USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 85 TYR OH : rot 90:sc= 0.587 USER MOD Set 1.2: B 188 LYS NZ :NH3+ -175:sc= 1.76 (180deg=1.2) USER MOD Single : A 86 ASN : amide:sc= -0.315 K(o=-0.32,f=-2.2!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot 180:sc= 0.342 USER MOD Single : B 168 LYS NZ :NH3+ -169:sc=-0.00535 (180deg=-0.146) USER MOD Single : B 170 THR OG1 : rot 82:sc= 0.483 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 177 ASN : amide:sc= -0.307 X(o=-0.31,f=-0.31) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 183 THR OG1 : rot 180:sc= 0 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 186 MET CE :methyl 178:sc= 0 (180deg=-0.0095) USER MOD Single : B 187 GLN : amide:sc= -0.37 X(o=-0.37,f=-0.37) USER MOD Single : B 190 GLN : amide:sc= 0.59 K(o=0.59,f=0) USER MOD Single : B 192 ASN : amide:sc= 0.294 K(o=0.29,f=-6.6!) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= -1.12 K(o=-1.1,f=-0.16) USER MOD Single : B 201 GLN : amide:sc= 0.93 K(o=0.93,f=-4.1!) USER MOD Single : B 202 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.37) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= -0.457 X(o=-0.46,f=0) USER MOD Single : B 207 TYR OH : rot 30:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 214 GLN : amide:sc= 0.772 K(o=0.77,f=0) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot -71:sc= 0.454 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.398 -11.767 2.360 1.00 0.00 N ATOM 132 CA GLU A 80 -10.896 -10.577 1.684 1.00 0.00 C ATOM 133 C GLU A 80 -9.884 -9.848 2.562 1.00 0.00 C ATOM 134 O GLU A 80 -8.861 -9.394 2.061 1.00 0.00 O ATOM 135 CB GLU A 80 -12.054 -9.633 1.375 1.00 0.00 C ATOM 136 CG GLU A 80 -13.093 -10.222 0.416 1.00 0.00 C ATOM 137 CD GLU A 80 -14.406 -9.480 0.624 1.00 0.00 C ATOM 138 OE1 GLU A 80 -14.491 -8.285 0.290 1.00 0.00 O ATOM 139 OE2 GLU A 80 -15.336 -10.067 1.224 1.00 0.00 O ATOM 0 HA GLU A 80 -10.410 -10.887 0.759 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.548 -9.361 2.308 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.656 -8.714 0.945 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -12.758 -10.120 -0.616 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -13.224 -11.287 0.605 1.00 0.00 H new ATOM 146 N PHE A 81 -10.148 -9.750 3.870 1.00 0.00 N ATOM 147 CA PHE A 81 -9.247 -9.082 4.799 1.00 0.00 C ATOM 148 C PHE A 81 -7.905 -9.807 4.887 1.00 0.00 C ATOM 149 O PHE A 81 -6.871 -9.150 4.958 1.00 0.00 O ATOM 150 CB PHE A 81 -9.894 -8.970 6.185 1.00 0.00 C ATOM 151 CG PHE A 81 -11.055 -7.999 6.225 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.812 -6.622 6.049 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.374 -8.461 6.412 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.884 -5.716 6.042 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.444 -7.549 6.414 1.00 0.00 C ATOM 156 CZ PHE A 81 -13.197 -6.178 6.223 1.00 0.00 C ATOM 0 H PHE A 81 -10.988 -10.131 4.306 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.058 -8.077 4.421 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.242 -9.955 6.497 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.140 -8.655 6.906 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.801 -6.264 5.920 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.562 -9.515 6.554 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.698 -4.662 5.897 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.454 -7.901 6.562 1.00 0.00 H new ATOM 0 HZ PHE A 81 -14.020 -5.479 6.216 1.00 0.00 H new ATOM 166 N ALA A 82 -7.915 -11.145 4.909 1.00 0.00 N ATOM 167 CA ALA A 82 -6.707 -11.955 4.994 1.00 0.00 C ATOM 168 C ALA A 82 -5.788 -11.640 3.819 1.00 0.00 C ATOM 169 O ALA A 82 -4.606 -11.336 4.005 1.00 0.00 O ATOM 170 CB ALA A 82 -7.087 -13.440 5.012 1.00 0.00 C ATOM 0 H ALA A 82 -8.773 -11.695 4.868 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.173 -11.723 5.915 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.183 -14.046 5.076 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.721 -13.643 5.875 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.627 -13.688 4.098 1.00 0.00 H new ATOM 176 N GLU A 83 -6.360 -11.703 2.619 1.00 0.00 N ATOM 177 CA GLU A 83 -5.698 -11.442 1.359 1.00 0.00 C ATOM 178 C GLU A 83 -5.215 -9.989 1.324 1.00 0.00 C ATOM 179 O GLU A 83 -4.045 -9.726 1.061 1.00 0.00 O ATOM 180 CB GLU A 83 -6.723 -11.739 0.251 1.00 0.00 C ATOM 181 CG GLU A 83 -6.120 -11.660 -1.153 1.00 0.00 C ATOM 182 CD GLU A 83 -4.996 -12.667 -1.376 1.00 0.00 C ATOM 183 OE1 GLU A 83 -5.053 -13.777 -0.809 