.00 H new ATOM 0 HG2 LYS B 169 -5.436 30.881 -6.146 1.00 0.00 H new ATOM 0 HG3 LYS B 169 -4.266 29.690 -5.613 1.00 0.00 H new ATOM 0 HD2 LYS B 169 -5.953 28.176 -4.856 1.00 0.00 H new ATOM 0 HD3 LYS B 169 -7.170 29.433 -4.751 1.00 0.00 H new ATOM 0 HE2 LYS B 169 -6.695 29.648 -7.408 1.00 0.00 H new ATOM 0 HE3 LYS B 169 -6.147 27.994 -7.217 1.00 0.00 H new ATOM 0 HZ1 LYS B 169 -8.560 28.081 -7.579 1.00 0.00 H new ATOM 0 HZ2 LYS B 169 -8.222 27.472 -6.031 1.00 0.00 H new ATOM 0 HZ3 LYS B 169 -8.753 29.074 -6.216 1.00 0.00 H new ATOM 736 N GLU B 170 -2.451 29.530 -1.955 1.00 0.00 N ATOM 737 CA GLU B 170 -0.969 29.367 -1.971 1.00 0.00 C ATOM 738 C GLU B 170 -0.528 28.538 -0.767 1.00 0.00 C ATOM 739 O GLU B 170 0.259 27.617 -0.893 1.00 0.00 O ATOM 740 CB GLU B 170 -0.411 30.788 -1.883 1.00 0.00 C ATOM 741 CG GLU B 170 0.976 30.833 -2.526 1.00 0.00 C ATOM 742 CD GLU B 170 1.770 32.005 -1.947 1.00 0.00 C ATOM 743 OE1 GLU B 170 2.200 31.900 -0.810 1.00 0.00 O ATOM 744 OE2 GLU B 170 1.934 32.989 -2.649 1.00 0.00 O ATOM 0 H GLU B 170 -2.875 29.519 -1.027 1.00 0.00 H new ATOM 0 HA GLU B 170 -0.615 28.851 -2.863 1.00 0.00 H new ATOM 0 HB2 GLU B 170 -1.080 31.485 -2.388 1.00 0.00 H new ATOM 0 HB3 GLU B 170 -0.351 31.102 -0.841 1.00 0.00 H new ATOM 0 HG2 GLU B 170 1.504 29.897 -2.343 1.00 0.00 H new ATOM 0 HG3 GLU B 170 0.884 30.941 -3.607 1.00 0.00 H new ATOM 751 N GLU B 171 -1.035 28.854 0.398 1.00 0.00 N ATOM 752 CA GLU B 171 -0.652 28.077 1.614 1.00 0.00 C ATOM 753 C GLU B 171 -1.192 26.654 1.496 1.00 0.00 C ATOM 754 O GLU B 171 -0.509 25.692 1.794 1.00 0.00 O ATOM 755 CB GLU B 171 -1.295 28.812 2.796 1.00 0.00 C ATOM 756 CG GLU B 171 -0.214 29.528 3.610 1.00 0.00 C ATOM 757 CD GLU B 171 0.411 30.638 2.764 1.00 0.00 C ATOM 758 OE1 GLU B 171 -0.338 31.408 2.185 1.00 0.00 O ATOM 759 OE2 GLU B 171 1.628 30.700 2.710 1.00 0.00 O ATOM 0 H GLU B 171 -1.696 29.614 0.559 1.00 0.00 H new ATOM 0 HA GLU B 171 0.428 28.006 1.741 1.00 0.00 H new ATOM 0 HB2 GLU B 171 -2.027 29.533 2.433 1.00 0.00 H new ATOM 0 HB3 GLU B 171 -1.831 28.104 3.429 1.00 0.00 H new ATOM 0 HG2 GLU B 171 -0.646 29.948 4.518 1.00 0.00 H new ATOM 0 HG3 GLU B 171 0.552 28.818 3.921 1.00 0.00 H new ATOM 766 N LEU B 172 -2.410 26.518 1.041 1.00 0.00 N ATOM 767 CA LEU B 172 -3.003 25.160 0.874 1.00 0.00 C ATOM 768 C LEU B 172 -2.330 24.458 -0.307 1.00 0.00 C ATOM 769 O LEU B 172 -2.220 23.248 -0.342 1.00 0.00 O ATOM 770 CB LEU B 172 -4.487 25.394 0.591 1.00 0.00 C ATOM 771 CG LEU B 172 -5.296 24.188 1.075 1.00 0.00 C ATOM 772 CD1 LEU B 172 -5.259 24.119 2.608 1.00 0.00 C ATOM 773 CD2 LEU B 172 -6.747 24.325 0.601 1.00 0.00 C ATOM 0 H LEU B 172 -3.020 27.291 0.777 1.00 0.00 H new ATOM 0 HA LEU B 172 -2.864 24.531 1.753 1.00 0.00 H new ATOM 0 HB2 LEU B 172 -4.826 26.299 1.096 1.00 0.00 H new ATOM 0 HB3 LEU B 172 -4.645 25.546 -0.477 1.00 0.00 H new ATOM 0 HG LEU B 172 -4.864 23.275 0.666 1.00 0.00 H new ATOM 0 HD11 LEU B 172 -5.836 23.259 2.948 1.00 0.00 H new ATOM 0 HD12 LEU B 172 -4.227 24.018 2.943 1.00 0.00 H new ATOM 0 HD13 LEU B 172 -5.688 25.031 3.024 1.00 0.00 H new ATOM 0 HD21 LEU B 172 -7.325 23.467 0.945 1.00 0.00 H new ATOM 0 HD22 LEU B 172 -7.178 25.239 1.009 1.00 0.00 H new ATOM 0 HD23 LEU B 172 -6.772 24.366 -0.488 1.00 0.00 H new ATOM 785 N ILE B 173 -1.867 25.220 -1.270 1.00 0.00 N ATOM 786 CA ILE B 173 -1.184 24.611 -2.447 1.00 0.00 C ATOM 787 C ILE B 173 0.126 23.966 -1.991 1.00 0.00 C ATOM 788 O ILE B 173 0.560 22.967 -2.535 1.00 0.00 O ATOM 789 CB ILE B 173 -0.908 25.773 -3.412 1.00 0.00 C ATOM 790 CG1 ILE B 173 -2.227 26.464 -3.802 1.00 0.00 C ATOM 791 CG2 ILE B 173 -0.215 25.244 -4.672 1.00 0.00 C ATOM 792 CD1 ILE B 173 -3.173 25.467 -4.483 1.00 0.00 C ATOM 0 H ILE B 173 -1.935 26.238 -1.288 1.00 0.00 H new ATOM 0 HA ILE B 173 -1.785 23.837 -2.925 1.00 0.00 H new ATOM 0 HB ILE B 173 -0.261 26.497 -2.917 1.00 0.00 H new ATOM 0 HG12 ILE B 173 -2.704 26.879 -2.914 1.00 0.00 H new ATOM 0 