1.00 0.00 O ATOM 184 OE2 GLU A 83 -4.050 -12.303 -2.110 1.00 0.00 O ATOM 0 H GLU A 83 -7.343 -11.949 2.501 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.817 -12.069 1.220 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.141 -12.734 0.406 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.548 -11.031 0.327 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.905 -11.831 -1.890 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.738 -10.653 -1.322 1.00 0.00 H new ATOM 191 N PHE A 84 -6.093 -9.037 1.642 1.00 0.00 N ATOM 192 CA PHE A 84 -5.809 -7.612 1.666 1.00 0.00 C ATOM 193 C PHE A 84 -4.605 -7.314 2.554 1.00 0.00 C ATOM 194 O PHE A 84 -3.653 -6.678 2.101 1.00 0.00 O ATOM 195 CB PHE A 84 -7.058 -6.861 2.145 1.00 0.00 C ATOM 196 CG PHE A 84 -6.848 -5.384 2.391 1.00 0.00 C ATOM 197 CD1 PHE A 84 -6.311 -4.583 1.370 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.195 -4.808 3.627 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.154 -3.202 1.558 1.00 0.00 C ATOM 200 CE2 PHE A 84 -7.016 -3.429 3.828 1.00 0.00 C ATOM 201 CZ PHE A 84 -6.497 -2.633 2.794 1.00 0.00 C ATOM 0 H PHE A 84 -7.057 -9.251 1.899 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.557 -7.274 0.661 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -7.847 -6.984 1.403 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.413 -7.323 3.067 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -6.017 -5.034 0.434 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.597 -5.423 4.418 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -5.773 -2.583 0.759 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.277 -2.982 4.776 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.361 -1.573 2.952 1.00 0.00 H new ATOM 211 N TYR A 85 -4.621 -7.786 3.805 1.00 0.00 N ATOM 212 CA TYR A 85 -3.522 -7.560 4.729 1.00 0.00 C ATOM 213 C TYR A 85 -2.237 -8.236 4.256 1.00 0.00 C ATOM 214 O TYR A 85 -1.146 -7.745 4.558 1.00 0.00 O ATOM 215 CB TYR A 85 -3.919 -7.968 6.150 1.00 0.00 C ATOM 216 CG TYR A 85 -4.745 -6.910 6.851 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.167 -5.648 7.066 1.00 0.00 C ATOM 218 CD2 TYR A 85 -6.064 -7.157 7.282 1.00 0.00 C ATOM 219 CE1 TYR A 85 -4.898 -4.632 7.693 1.00 0.00 C ATOM 220 CE2 TYR A 85 -6.806 -6.142 7.912 1.00 0.00 C ATOM 221 CZ TYR A 85 -6.223 -4.872 8.120 1.00 0.00 C ATOM 222 OH TYR A 85 -6.929 -3.897 8.754 1.00 0.00 O ATOM 0 H TYR A 85 -5.391 -8.329 4.196 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.307 -6.492 4.750 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.485 -8.899 6.112 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.019 -8.166 6.732 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.153 -5.460 6.746 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.507 -8.130 7.128 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -4.448 -3.663 7.851 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.818 -6.333 8.236 1.00 0.00 H new ATOM 0 HH TYR A 85 -7.415 -3.362 8.092 1.00 0.00 H new ATOM 232 N ASN A 86 -2.330 -9.356 3.535 1.00 0.00 N ATOM 233 CA ASN A 86 -1.160 -10.051 3.010 1.00 0.00 C ATOM 234 C ASN A 86 -0.517 -9.129 1.968 1.00 0.00 C ATOM 235 O ASN A 86 0.674 -8.821 2.061 1.00 0.00 O ATOM 236 CB ASN A 86 -1.550 -11.440 2.449 1.00 0.00 C ATOM 237 CG ASN A 86 -1.346 -12.571 3.457 1.00 0.00 C ATOM 238 OD1 ASN A 86 -0.635 -12.432 4.454 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.005 -13.702 3.310 1.00 0.00 N ATOM 0 H ASN A 86 -3.217 -9.803 3.301 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.431 -10.259 3.794 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.595 -11.420 2.140 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.958 -11.645 1.557 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.920 -14.437 4.012 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.601 -13.843 2.494 1.00 0.00 H new ATOM 246 N ARG A 87 -1.317 -8.618 1.022 1.00 0.00 N ATOM 247 CA ARG A 87 -0.844 -7.713 -0.026 1.00 0.00 C ATOM 248 C ARG A 87 -0.294 -6.419 0.593 1.00 0.00 C ATOM 249 O ARG A 87 0.798 -6.003 0.197 1.00 0.00 O ATOM 250 CB ARG A 87 -1.966 -7.429 -1.052 1.00 0.00 C ATOM 251 CG ARG A 87 -2.555 -8.659 -1.769 1.00 0.00 C ATOM 252 CD ARG A 87 -1.690 -9.264 -2.881 1.00 0.00 C ATOM 253 NE ARG A 87 -2.013 -10.690 -3.048 1.00 0.00 N ATOM 254 CZ ARG A 87 -1.230 -11.683 -3.475 1.00 0.00 C ATOM 255 NH1 ARG A 87 -0.082 -11.456 -4.104 1.00 0.00 N ATOM 256 NH2 ARG A 87 -1.623 -12.925 -3.223 1.00 0.00 N ATOM 0 H ARG A 87 -2.314 -8.824 0.965 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.028 -8.194 -0.565 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.776 -6.910 -0.540 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.576 -6.746 -1.807 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.748 -9.431 -1.025 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.518 -8.380 -2.196 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.861 -8.732 -3.817 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.634 -9.148 -2.636 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.967 -10.956 -2.804 1.00 0.00 H new ATOM 0 HH11 ARG A 87 0.226 -10.499 -4.274 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.492 -12.239 -4.417 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -2.495 -13.092 -2.720 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.054 -13.713 -3.532 1.00 0.00 H new ATOM 270 N LEU A 88 -1.003 -5.794 1.549 1.00 0.00 N ATOM 271 CA LEU A 88 -0.565 -4.563 2.228 1.00 0.00 C ATOM 272 C LEU A 88 0.832 -4.714 2.797 1.00 0.00 C ATOM 273 O LEU A 88 1.709 -3.885 2.539 1.00 0.00 O ATOM 274 CB LEU A 88 -1.465 -4.196 3.430 1.00 0.00 C ATOM 275 CG LEU A 88 -2.644 -3.251 3.183 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.670 -3.423 4.307 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.134 -1.802 3.245 1.00 0.00 C ATOM 0 H LEU A 88 -1.907 -6.134 1.876 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.611 -3.789 1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.861 -5.122 3.846 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.832 -3.748 4.196 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.091 -3.472 2.214 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.512 -2.752 4.137 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.024 -4.454 4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.205 -3.185 5.264 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.963 -1.117 3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.704 -1.609 4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.372 -1.651 2.480 1.00 0.00 H new ATOM 289 N LYS A 89 1.009 -5.760 3.607 1.00 0.00 N ATOM 290 CA LYS A 89 2.261 -6.062 4.270 1.00 0.00 C ATOM 291 C LYS A 89 3.396 -6.103 3.268 1.00 0.00 C ATOM 292 O LYS A 89 4.395 -5.434 3.507 1.00 0.00 O ATOM 293 CB LYS A 89 2.126 -7.352 5.078 1.00 0.00 C ATOM 294 CG LYS A 89 3.373 -7.582 5.940 1.00 0.00 C ATOM 295 CD LYS A 89 3.170 -8.806 6.823 1.00 0.00 C ATOM 296 CE LYS A 89 4.381 -9.030 7.728 1.00 0.00 C ATOM 297 NZ LYS A 89 4.244 -10.315 8.432 1.00 0.00 N ATOM 0 H LYS A 89 0.267 -6.428 3.819 1.00 0.00 H new ATOM 0 HA LYS A 89 2.504 -5.269 4.977 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.242 -7.298 5.714 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.983 -8.196 4.404 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.246 -7.722 5.303 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.567 -6.705 6.557 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.275 -8.677 7.431 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.008 -9.686 6.201 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.296 -9.025 7.135 1.00 0.00 H new ATOM 0 HE3 LYS A 89 4.464 -8.217 8.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 5.070 -10.464 9.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 3.380 -10.304 9.010 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 4.186 -11.087 7.737 1.00 0.00 H new ATOM 311 N GLN A 90 3.248 -6.825 2.155 1.00 0.00 N ATOM 312 CA GLN A 90 4.270 -6.919 1.143 1.00 0.00 C ATOM 313 C GLN A 90 4.721 -5.534 0.681 1.00 0.00 C ATOM 314 O GLN A 90 5.917 -5.305 0.596 1.00 0.00 O ATOM 315 CB GLN A 90 3.654 -7.722 0.002 1.00 0.00 C ATOM 316 CG GLN A 90 4.641 -8.597 -0.744 1.00 0.00 C ATOM 317 CD GLN A 90 5.516 -7.842 -1.751 1.00 0.00 C ATOM 318 OE1 GLN A 90 6.715 -7.680 -1.548 1.00 0.00 O ATOM 319 NE2 GLN A 90 4.959 -7.363 -2.853 1.00 0.00 N ATOM 0 H GLN A 90 2.406 -7.359 1.941 1.00 0.00 H new ATOM 0 HA GLN A 90 5.167 -7.407 1.525 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.859 -8.351 0.403 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.191 -7.033 -0.704 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.287 -9.095 -0.021 1.00 0.00 H new ATOM 0 HG3 GLN A 90 4.092 -9.377 -1.271 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.962 -7.498 -3.021 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.527 -6.859 -3.534 1.00 0.00 H new ATOM 328 N ILE A 91 3.802 -4.599 0.415 1.00 0.00 N ATOM 329 CA ILE A 91 4.163 -3.244 -0.016 1.00 0.00 C ATOM 330 C ILE A 91 4.969 -2.567 1.101 1.00 0.00 C ATOM 331 O ILE A 91 5.966 -1.901 