HG13 ILE B 173 -2.023 27.298 -4.473 1.00 0.00 H new ATOM 0 HG21 ILE B 173 -0.021 26.071 -5.355 1.00 0.00 H new ATOM 0 HG22 ILE B 173 0.728 24.771 -4.397 1.00 0.00 H new ATOM 0 HG23 ILE B 173 -0.859 24.513 -5.162 1.00 0.00 H new ATOM 0 HD11 ILE B 173 -4.101 25.972 -4.752 1.00 0.00 H new ATOM 0 HD12 ILE B 173 -2.700 25.073 -5.382 1.00 0.00 H new ATOM 0 HD13 ILE B 173 -3.391 24.647 -3.799 1.00 0.00 H new ATOM 804 N GLN B 174 0.750 24.530 -0.988 1.00 0.00 N ATOM 805 CA GLN B 174 2.029 23.953 -0.478 1.00 0.00 C ATOM 806 C GLN B 174 1.736 22.689 0.331 1.00 0.00 C ATOM 807 O GLN B 174 2.526 21.764 0.363 1.00 0.00 O ATOM 808 CB GLN B 174 2.634 25.036 0.416 1.00 0.00 C ATOM 809 CG GLN B 174 3.612 25.886 -0.399 1.00 0.00 C ATOM 810 CD GLN B 174 4.969 25.183 -0.463 1.00 0.00 C ATOM 811 OE1 GLN B 174 5.310 24.587 -1.466 1.00 0.00 O ATOM 812 NE2 GLN B 174 5.764 25.229 0.571 1.00 0.00 N ATOM 0 H GLN B 174 0.428 25.366 -0.500 1.00 0.00 H new ATOM 0 HA GLN B 174 2.709 23.674 -1.283 1.00 0.00 H new ATOM 0 HB2 GLN B 174 1.845 25.665 0.827 1.00 0.00 H new ATOM 0 HB3 GLN B 174 3.150 24.579 1.260 1.00 0.00 H new ATOM 0 HG2 GLN B 174 3.224 26.042 -1.405 1.00 0.00 H new ATOM 0 HG3 GLN B 174 3.722 26.870 0.056 1.00 0.00 H new ATOM 0 HE21 GLN B 174 5.478 25.729 1.413 1.00 0.00 H new ATOM 0 HE22 GLN B 174 6.672 24.765 0.538 1.00 0.00 H new ATOM 821 N ASN B 175 0.597 22.643 0.974 1.00 0.00 N ATOM 822 CA ASN B 175 0.234 21.437 1.777 1.00 0.00 C ATOM 823 C ASN B 175 -0.097 20.272 0.842 1.00 0.00 C ATOM 824 O ASN B 175 0.106 19.120 1.177 1.00 0.00 O ATOM 825 CB ASN B 175 -1.000 21.845 2.586 1.00 0.00 C ATOM 826 CG ASN B 175 -0.624 22.954 3.571 1.00 0.00 C ATOM 827 OD1 ASN B 175 0.522 23.079 3.955 1.00 0.00 O ATOM 828 ND2 ASN B 175 -1.548 23.769 3.999 1.00 0.00 N ATOM 0 H ASN B 175 -0.098 23.390 0.977 1.00 0.00 H new ATOM 0 HA ASN B 175 1.048 21.111 2.425 1.00 0.00 H new ATOM 0 HB2 ASN B 175 -1.788 22.191 1.917 1.00 0.00 H new ATOM 0 HB3 ASN B 175 -1.395 20.984 3.125 1.00 0.00 H new ATOM 0 HD21 ASN B 175 -1.309 24.511 4.656 1.00 0.00 H new ATOM 0 HD22 ASN B 175 -2.510 23.664 3.677 1.00 0.00 H new ATOM 835 N MET B 176 -0.602 20.568 -0.328 1.00 0.00 N ATOM 836 CA MET B 176 -0.946 19.484 -1.297 1.00 0.00 C ATOM 837 C MET B 176 0.332 18.805 -1.796 1.00 0.00 C ATOM 838 O MET B 176 0.347 17.623 -2.082 1.00 0.00 O ATOM 839 CB MET B 176 -1.669 20.184 -2.454 1.00 0.00 C ATOM 840 CG MET B 176 -3.178 19.937 -2.346 1.00 0.00 C ATOM 841 SD MET B 176 -3.901 19.846 -4.004 1.00 0.00 S ATOM 842 CE MET B 176 -5.407 20.782 -3.647 1.00 0.00 C ATOM 0 H MET B 176 -0.791 21.515 -0.655 1.00 0.00 H new ATOM 0 HA MET B 176 -1.567 18.711 -0.845 1.00 0.00 H new ATOM 0 HB2 MET B 176 -1.463 21.254 -2.430 1.00 0.00 H new ATOM 0 HB3 MET B 176 -1.297 19.810 -3.408 1.00 0.00 H new ATOM 0 HG2 MET B 176 -3.367 19.010 -1.805 1.00 0.00 H new ATOM 0 HG3 MET B 176 -3.648 20.739 -1.777 1.00 0.00 H new ATOM 0 HE1 MET B 176 -5.783 21.230 -4.567 1.00 0.00 H new ATOM 0 HE2 MET B 176 -6.162 20.113 -3.234 1.00 0.00 H new ATOM 0 HE3 MET B 176 -5.184 21.568 -2.925 1.00 0.00 H new ATOM 852 N ASP B 177 1.404 19.549 -1.897 1.00 0.00 N ATOM 853 CA ASP B 177 2.691 18.956 -2.372 1.00 0.00 C ATOM 854 C ASP B 177 3.285 18.059 -1.284 1.00 0.00 C ATOM 855 O ASP B 177 3.894 17.045 -1.567 1.00 0.00 O ATOM 856 CB ASP B 177 3.609 20.148 -2.648 1.00 0.00 C ATOM 857 CG ASP B 177 3.279 20.738 -4.021 1.00 0.00 C ATOM 858 OD1 ASP B 177 3.105 19.967 -4.949 1.00 0.00 O ATOM 859 OD2 ASP B 177 3.208 21.951 -4.119 1.00 0.00 O ATOM 0 H ASP B 177 1.444 20.543 -1.671 1.00 0.00 H new ATOM 0 HA ASP B 177 2.558 18.338 -3.260 1.00 0.00 H new ATOM 0 HB2 ASP B 177 3.482 20.905 -1.875 1.00 0.00 H new ATOM 0 HB3 ASP B 177 4.652 19.833 -2.617 1.00 0.00 H new ATOM 864 N ARG B 178 3.100 18.428 -0.044 1.00 0.00 N ATOM 865 CA ARG B 178 3.642 17.601 1.077 1.00 0.00 C ATOM 866 C ARG B 178 2.793 16.340 1.249 1.00 0.00 C ATOM 867 O ARG B 178 3.278 15.306 1.669 1.00 0.00 O ATOM 