0.820 1.00 0.00 O ATOM 332 CB ILE A 91 2.889 -2.481 -0.444 1.00 0.00 C ATOM 333 CG1 ILE A 91 2.409 -3.075 -1.784 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.091 -0.956 -0.581 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.921 -2.832 -2.029 1.00 0.00 C ATOM 0 H ILE A 91 2.797 -4.758 0.491 1.00 0.00 H new ATOM 0 HA ILE A 91 4.807 -3.257 -0.895 1.00 0.00 H new ATOM 0 HB ILE A 91 2.145 -2.607 0.342 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.985 -2.637 -2.599 1.00 0.00 H new ATOM 0 HG13 ILE A 91 2.606 -4.147 -1.794 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.153 -0.491 -0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.408 -0.543 0.377 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.855 -0.756 -1.333 1.00 0.00 H new ATOM 0 HD11 ILE A 91 0.633 -3.270 -2.985 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.341 -3.293 -1.230 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.726 -1.760 -2.047 1.00 0.00 H new ATOM 347 N LYS A 92 4.572 -2.743 2.368 1.00 0.00 N ATOM 348 CA LYS A 92 5.301 -2.152 3.489 1.00 0.00 C ATOM 349 C LYS A 92 6.731 -2.684 3.494 1.00 0.00 C ATOM 350 O LYS A 92 7.686 -1.911 3.552 1.00 0.00 O ATOM 351 CB LYS A 92 4.617 -2.406 4.850 1.00 0.00 C ATOM 352 CG LYS A 92 3.134 -2.011 4.881 1.00 0.00 C ATOM 353 CD LYS A 92 2.687 -1.411 6.220 1.00 0.00 C ATOM 354 CE LYS A 92 1.423 -0.548 6.036 1.00 0.00 C ATOM 355 NZ LYS A 92 0.326 -0.891 6.962 1.00 0.00 N ATOM 0 H LYS A 92 3.753 -3.288 2.638 1.00 0.00 H new ATOM 0 HA LYS A 92 5.306 -1.071 3.350 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.707 -3.463 5.100 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.148 -1.850 5.622 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.942 -1.290 4.087 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.528 -2.891 4.666 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.487 -2.210 6.934 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.490 -0.804 6.638 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.687 0.500 6.174 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.067 -0.655 5.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.489 -0.271 6.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.046 -1.882 6.817 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.647 -0.762 7.943 1.00 0.00 H new ATOM 1028 N SER B 160 3.693 9.507 -1.701 1.00 0.00 N ATOM 1029 CA SER B 160 4.793 8.554 -1.772 1.00 0.00 C ATOM 1030 C SER B 160 4.362 7.393 -2.682 1.00 0.00 C ATOM 1031 O SER B 160 3.168 7.150 -2.871 1.00 0.00 O ATOM 1032 CB SER B 160 5.144 8.058 -0.361 1.00 0.00 C ATOM 1033 OG SER B 160 4.043 7.387 0.213 1.00 0.00 O ATOM 0 HA SER B 160 5.685 9.023 -2.187 1.00 0.00 H new ATOM 0 HB2 SER B 160 6.002 7.388 -0.407 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.432 8.901 0.267 1.00 0.00 H new ATOM 0 HG SER B 160 4.282 7.076 1.111 1.00 0.00 H new ATOM 1039 N ALA B 161 5.319 6.632 -3.219 1.00 0.00 N ATOM 1040 CA ALA B 161 5.030 5.479 -4.070 1.00 0.00 C ATOM 1041 C ALA B 161 4.284 4.412 -3.252 1.00 0.00 C ATOM 1042 O ALA B 161 3.509 3.628 -3.801 1.00 0.00 O ATOM 1043 CB ALA B 161 6.353 4.913 -4.599 1.00 0.00 C ATOM 0 H ALA B 161 6.315 6.799 -3.075 1.00 0.00 H new ATOM 0 HA ALA B 161 4.402 5.778 -4.909 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.151 4.052 -5.236 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.871 5.678 -5.177 1.00 0.00 H new ATOM 0 HB3 ALA B 161 6.978 4.606 -3.761 1.00 0.00 H new ATOM 1049 N PHE B 162 4.545 4.377 -1.943 1.00 0.00 N ATOM 1050 CA PHE B 162 3.936 3.466 -0.995 1.00 0.00 C ATOM 1051 C PHE B 162 2.458 3.827 -0.891 1.00 0.00 C ATOM 1052 O PHE B 162 1.608 2.986 -1.176 1.00 0.00 O ATOM 1053 CB PHE B 162 4.675 3.607 0.349 1.00 0.00 C ATOM 1054 CG PHE B 162 4.261 2.712 1.514 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.916 2.578 1.915 1.00 0.00 C ATOM 1056 CD2 PHE B 162 5.262 2.107 2.301 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.577 1.827 3.048 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.929 1.417 3.478 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.582 1.277 3.845 1.00 0.00 C ATOM 0 H PHE B 162 5.214 5.011 -1.506 1.00 0.00 H new ATOM 0 HA PHE B 162 4.011 2.424 -1.307 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.735 3.436 0.162 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.572 4.642 0.675 1.00 0.00 H new ATOM 0 HD1 PHE B 162 2.138 3.060 1.342 1.00 0.00 H new ATOM 0 HD2 PHE B 162 6.296 2.175 1.996 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.539 1.674 3.304 