868 CB ARG B 178 3.543 18.490 2.319 1.00 0.00 C ATOM 869 CG ARG B 178 4.905 19.127 2.606 1.00 0.00 C ATOM 870 CD ARG B 178 5.237 20.142 1.510 1.00 0.00 C ATOM 871 NE ARG B 178 6.018 19.375 0.500 1.00 0.00 N ATOM 872 CZ ARG B 178 7.318 19.312 0.592 1.00 0.00 C ATOM 873 NH1 ARG B 178 8.057 20.240 0.047 1.00 0.00 N ATOM 874 NH2 ARG B 178 7.880 18.320 1.226 1.00 0.00 N ATOM 0 H ARG B 178 2.596 19.267 0.242 1.00 0.00 H new ATOM 0 HA ARG B 178 4.667 17.278 0.895 1.00 0.00 H new ATOM 0 HB2 ARG B 178 2.793 19.266 2.164 1.00 0.00 H new ATOM 0 HB3 ARG B 178 3.219 17.900 3.176 1.00 0.00 H new ATOM 0 HG2 ARG B 178 4.890 19.619 3.579 1.00 0.00 H new ATOM 0 HG3 ARG B 178 5.676 18.358 2.649 1.00 0.00 H new ATOM 0 HD2 ARG B 178 4.331 20.562 1.073 1.00 0.00 H new ATOM 0 HD3 ARG B 178 5.816 20.976 1.906 1.00 0.00 H new ATOM 0 HE ARG B 178 5.537 18.899 -0.263 1.00 0.00 H new ATOM 0 HH11 ARG B 178 7.618 21.015 -0.451 1.00 0.00 H new ATOM 0 HH12 ARG B 178 9.073 20.191 0.119 1.00 0.00 H new ATOM 0 HH21 ARG B 178 7.303 17.593 1.650 1.00 0.00 H new ATOM 0 HH22 ARG B 178 8.896 18.271 1.298 1.00 0.00 H new ATOM 888 N VAL B 179 1.528 16.422 0.922 1.00 0.00 N ATOM 889 CA VAL B 179 0.636 15.231 1.057 1.00 0.00 C ATOM 890 C VAL B 179 0.936 14.230 -0.063 1.00 0.00 C ATOM 891 O VAL B 179 0.785 13.035 0.105 1.00 0.00 O ATOM 892 CB VAL B 179 -0.792 15.777 0.930 1.00 0.00 C ATOM 893 CG1 VAL B 179 -1.799 14.630 1.043 1.00 0.00 C ATOM 894 CG2 VAL B 179 -1.056 16.790 2.048 1.00 0.00 C ATOM 0 H VAL B 179 1.074 17.264 0.567 1.00 0.00 H new ATOM 0 HA VAL B 179 0.780 14.709 2.003 1.00 0.00 H new ATOM 0 HB VAL B 179 -0.902 16.263 -0.040 1.00 0.00 H new ATOM 0 HG11 VAL B 179 -2.811 15.024 0.952 1.00 0.00 H new ATOM 0 HG12 VAL B 179 -1.618 13.907 0.247 1.00 0.00 H new ATOM 0 HG13 VAL B 179 -1.686 14.140 2.010 1.00 0.00 H new ATOM 0 HG21 VAL B 179 -2.071 17.177 1.956 1.00 0.00 H new ATOM 0 HG22 VAL B 179 -0.940 16.302 3.016 1.00 0.00 H new ATOM 0 HG23 VAL B 179 -0.346 17.613 1.969 1.00 0.00 H new ATOM 904 N ASP B 180 1.363 14.715 -1.200 1.00 0.00 N ATOM 905 CA ASP B 180 1.680 13.798 -2.337 1.00 0.00 C ATOM 906 C ASP B 180 2.967 13.025 -2.044 1.00 0.00 C ATOM 907 O ASP B 180 3.137 11.899 -2.472 1.00 0.00 O ATOM 908 CB ASP B 180 1.864 14.709 -3.553 1.00 0.00 C ATOM 909 CG ASP B 180 2.046 13.854 -4.809 1.00 0.00 C ATOM 910 OD1 ASP B 180 3.104 13.264 -4.952 1.00 0.00 O ATOM 911 OD2 ASP B 180 1.124 13.806 -5.607 1.00 0.00 O ATOM 0 H ASP B 180 1.506 15.707 -1.391 1.00 0.00 H new ATOM 0 HA ASP B 180 0.894 13.061 -2.502 1.00 0.00 H new ATOM 0 HB2 ASP B 180 0.998 15.361 -3.666 1.00 0.00 H new ATOM 0 HB3 ASP B 180 2.731 15.353 -3.410 1.00 0.00 H new ATOM 916 N ARG B 181 3.870 13.624 -1.310 1.00 0.00 N ATOM 917 CA ARG B 181 5.149 12.930 -0.975 1.00 0.00 C ATOM 918 C ARG B 181 4.897 11.854 0.084 1.00 0.00 C ATOM 919 O ARG B 181 5.589 10.855 0.143 1.00 0.00 O ATOM 920 CB ARG B 181 6.069 14.022 -0.424 1.00 0.00 C ATOM 921 CG ARG B 181 7.498 13.782 -0.915 1.00 0.00 C ATOM 922 CD ARG B 181 7.591 14.120 -2.406 1.00 0.00 C ATOM 923 NE ARG B 181 8.116 15.512 -2.451 1.00 0.00 N ATOM 924 CZ ARG B 181 7.456 16.438 -3.093 1.00 0.00 C ATOM 925 NH1 ARG B 181 7.671 16.630 -4.365 1.00 0.00 N ATOM 926 NH2 ARG B 181 6.580 17.170 -2.460 1.00 0.00 N ATOM 0 H ARG B 181 3.776 14.565 -0.928 1.00 0.00 H new ATOM 0 HA ARG B 181 5.588 12.433 -1.840 1.00 0.00 H new ATOM 0 HB2 ARG B 181 5.722 15.003 -0.749 1.00 0.00 H new ATOM 0 HB3 ARG B 181 6.042 14.019 0.666 1.00 0.00 H new ATOM 0 HG2 ARG B 181 8.197 14.397 -0.348 1.00 0.00 H new ATOM 0 HG3 ARG B 181 7.781 12.743 -0.749 1.00 0.00 H new ATOM 0 HD2 ARG B 181 8.255 13.430 -2.927 1.00 0.00 H new ATOM 0 HD3 ARG B 181 6.616 14.050 -2.889 1.00 0.00 H new ATOM 0 HE ARG B 181 8.991 15.743 -1.980 1.00 0.00 H new ATOM 0 HH11 ARG B 181 8.355 16.057 -4.859 1.00 0.00 H new ATOM 0 HH12 ARG B 181 7.155 17.353 -4.866 1.00 0.00 H new ATOM 0 HH21 ARG B 181 6.412 17.018 -1.465 1.00 0.00 H new ATOM 0 HH22 ARG B 181 6.064 17.894 -2.960 1.00 0.00 H new ATOM 940 N GLU B 182 3.905 12.052 0.917 1.00 0.00 N ATOM 941 CA GLU B 182 3.596 11.043 1.975 1.00 0.00 C ATOM 942 C GLU B 182 2.915 9.824 1.350 1.00 0.00 C ATOM 943 O GLU B 182 3.156 8.698 1.746 1.00 0.00 O ATOM 944 CB GLU B 182 2.648 11.749 2.944 1.00 0.00 C ATOM 945 CG GLU B 182 2.491 10.908 4.212 1.00 0.00 C ATOM 946 CD GLU B 182 1.434 11.539 5.118 1.00 0.00 C ATOM 947 OE1 GLU B 182 0.376 11.877 4.615 1.00 0.00 O ATOM 948 OE2 GLU B 182 1.701 11.675 6.301 1.00 0.00 O ATOM 0 H GLU B 182 3.296 12.870 0.909 1.00 0.00 H new ATOM 0 HA GLU B 182 4.494 10.687 2.480 1.00 0.00 H new ATOM 0 HB2 GLU B 182 3.037 12.736 3.196 1.00 0.00 H new ATOM 0 HB3 GLU B 182 1.677 11.900 2.473 1.00 0.00 H new ATOM 0 HG2 GLU B 182 2.201 9.890 3.952 1.00 0.00 H new ATOM 0 HG3 GLU B 182 3.444 10.843 4.738 1.00 0.00 H new ATOM 955 N ILE B 183 2.075 10.043 0.374 1.00 0.00 N ATOM 956 CA ILE B 183 1.377 8.899 -0.290 1.00 0.00 C ATOM 957 C ILE B 183 2.379 8.108 -1.138 1.00 0.00 C ATOM 958 O ILE B 183 2.241 6.913 -1.322 1.00 0.00 O ATOM 959 CB ILE B 183 0.294 9.538 -1.166 1.00 0.00 C ATOM 960 CG1 ILE B 183 -0.683 10.310 -0.275 1.00 0.00 C ATOM 961 CG2 ILE B 183 -0.470 8.448 -1.925 1.00 0.00 C ATOM 962 CD1 ILE B 183 -1.679 11.076 -1.147 1.00 0.00 C ATOM 0 H ILE B 183 1.840 10.965 0.006 1.00 0.00 H new ATOM 0 HA ILE B 183 0.943 8.200 0.425 1.00 0.00 H new ATOM 0 HB ILE B 183 0.761 10.216 -1.881 1.00 0.00 H new ATOM 0 HG12 ILE B 183 -1.214 9.621 0.381 1.00 0.00 H new ATOM 0 HG13 ILE B 183 -0.137 11.003 0.365 1.00 0.00 H new ATOM 0 HG21 ILE B 183 -1.239 8.908 -2.546 1.00 0.00 H new ATOM 0 HG22 ILE B 183 0.222 7.891 -2.557 1.00 0.00 H new ATOM 0 HG23 ILE B 183 -0.938 7.768 -1.213 1.00 0.00 H new ATOM 0 HD11 ILE B 183 -2.373 11.625 -0.510 1.00 0.00 H new ATOM 0 HD12 ILE B 183 -1.140 11.777 -1.785 1.00 0.00 H new ATOM 0 HD13 ILE B 183 -2.234 10.373 -1.768 1.00 0.00 H new ATOM 974 N THR B 184 3.388 8.769 -1.645 1.00 0.00 N ATOM 975 CA THR B 184 4.411 8.061 -2.474 1.00 0.00 C ATOM 976 C THR B 184 5.258 7.152 -1.581 1.00 0.00 C ATOM 977 O THR B 184 5.684 6.088 -1.989 1.00 0.00 O ATOM 978 CB THR B 184 5.273 9.168 -3.086 1.00 0.00 C ATOM 979 OG1 THR B 184 4.444 10.063 -3.814 1.00 0.00 O ATOM 980 CG2 THR B 184 6.308 8.549 -4.028 1.00 0.00 C ATOM 0 H THR B 184 3.548 9.769 -1.521 1.00 0.00 H new ATOM 0 HA THR B 184 3.961 7.433 -3.243 1.00 0.00 H new ATOM 0 HB THR B 184 5.786 9.711 -2.292 1.00 0.00 H new ATOM 0 HG1 THR B 184 4.055 10.721 -3.201 1.00 0.00 H new ATOM 0 HG21 THR B 184 6.921 9.338 -4.463 1.00 0.00 H new ATOM 0 HG22 THR B 184 6.943 7.862 -3.469 1.00 0.00 H new ATOM 0 HG23 THR B 184 5.797 8.006 -4.823 1.00 0.00 H new ATOM 988 N MET B 185 5.494 7.564 -0.360 1.00 0.00 N ATOM 989 CA MET B 185 6.305 6.724 0.574 1.00 0.00 C ATOM 990 C MET B 185 5.508 5.481 0.973 1.00 0.00 C ATOM 991 O MET B 185 6.024 4.379 0.986 1.00 0.00 O ATOM 992 CB MET B 185 6.566 7.611 1.794 1.00 0.00 C ATOM 993 CG MET B 185 7.981 8.190 1.717 1.00 0.00 C ATOM 994 SD MET B 185 8.218 9.381 3.059 1.00 0.00 S ATOM 995 CE MET B 185 8.704 10.788 2.029 1.00 0.00 C ATOM 0 H MET B 185 5.160 8.445 0.030 1.00 0.00 H new ATOM 0 HA MET B 185 7.236 6.381 0.122 1.00 0.00 H new ATOM 0 HB2 MET B 185 5.834 8.418 1.832 1.00 0.00 H new ATOM 0 HB3 MET B 185 6.449 7.031 2.709 1.00 0.00 H new ATOM 0 HG2 MET B 185 8.718 7.390 1.792 1.00 0.00 H new ATOM 0 HG3 MET B 185 8.135 8.676 0.754 1.00 0.00 H new ATOM 0 HE1 MET B 185 8.903 11.652 2.663 1.00 0.00 H new ATOM 0 HE2 MET B 185 9.604 10.535 1.468 1.00 0.00 H new ATOM 0 HE3 MET B 185 7.899 11.026 1.334 1.00 0.00 H new ATOM 1005 N VAL B 186 4.250 5.655 1.292 1.00 0.00 N ATOM 1006 CA VAL B 186 3.403 4.486 1.683 1.00 0.00 C ATOM 1007 C VAL B 186 3.209 3.567 0.475 1.00 0.00 C ATOM 1008 O VAL B 186 3.079 2.365 0.612 1.00 0.00 O ATOM 1009 CB VAL B 186 2.065 5.085 2.134 1.00 0.00 C ATOM 1010 CG1 VAL B 186 1.109 3.963 2.550 1.00 0.00 C ATOM 1011 CG2 VAL B 