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.707 0.996 4.098 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.322 0.742 4.747 1.00 0.00 H new ATOM 1069 N ASP B 163 2.145 5.066 -0.492 1.00 0.00 N ATOM 1070 CA ASP B 163 0.779 5.560 -0.322 1.00 0.00 C ATOM 1071 C ASP B 163 0.003 5.399 -1.625 1.00 0.00 C ATOM 1072 O ASP B 163 -1.160 4.999 -1.618 1.00 0.00 O ATOM 1073 CB ASP B 163 0.778 7.030 0.118 1.00 0.00 C ATOM 1074 CG ASP B 163 1.107 7.288 1.586 1.00 0.00 C ATOM 1075 OD1 ASP B 163 1.714 6.432 2.262 1.00 0.00 O ATOM 1076 OD2 ASP B 163 0.774 8.396 2.070 1.00 0.00 O ATOM 0 H ASP B 163 2.853 5.767 -0.274 1.00 0.00 H new ATOM 0 HA ASP B 163 0.295 4.973 0.458 1.00 0.00 H new ATOM 0 HB2 ASP B 163 1.496 7.573 -0.496 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.205 7.451 -0.093 1.00 0.00 H new ATOM 1081 N LEU B 164 0.659 5.679 -2.754 1.00 0.00 N ATOM 1082 CA LEU B 164 0.067 5.548 -4.073 1.00 0.00 C ATOM 1083 C LEU B 164 -0.395 4.107 -4.282 1.00 0.00 C ATOM 1084 O LEU B 164 -1.516 3.884 -4.750 1.00 0.00 O ATOM 1085 CB LEU B 164 1.100 5.946 -5.139 1.00 0.00 C ATOM 1086 CG LEU B 164 0.635 5.658 -6.576 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.516 6.584 -6.984 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.803 5.808 -7.539 1.00 0.00 C ATOM 0 H LEU B 164 1.625 6.006 -2.770 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.796 6.208 -4.160 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.320 7.009 -5.042 1.00 0.00 H new ATOM 0 HB3 LEU B 164 2.030 5.410 -4.951 1.00 0.00 H new ATOM 0 HG LEU B 164 0.267 4.633 -6.617 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.822 6.356 -8.005 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.360 6.435 -6.310 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.186 7.621 -6.928 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.466 5.602 -8.555 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.191 6.825 -7.484 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.590 5.104 -7.269 1.00 0.00 H new ATOM 1100 N ASP B 165 0.464 3.135 -3.984 1.00 0.00 N ATOM 1101 CA ASP B 165 0.118 1.733 -4.153 1.00 0.00 C ATOM 1102 C ASP B 165 -0.964 1.327 -3.150 1.00 0.00 C ATOM 1103 O ASP B 165 -1.826 0.533 -3.505 1.00 0.00 O ATOM 1104 CB ASP B 165 1.360 0.843 -4.142 1.00 0.00 C ATOM 1105 CG ASP B 165 1.115 -0.540 -4.767 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.118 -0.747 -5.499 1.00 0.00 O ATOM 1107 OD2 ASP B 165 2.017 -1.399 -4.638 1.00 0.00 O ATOM 0 H ASP B 165 1.405 3.297 -3.624 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.318 1.585 -5.141 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.163 1.343 -4.684 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.700 0.716 -3.114 1.00 0.00 H new ATOM 1112 N VAL B 166 -0.994 1.894 -1.932 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.026 1.588 -0.928 1.00 0.00 C ATOM 1114 C VAL B 166 -3.378 1.971 -1.539 1.00 0.00 C ATOM 1115 O VAL B 166 -4.311 1.166 -1.523 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.755 2.315 0.417 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -2.913 2.179 1.429 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.499 1.770 1.108 1.00 0.00 C ATOM 0 H VAL B 166 -0.304 2.576 -1.617 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.018 0.526 -0.682 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.634 3.363 0.141 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.659 2.710 2.346 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.821 2.606 1.003 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.078 1.125 1.653 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.340 2.302 2.046 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.628 0.707 1.311 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.365 1.913 0.459 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.492 3.168 -2.118 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.721 3.639 -2.744 1.00 0.00 C ATOM 1130 C VAL B 167 -5.134 2.675 -3.875 1.00 0.00 C ATOM 1131 O VAL B 167 -6.307 2.309 -3.942 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.534 5.110 -3.180 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.734 5.632 -3.980 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.355 6.071 -1.997 1.00 0.00 C ATOM 0 H VAL B 167 -2.726 3.840 -2.164 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.555 3.635 -2.042 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.631 5.093 -3.790 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.558 6.669 -4.265 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.865 