186 2.297 6.020 3.325 1.00 0.00 C ATOM 0 H VAL B 186 3.772 6.556 1.299 1.00 0.00 H new ATOM 0 HA VAL B 186 3.856 3.888 2.474 1.00 0.00 H new ATOM 0 HB VAL B 186 1.628 5.646 1.308 1.00 0.00 H new ATOM 0 HG11 VAL B 186 0.160 4.393 2.870 1.00 0.00 H new ATOM 0 HG12 VAL B 186 0.939 3.297 1.704 1.00 0.00 H new ATOM 0 HG13 VAL B 186 1.547 3.398 3.373 1.00 0.00 H new ATOM 0 HG21 VAL B 186 1.346 6.445 3.645 1.00 0.00 H new ATOM 0 HG22 VAL B 186 2.738 5.458 4.148 1.00 0.00 H new ATOM 0 HG23 VAL B 186 2.973 6.823 3.031 1.00 0.00 H new ATOM 1021 N GLU B 187 3.196 4.129 -0.707 1.00 0.00 N ATOM 1022 CA GLU B 187 3.017 3.298 -1.937 1.00 0.00 C ATOM 1023 C GLU B 187 4.265 2.446 -2.173 1.00 0.00 C ATOM 1024 O GLU B 187 4.190 1.353 -2.703 1.00 0.00 O ATOM 1025 CB GLU B 187 2.827 4.300 -3.077 1.00 0.00 C ATOM 1026 CG GLU B 187 2.277 3.576 -4.307 1.00 0.00 C ATOM 1027 CD GLU B 187 2.733 4.301 -5.574 1.00 0.00 C ATOM 1028 OE1 GLU B 187 3.927 4.311 -5.828 1.00 0.00 O ATOM 1029 OE2 GLU B 187 1.884 4.834 -6.268 1.00 0.00 O ATOM 0 H GLU B 187 3.302 5.130 -0.874 1.00 0.00 H new ATOM 0 HA GLU B 187 2.171 2.616 -1.857 1.00 0.00 H new ATOM 0 HB2 GLU B 187 2.142 5.090 -2.770 1.00 0.00 H new ATOM 0 HB3 GLU B 187 3.777 4.778 -3.318 1.00 0.00 H new ATOM 0 HG2 GLU B 187 2.626 2.544 -4.321 1.00 0.00 H new ATOM 0 HG3 GLU B 187 1.188 3.543 -4.266 1.00 0.00 H new ATOM 1036 N GLN B 188 5.410 2.939 -1.774 1.00 0.00 N ATOM 1037 CA GLN B 188 6.673 2.161 -1.965 1.00 0.00 C ATOM 1038 C GLN B 188 6.657 0.924 -1.068 1.00 0.00 C ATOM 1039 O GLN B 188 7.130 -0.133 -1.443 1.00 0.00 O ATOM 1040 CB GLN B 188 7.802 3.111 -1.552 1.00 0.00 C ATOM 1041 CG GLN B 188 8.494 3.664 -2.800 1.00 0.00 C ATOM 1042 CD GLN B 188 7.577 4.678 -3.488 1.00 0.00 C ATOM 1043 OE1 GLN B 188 7.759 5.871 -3.349 1.00 0.00 O ATOM 1044 NE2 GLN B 188 6.592 4.249 -4.229 1.00 0.00 N ATOM 0 H GLN B 188 5.525 3.847 -1.324 1.00 0.00 H new ATOM 0 HA GLN B 188 6.796 1.816 -2.992 1.00 0.00 H new ATOM 0 HB2 GLN B 188 7.401 3.929 -0.954 1.00 0.00 H new ATOM 0 HB3 GLN B 188 8.524 2.584 -0.928 1.00 0.00 H new ATOM 0 HG2 GLN B 188 9.436 4.138 -2.526 1.00 0.00 H new ATOM 0 HG3 GLN B 188 8.734 2.851 -3.486 1.00 0.00 H new ATOM 0 HE21 GLN B 188 6.440 3.247 -4.345 1.00 0.00 H new ATOM 0 HE22 GLN B 188 5.974 4.916 -4.692 1.00 0.00 H new ATOM 1053 N GLN B 189 6.111 1.050 0.112 1.00 0.00 N ATOM 1054 CA GLN B 189 6.053 -0.115 1.045 1.00 0.00 C ATOM 1055 C GLN B 189 5.095 -1.174 0.495 1.00 0.00 C ATOM 1056 O GLN B 189 5.347 -2.360 0.592 1.00 0.00 O ATOM 1057 CB GLN B 189 5.528 0.450 2.369 1.00 0.00 C ATOM 1058 CG GLN B 189 6.294 -0.179 3.538 1.00 0.00 C ATOM 1059 CD GLN B 189 7.415 0.764 3.985 1.00 0.00 C ATOM 1060 OE1 GLN B 189 7.666 0.909 5.166 1.00 0.00 O ATOM 1061 NE2 GLN B 189 8.103 1.415 3.088 1.00 0.00 N ATOM 0 H GLN B 189 5.701 1.912 0.472 1.00 0.00 H new ATOM 0 HA GLN B 189 7.025 -0.592 1.170 1.00 0.00 H new ATOM 0 HB2 GLN B 189 5.646 1.534 2.385 1.00 0.00 H new ATOM 0 HB3 GLN B 189 4.462 0.244 2.467 1.00 0.00 H new ATOM 0 HG2 GLN B 189 5.615 -0.373 4.369 1.00 0.00 H new ATOM 0 HG3 GLN B 189 6.712 -1.140 3.237 1.00 0.00 H new ATOM 0 HE21 GLN B 189 7.893 1.294 2.097 1.00 0.00 H new ATOM 0 HE22 GLN B 189 8.851 2.045 3.377 1.00 0.00 H new ATOM 1070 N ILE B 190 4.002 -0.750 -0.087 1.00 0.00 N ATOM 1071 CA ILE B 190 3.021 -1.729 -0.652 1.00 0.00 C ATOM 1072 C ILE B 190 3.613 -2.390 -1.899 1.00 0.00 C ATOM 1073 O ILE B 190 3.417 -3.566 -2.140 1.00 0.00 O ATOM 1074 CB ILE B 190 1.779 -0.904 -1.009 1.00 0.00 C ATOM 1075 CG1 ILE B 190 1.245 -0.217 0.254 1.00 0.00 C ATOM 1076 CG2 ILE B 190 0.699 -1.829 -1.581 1.00 0.00 C ATOM 1077 CD1 ILE B 190 0.052 0.678 -0.100 1.00 0.00 C ATOM 0 H ILE B 190 3.745 0.231 -0.196 1.00 0.00 H new ATOM 0 HA ILE B 190 2.778 -2.526 0.051 1.00 0.00 H new ATOM 0 HB ILE B 190 2.043 -0.150 -1.751 1.00 0.00 H new ATOM 0 HG12 ILE B 190 0.943 -0.967 0.986 1.00 0.00 H new ATOM 0 HG13 ILE B 190 2.033 0.379 0.715 1.00 0.00 H new ATOM 0 