5.026 -4.877 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.634 5.572 -3.367 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.229 7.087 -2.370 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.235 6.027 -1.356 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.474 5.782 -1.424 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.218 2.255 -4.762 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.506 1.337 -5.870 1.00 0.00 C ATOM 1146 C LYS B 168 -4.961 -0.029 -5.354 1.00 0.00 C ATOM 1147 O LYS B 168 -5.982 -0.540 -5.815 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.241 1.168 -6.729 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.157 2.103 -7.944 1.00 0.00 C ATOM 1150 CD LYS B 168 -1.673 2.279 -8.324 1.00 0.00 C ATOM 1151 CE LYS B 168 -1.429 2.946 -9.679 1.00 0.00 C ATOM 1152 NZ LYS B 168 -2.010 2.170 -10.792 1.00 0.00 N ATOM 0 H LYS B 168 -3.242 2.550 -4.727 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.313 1.760 -6.468 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.367 1.334 -6.100 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.191 0.137 -7.078 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -3.716 1.686 -8.782 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.605 3.069 -7.711 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.183 2.871 -7.551 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -1.195 1.299 -8.327 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -1.859 3.947 -9.672 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -0.357 3.061 -9.838 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -1.667 2.551 -11.697 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -1.726 1.173 -10.706 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -3.047 2.238 -10.759 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.210 -0.618 -4.422 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.490 -1.920 -3.823 1.00 0.00 C ATOM 1168 C LEU B 169 -5.896 -1.892 -3.232 1.00 0.00 C ATOM 1169 O LEU B 169 -6.717 -2.762 -3.533 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.443 -2.206 -2.732 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.245 -3.677 -2.305 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -2.604 -3.686 -0.916 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -4.480 -4.558 -2.219 1.00 0.00 C ATOM 0 H LEU B 169 -3.363 -0.186 -4.053 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.436 -2.710 -4.572 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.483 -1.824 -3.078 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.714 -1.632 -1.846 1.00 0.00 H new ATOM 0 HG LEU B 169 -2.639 -4.103 -3.104 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.454 -4.716 -0.591 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -1.643 -3.174 -0.956 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.258 -3.175 -0.210 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.190 -5.562 -1.908 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.175 -4.140 -1.491 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -4.962 -4.606 -3.196 1.00 0.00 H new ATOM 1185 N THR B 170 -6.186 -0.893 -2.397 1.00 0.00 N ATOM 1186 CA THR B 170 -7.489 -0.747 -1.779 1.00 0.00 C ATOM 1187 C THR B 170 -8.560 -0.637 -2.867 1.00 0.00 C ATOM 1188 O THR B 170 -9.530 -1.393 -2.833 1.00 0.00 O ATOM 1189 CB THR B 170 -7.476 0.426 -0.789 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.488 0.214 0.207 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.794 0.538 -0.029 1.00 0.00 C ATOM 0 H THR B 170 -5.519 -0.167 -2.135 1.00 0.00 H new ATOM 0 HA THR B 170 -7.738 -1.629 -1.189 1.00 0.00 H new ATOM 0 HB THR B 170 -7.288 1.322 -1.381 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.612 0.486 -0.138 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.745 1.380 0.662 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.609 0.695 -0.735 1.00 0.00 H new ATOM 0 HG23 THR B 170 -8.971 -0.381 0.531 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.362 0.246 -3.854 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.305 0.476 -4.948 1.00 0.00 C ATOM 1201 C ALA B 171 -9.633 -0.795 -5.740 1.00 0.00 C ATOM 1202 O ALA B 171 -10.739 -0.929 -6.264 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.783 1.578 -5.876 1.00 0.00 C ATOM 0 H ALA B 171 -7.527 0.829 -3.913 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.241 0.800 -4.494 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.495 1.739 -6.686 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.661 2.502 -5.311 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -7.821 1.278 -6.292 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.706 -1.746 -5.812 1.00 0.00 N ATOM 1210 CA GLN B 172 -8.915 -2.993 -6.522 1.00 0.00 C ATOM 1211 C GLN B 172 -9.901 -3.915 -5.802 1.00 0.00 C ATOM 1212 O GLN B 172 -10.892 -4.337 -6.399 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.576 -3.715 -6.699 1.00 0.00 C ATOM 1214 CG GLN B 172 -6.867 -3.304 -7.989 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.978 -4.440 -8.458 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -4.771 -4.449 -8.230 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -6.566 -5.441 -9.083 1.00 0.00 N ATOM 0 H GLN B 172 -7.787 -1.668 -5.376 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.345 -2.747 -7.493 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -6.932 -3.498 -5.847 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.743 -4.792 -6.705 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.600 -3.060 -8.758 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.271 -2.407 -7.820 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -7.570 -5.412 -9.261 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -6.017 -6.245 -9.388 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.642 -4.260 -4.537 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.523 -5.167 -3.803 1.00 0.00 C ATOM 1228 C PHE B 173 -11.913 -4.581 -3.568 1.00 0.00 C ATOM 1229 O PHE B 173 -12.896 -5.316 -3.701 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.874 -5.616 -2.499 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.747 -6.629 -2.669 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.492 -6.293 -3.234 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.983 -7.959 -2.275 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.500 -7.277 -3.385 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.999 -8.943 -2.450 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.756 -8.605 -3.010 1.00 0.00 C ATOM 0 H PHE B 173 -8.837 -3.928 -4.006 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.669 -6.046 -4.431 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.483 -4.740 -1.982 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.641 -6.049 -1.857 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.297 -5.279 -3.549 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.932 -8.225 -1.833 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.536 -7.010 -3.792 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -8.197 -9.962 -2.154 1.00 0.00 H new ATOM 0 HZ PHE B 173 -6.001 -9.364 -3.151 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.014 -3.281 -3.261 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.315 -2.641 -3.040 1.00 0.00 C ATOM 1248 C VAL B 174 -14.173 -2.751 -4.306 1.00 0.00 C ATOM 1249 O VAL B 174 -15.392 -2.749 -4.203 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.160 -1.175 -2.588 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.416 -1.061 -1.250 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.483 -0.314 -3.635 1.00 0.00 C ATOM 0 H VAL B 174 -11.214 -2.656 -3.161 1.00 0.00 H new ATOM 0 HA VAL B 174 -13.822 -3.166 -2.230 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.174 -0.799 -2.451 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.330 -0.011 -0.970 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -12.969 -1.598 -0.479 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.420 -1.493 -1.349 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.399 0.708 -3.266 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.488 -0.708 -3.842 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.074 -0.322 -4.551 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.551 -2.843 -5.484 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.255 -2.985 -6.744 1.00 0.00 C ATOM 1264 C ALA B 175 -14.649 -4.448 -6.960 1.00 0.00 C ATOM 1265 O ALA B 175 -15.804 -4.742 -7.251 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.359 -2.511 -7.889 1.00 0.00 C ATOM 0 H ALA B 175 -12.536 -2.820 -5.582 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.159 -2.376 -6.721 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.890 -2.619 -8.835 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.097 -1.464 -7.737 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.450 -3.112 -7.913 1.00 0.00 H new ATOM 1272 N ARG B 176 -13.689 -5.373 -6.818 1.00 0.00 N ATOM 1273 CA ARG B 176 -13.900 -6.807 -7.004 1.00 0.00 C ATOM 1274 C ARG B 176 -15.086 -7.299 -6.192 1.00 0.00 C