HG21 ILE B 190 -0.184 -1.243 -1.835 1.00 0.00 H new ATOM 0 HG22 ILE B 190 1.078 -2.321 -2.477 1.00 0.00 H new ATOM 0 HG23 ILE B 190 0.434 -2.582 -0.838 1.00 0.00 H new ATOM 0 HD11 ILE B 190 -0.321 1.162 0.803 1.00 0.00 H new ATOM 0 HD12 ILE B 190 0.367 1.438 -0.815 1.00 0.00 H new ATOM 0 HD13 ILE B 190 -0.740 0.072 -0.540 1.00 0.00 H new ATOM 1089 N SER B 191 4.342 -1.639 -2.682 1.00 0.00 N ATOM 1090 CA SER B 191 4.963 -2.217 -3.914 1.00 0.00 C ATOM 1091 C SER B 191 6.061 -3.204 -3.520 1.00 0.00 C ATOM 1092 O SER B 191 6.283 -4.198 -4.186 1.00 0.00 O ATOM 1093 CB SER B 191 5.553 -1.025 -4.668 1.00 0.00 C ATOM 1094 OG SER B 191 4.499 -0.269 -5.249 1.00 0.00 O ATOM 0 H SER B 191 4.535 -0.650 -2.523 1.00 0.00 H new ATOM 0 HA SER B 191 4.244 -2.760 -4.528 1.00 0.00 H new ATOM 0 HB2 SER B 191 6.132 -0.400 -3.988 1.00 0.00 H new ATOM 0 HB3 SER B 191 6.237 -1.372 -5.443 1.00 0.00 H new ATOM 0 HG SER B 191 4.183 0.400 -4.606 1.00 0.00 H new ATOM 1100 N LYS B 192 6.741 -2.940 -2.433 1.00 0.00 N ATOM 1101 CA LYS B 192 7.819 -3.866 -1.979 1.00 0.00 C ATOM 1102 C LYS B 192 7.192 -5.093 -1.317 1.00 0.00 C ATOM 1103 O LYS B 192 7.707 -6.191 -1.411 1.00 0.00 O ATOM 1104 CB LYS B 192 8.643 -3.063 -0.969 1.00 0.00 C ATOM 1105 CG LYS B 192 9.257 -1.845 -1.663 1.00 0.00 C ATOM 1106 CD LYS B 192 10.636 -2.213 -2.215 1.00 0.00 C ATOM 1107 CE LYS B 192 11.079 -1.156 -3.230 1.00 0.00 C ATOM 1108 NZ LYS B 192 11.668 -0.059 -2.412 1.00 0.00 N ATOM 0 H LYS B 192 6.595 -2.122 -1.841 1.00 0.00 H new ATOM 0 HA LYS B 192 8.439 -4.223 -2.801 1.00 0.00 H new ATOM 0 HB2 LYS B 192 8.011 -2.742 -0.141 1.00 0.00 H new ATOM 0 HB3 LYS B 192 9.429 -3.688 -0.546 1.00 0.00 H new ATOM 0 HG2 LYS B 192 8.608 -1.508 -2.471 1.00 0.00 H new ATOM 0 HG3 LYS B 192 9.344 -1.018 -0.959 1.00 0.00 H new ATOM 0 HD2 LYS B 192 11.359 -2.278 -1.402 1.00 0.00 H new ATOM 0 HD3 LYS B 192 10.600 -3.194 -2.688 1.00 0.00 H new ATOM 0 HE2 LYS B 192 11.809 -1.562 -3.930 1.00 0.00 H new ATOM 0 HE3 LYS B 192 10.236 -0.799 -3.821 1.00 0.00 H new ATOM 0 HZ1 LYS B 192 11.995 0.704 -3.038 1.00 0.00 H new ATOM 0 HZ2 LYS B 192 10.948 0.313 -1.760 1.00 0.00 H new ATOM 0 HZ3 LYS B 192 12.473 -0.427 -1.866 1.00 0.00 H new ATOM 1122 N LEU B 193 6.072 -4.912 -0.661 1.00 0.00 N ATOM 1123 CA LEU B 193 5.392 -6.067 -0.004 1.00 0.00 C ATOM 1124 C LEU B 193 4.745 -6.948 -1.073 1.00 0.00 C ATOM 1125 O LEU B 193 4.677 -8.155 -0.939 1.00 0.00 O ATOM 1126 CB LEU B 193 4.327 -5.447 0.908 1.00 0.00 C ATOM 1127 CG LEU B 193 4.348 -6.141 2.272 1.00 0.00 C ATOM 1128 CD1 LEU B 193 4.006 -5.129 3.365 1.00 0.00 C ATOM 1129 CD2 LEU B 193 3.318 -7.272 2.284 1.00 0.00 C ATOM 0 H LEU B 193 5.601 -4.014 -0.553 1.00 0.00 H new ATOM 0 HA LEU B 193 6.081 -6.693 0.563 1.00 0.00 H new ATOM 0 HB2 LEU B 193 4.515 -4.380 1.029 1.00 0.00 H new ATOM 0 HB3 LEU B 193 3.342 -5.548 0.453 1.00 0.00 H new ATOM 0 HG LEU B 193 5.341 -6.551 2.455 1.00 0.00 H new ATOM 0 HD11 LEU B 193 4.021 -5.623 4.336 1.00 0.00 H new ATOM 0 HD12 LEU B 193 4.740 -4.323 3.357 1.00 0.00 H new ATOM 0 HD13 LEU B 193 3.013 -4.718 3.182 1.00 0.00 H new ATOM 0 HD21 LEU B 193 3.332 -7.767 3.255 1.00 0.00 H new ATOM 0 HD22 LEU B 193 2.325 -6.862 2.100 1.00 0.00 H new ATOM 0 HD23 LEU B 193 3.562 -7.994 1.505 1.00 0.00 H new ATOM 1141 N LYS B 194 4.281 -6.349 -2.143 1.00 0.00 N ATOM 1142 CA LYS B 194 3.649 -7.145 -3.236 1.00 0.00 C ATOM 1143 C LYS B 194 4.700 -8.051 -3.877 1.00 0.00 C ATOM 1144 O LYS B 194 4.431 -9.190 -4.212 1.00 0.00 O ATOM 1145 CB LYS B 194 3.136 -6.116 -4.247 1.00 0.00 C ATOM 1146 CG LYS B 194 1.888 -6.663 -4.944 1.00 0.00 C ATOM 1147 CD LYS B 194 0.676 -6.496 -4.027 1.00 0.00 C ATOM 1148 CE LYS B 194 -0.595 -6.889 -4.784 1.00 0.00 C ATOM 1149 NZ LYS B 194 -1.566 -7.286 -3.726 1.00 0.00 N ATOM 0 H LYS B 194 4.314 -5.342 -2.305 1.00 0.00 H new ATOM 0 HA LYS B 194 2.842 -7.782 -2.875 1.00 0.00 H new ATOM 0 HB2 LYS B 194 2.902 -5.179 -3.741 1.00 0.00 H new ATOM 0 HB3 LYS B 194 3.910 -5.896 -4.983 1.00 0.00 H new ATOM 0 HG2 LYS B 194 1.722 -6.135 -5.883 1.00 0.00 H new ATOM 0 HG3 LYS B 194 2.028 -7.715 -5.191 1.00 0.00 H new ATOM 0 HD2 LYS B 194 0.790 -7.118 -3.139 1.00 0.00 H new ATOM 0 HD3 LYS B 194 0.604 -5.463 -3.686 1.00 0.00 H new ATOM 0 HE2 LYS B 194 -0.975 -6.057 -5.376 1.00 0.00 H new ATOM 0 HE3 LYS B 194 -0.405 -7.711 -5.474 1.00 0.00 H new ATOM 0 HZ1 LYS B 194 -2.502 -7.439 -4.153 1.00 0.00 H new ATOM 0 HZ2 LYS B 194 -1.245 -8.165 -3.272 1.00 0.00 H new ATOM 0 HZ3 LYS B 194 -1.630 -6.532 -3.013 1.00 0.00 H new ATOM 1163 N LYS B 195 5.902 -7.555 -4.033 1.00 0.00 N ATOM 1164 CA LYS B 195 6.986 -8.388 -4.635 1.00 0.00 C ATOM 1165 C LYS B 195 7.339 -9.527 -3.679 1.00 0.00 C ATOM 1166 O LYS B 195 7.715 -10.607 -4.096 1.00 0.00 O ATOM 1167 CB LYS B 195 8.174 -7.439 -4.812 1.00 0.00 C ATOM 1168 CG LYS B 195 9.103 -7.979 -5.901 1.00 0.00 C ATOM 1169 CD LYS B 195 8.741 -7.341 -7.243 1.00 0.00 C ATOM 1170 CE LYS B 195 9.882 -7.566 -8.240 1.00 0.00 C ATOM 1171 NZ LYS B 195 9.440 -6.885 -9.488 1.00 0.00 N ATOM 0 H LYS B 195 6.179 -6.609 -3.769 1.00 0.00 H new ATOM 0 HA LYS B 195 6.694 -8.837 -5.584 1.00 0.00 H new ATOM 0 HB2 LYS B 195 7.821 -6.444 -5.082 1.00 0.00 H new ATOM 0 HB3 LYS B 195 8.717 -7.341 -3.872 1.00 0.00 H new ATOM 0 HG2 LYS B 195 10.141 -7.760 -5.650 1.00 0.00 H new ATOM 0 HG3 LYS B 195 9.013 -9.063 -5.966 1.00 0.00 H new ATOM 0 HD2 LYS B 195 7.818 -7.775 -7.627 1.00 0.00 H new ATOM 0 HD3 LYS B 195 8.562 -6.274 -7.114 1.00 0.00 H new ATOM 0 HE2 LYS B 195 10.818 -7.146 -7.871 1.00 0.00 H new ATOM 0 HE3 LYS B 195 10.055 -8.629 -8.410 1.00 0.00 H new ATOM 0 HZ1 LYS B 195 10.170 -6.995 -10.221 1.00 0.00 H new ATOM 0 HZ2 LYS B 195 8.551 -7.310 -9.819 1.00 0.00 H new ATOM 0 HZ3 LYS B 195 9.290 -5.874 -9.297 1.00 0.00 H new ATOM 1185 N LYS B 196 7.207 -9.293 -2.397 1.00 0.00 N ATOM 1186 CA LYS B 196 7.518 -10.361 -1.398 1.00 0.00 C ATOM 1187 C LYS B 196 6.554 -11.532 -1.589 1.00 0.00 C ATOM 1188 O LYS B 196 6.925 -12.684 -1.456 1.00 0.00 O ATOM 1189 CB LYS B 196 7.313 -9.702 -0.030 1.00 0.00 C ATOM 1190 CG LYS B 196 7.597 -10.715 1.086 1.00 0.00 C ATOM 1191 CD LYS B 196 6.279 -11.310 1.592 1.00 0.00 C ATOM 1192 CE LYS B 196 5.427 -10.210 2.237 1.00 0.00 C ATOM 1193 NZ LYS B 196 4.889 -10.820 3.485 1.00 0.00 N ATOM 0 H LYS B 196 6.897 -8.407 -1.999 1.00 0.00 H new ATOM 0 HA LYS B 196 8.529 -10.755 -1.502 1.00 0.00 H new ATOM 0 HB2 LYS B 196 7.974 -8.841 0.071 1.00 0.00 H new ATOM 0 HB3 LYS B 196 6.292 -9.331 0.055 1.00 0.00 H new ATOM 0 HG2 LYS B 196 8.246 -11.508 0.714 1.00 0.00 H new ATOM 0 HG3 LYS B 196 8.126 -10.229 1.906 1.00 0.00 H new ATOM 0 HD2 LYS B 196 5.735 -11.767 0.766 1.00 0.00 H new ATOM 0 HD3 LYS B 196 6.480 -12.099 2.317 1.00 0.00 H new ATOM 0 HE2 LYS B 196 6.025 -9.325 2.456 1.00 0.00 H new ATOM 0 HE3 LYS B 196 4.622 -9.894 1.573 1.00 0.00 H new ATOM 0 HZ1 LYS B 196 4.007 -10.339 3.754 1.00 0.00 H new ATOM 0 HZ2 LYS B 196 4.698 -11.829 3.324 1.00 0.00 H new ATOM 0 HZ3 LYS B 196 5.586 -10.718 4.250 1.00 0.00 H new ATOM 1207 N GLN B 197 5.320 -11.240 -1.908 1.00 0.00 N ATOM 1208 CA GLN B 197 4.318 -12.328 -2.122 1.00 0.00 C ATOM 1209 C GLN B 197 4.745 -13.196 -3.306 1.00 0.00 C ATOM 1210 O GLN B 197 4.467 -14.380 -3.352 1.00 0.00 O ATOM 1211 CB GLN B 197 3.000 -11.612 -2.428 1.00 0.00 C ATOM 1212 CG GLN B 197 1.881 -12.644 -2.579 1.00 0.00 C ATOM 1213 CD GLN B 197 0.533 -11.925 -2.674 1.00 0.00 C ATOM 1214 OE1 GLN B 197 0.159 -11.447 -3.726 1.00 0.00 O ATOM 1215 NE2 GLN B 197 -0.215 -11.828 -1.609 1.00 0.00 N ATOM 0 H GLN B 197 4.961 -10.293 -2.030 1.00 0.00 H new ATOM 0 HA GLN B 197 4.225 -12.983 -1.255 1.00 0.00 H new ATOM 0 HB2 GLN B 197 2.759 -10.913 -1.627 1.00 0.00 H new ATOM 0 HB3 GLN B 197 3.096 -11.027 -3.343 1.00 0.00 H new ATOM 0 HG2 GLN B 197 2.047 -13.248 -3.471 1.00 0.00 H new ATOM 0 HG3 GLN B 197 1.883 -13.325 -1.728 1.00 0.00 H new ATOM 0 HE21 GLN B 197 0.100 -12.230 -0.726 1.00 0.00 H new ATOM 0 HE22 GLN B 197 -1.115 -11.350 -1.660 1.00 0.00 H new ATOM 1224 N GLN B 198 5.427 -12.612 -4.260 1.00 0.00 N ATOM 1225 CA GLN B 198 5.887 -13.396 -5.447 1.00 0.00 C ATOM 1226 C GLN B 198 6.834 -14.510 -4.999 1.00 0.00 C ATOM 1227 O GLN B 198 6.768 -15.625 -5.482 1.00 0.00 O ATOM 1228 CB GLN B 198 6.626 -12.392 -6.335 1.00 0.00 C ATOM 1229 CG GLN B 198 6.721 -12.941 -7.758 1.00 0.00 C ATOM 1230 CD GLN B 198 6.653 -11.784 -8.756 1.00 0.00 C ATOM 1231 OE1 GLN B 198 7.490 -11.669 -9.629 1.00 0.00 O ATOM 1232 NE2 GLN B 198 5.683 -10.917 -8.664 1.00 0.00 N ATOM 0 H GLN B 198 5.685 -11.625 -4.268 1.00 0.00 H new ATOM 0 HA GLN B 198 5.058 -13.867 -5.976 1.00 0.00 H new ATOM 0 HB2 GLN B 198 6.101 -11.437 -6.337 1.00 0.00 H new ATOM 0 HB3 GLN B 198 7.624 -12.206 -5.939 1.00 0.00 H new ATOM 0 HG2 GLN B 198 7.653 -13.491 -7.886 1.00 0.00 H new ATOM 0 HG3 GLN B 198 5.908 -13.644 -7.943 1.00 0.00 H new ATOM 0 HE21 GLN B 198 4.980 -11.014 -7.931 1.00 0.00 H new ATOM 0 HE22 GLN B 198 5.627 -10.142 -9.325 1.00 0.00 H new ATOM 1241 N GLN B 199 7.708 -14.211 -4.075 1.00 0.00 N ATOM 1242 CA GLN B 199 8.664 -15.248 -3.579 1.00 0.00 C ATOM 1243 C GLN B 199 7.892 -16.396 -2.925 1.00 0.00 C ATOM 1244 O GLN B 199 8.203 -17.556 -3.121 1.00 0.00 O ATOM 1245 CB GLN B 199 9.540 -14.534 -2.548 1.00 0.00 C ATOM 1246 CG GLN B 199 10.474 -13.554 -3.262 1.00 0.00 C ATOM 1247 CD GLN B 199 11.346 -12.836 -2.230 1.00 0.00 C ATOM 1248 OE1 GLN B 199 12.557 -12.833 -2.338 1.00 0.00 O ATOM 1249 NE2 GLN B 199 10.779 -12.222 -1.228 1.00 0.00 N ATOM 0 H GLN B 199 7.802 -13.293 -3.641 1.00 0.00 H new ATOM 0 HA GLN B 199 9.261 -15.677 -4.384 1.00 0.00 H new ATOM 0 HB2 GLN B 199 8.915 -14.001 -1.831 1.00 0.00 H new ATOM 0 HB3 GLN B 199 10.122 -15.262 -1.983 1.00 0.00 H new ATOM 0 HG2 GLN B 199 11.102 -14.088 -3.976 1.00 0.00 H new ATOM 0 HG3 GLN B 199 9.892 -12.828 -3.830 1.00 0.00 H new ATOM 0 HE21 GLN B 199 9.763 -12.224 -1.137 1.00 0.00 H new ATOM 0 HE22 GLN B 199 11.352 -11.740 -0.535 1.00 0.00 H new ATOM 1258 N LEU B 200 6.881 -16.075 -2.156 1.00 0.00 N ATOM 1259 CA LEU B 200 6.074 -17.142 -1.492 1.00 0.00 C ATOM 1260 C LEU B 200 5.208 -17.858 -2.531 1.00 0.00 C ATOM 1261 O LEU B 200 4.915 -19.032 -2.405 1.00 0.00 O ATOM 1262 CB LEU B 200 5.198 -16.410 -0.473 1.00 0.00 C ATOM 1263 CG LEU B 200 4.769 -17.384 0.626 1.00 0.00 C ATOM 1264 CD1 LEU B 200 5.778 -17.336 1.773 1.00 0.00 C ATOM 1265 CD2 LEU B 200 3.386 -16.987 1.146 1.00 0.00 C ATOM 0 H LEU B 200 6.581 -15.120 -1.960 1.00 0.00 H new ATOM 0 HA LEU B 200 6.698 -17.898 -1.015 1.00 0.00 H new ATOM 0 HB2 LEU B 200 5.748 -15.575 -0.039 1.00 0.00 H new ATOM 0 HB3 LEU B 200 4.320 -15.992 -0.966 1.00 0.00 H new ATOM 0 HG LEU B 200 4.729 -18.395 0.221 1.00 0.00 H new ATOM 0 HD11 LEU B 200 5.472 -18.030 2.556 1.00 0.00 H new ATOM 0 HD12 LEU B 200 6.764 -17.618 1.403 1.00 0.00 H new ATOM 0 HD13 LEU B 200 5.819 -16.325 2.180 1.00 0.00 H new ATOM 0 HD21 LEU B 200 3.079 -17.680 1.929 1.00 0.00 H new ATOM 0 HD22 LEU B 200 3.426 -15.976 1.552 1.00 0.00 H new ATOM 0 HD23 LEU B 200 2.666 -17.022 0.328 1.00 0.00 H new ATOM 1277 N GLU B 201 4.804 -17.155 -3.559 1.00 0.00 N ATOM 1278 CA GLU B 201 3.963 -17.785 -4.620 1.00 0.00 C ATOM 1279 C GLU B 201 4.839 -18.640 -5.537 1.00 0.00 C ATOM 1280 O GLU B 201 4.399 -19.636 -6.079 1.00 0.00 O ATOM 1281 CB GLU B 201 3.352 -16.617 -5.396 1.00 0.00 C ATOM 1282 CG GLU B 201 2.129 -16.087 -4.644 1.00 0.00 C ATOM 1283 CD GLU B 201 1.260 -15.266 -5.598 1.00 0.00 C ATOM 1284 OE1 GLU B 201 1.667 -14.170 -5.944 1.00 0.00 O ATOM 1285 OE2 GLU B 201 0.201 -15.748 -5.965 1.00 0.00 O ATOM 0 H GLU B 201 5.021 -16.170 -3.709 1.00 0.00 H new ATOM 0 HA GLU B 201 3.195 -18.438 -4.207 1.00 0.00 H new ATOM 0 HB2 GLU B 201 4.089 -15.823 -5.518 1.00 0.00 H new ATOM 0 HB3 GLU B 201 3.064 -16.942 -6.396 1.00 0.00 H new ATOM 0 HG2 GLU B 201 1.553 -16.917 -4.234 1.00 0.00 H new ATOM 0 HG3 GLU B 201 2.445 -15.471 -3.802 1.00 0.00 H new