ATOM 1275 O ARG B 176 -16.019 -7.884 -6.745 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.649 -7.595 -6.594 1.00 0.00 C ATOM 1277 CG ARG B 176 -11.536 -7.497 -7.635 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.285 -8.238 -7.152 1.00 0.00 C ATOM 1279 NE ARG B 176 -9.822 -9.206 -8.155 1.00 0.00 N ATOM 1280 CZ ARG B 176 -8.964 -10.213 -7.973 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -8.534 -10.542 -6.759 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -8.543 -10.874 -9.043 1.00 0.00 N ATOM 0 H ARG B 176 -12.729 -5.137 -6.566 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.104 -6.971 -8.062 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -12.283 -7.220 -5.638 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -12.914 -8.642 -6.446 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -11.875 -7.921 -8.580 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -11.296 -6.450 -7.823 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -9.492 -7.520 -6.942 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -10.503 -8.755 -6.217 1.00 0.00 H new ATOM 0 HE ARG B 176 -10.198 -9.097 -9.097 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -8.860 -10.022 -5.944 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -7.879 -11.315 -6.642 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -8.875 -10.608 -9.970 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -7.887 -11.648 -8.939 1.00 0.00 H new ATOM 1296 N ASN B 177 -15.032 -7.084 -4.881 1.00 0.00 N ATOM 1297 CA ASN B 177 -16.069 -7.506 -3.961 1.00 0.00 C ATOM 1298 C ASN B 177 -17.220 -6.521 -4.039 1.00 0.00 C ATOM 1299 O ASN B 177 -18.344 -6.926 -4.339 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.476 -7.679 -2.562 1.00 0.00 C ATOM 1301 CG ASN B 177 -14.457 -8.811 -2.621 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.805 -9.986 -2.638 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -13.179 -8.507 -2.772 1.00 0.00 N ATOM 0 H ASN B 177 -14.254 -6.605 -4.427 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.475 -8.481 -4.230 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -15.001 -6.755 -2.232 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -16.260 -7.909 -1.841 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -12.490 -9.248 -2.902 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.882 -7.531 -2.759 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.960 -5.234 -3.828 1.00 0.00 N ATOM 1311 CA GLY B 178 -17.964 -4.185 -3.890 1.00 0.00 C ATOM 1312 C GLY B 178 -17.837 -3.216 -2.723 1.00 0.00 C ATOM 1313 O GLY B 178 -17.182 -3.505 -1.714 1.00 0.00 O ATOM 0 H GLY B 178 -16.027 -4.888 -3.605 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -17.864 -3.640 -4.829 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -18.958 -4.632 -3.886 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.547 -2.088 -2.827 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.572 -1.014 -1.831 1.00 0.00 C ATOM 1319 C ARG B 179 -18.850 -1.521 -0.427 1.00 0.00 C ATOM 1320 O ARG B 179 -18.408 -0.894 0.530 1.00 0.00 O ATOM 1321 CB ARG B 179 -19.628 0.027 -2.234 1.00 0.00 C ATOM 1322 CG ARG B 179 -19.784 1.195 -1.240 1.00 0.00 C ATOM 1323 CD ARG B 179 -20.859 0.998 -0.163 1.00 0.00 C ATOM 1324 NE ARG B 179 -22.208 0.924 -0.750 1.00 0.00 N ATOM 1325 CZ ARG B 179 -23.124 1.894 -0.815 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -22.889 3.112 -0.340 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -24.294 1.628 -1.376 1.00 0.00 N ATOM 0 H ARG B 179 -19.139 -1.892 -3.634 1.00 0.00 H new ATOM 0 HA ARG B 179 -17.581 -0.561 -1.811 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -19.367 0.431 -3.212 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -20.591 -0.473 -2.342 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -18.826 1.362 -0.748 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.016 2.100 -1.801 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -20.653 0.084 0.394 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -20.816 1.822 0.549 1.00 0.00 H new ATOM 0 HE ARG B 179 -22.474 0.026 -1.155 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -21.989 3.327 0.089 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -23.609 3.832 -0.404 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -24.481 0.697 -1.748 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -25.008 2.354 -1.436 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.577 -2.624 -0.270 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.873 -3.157 1.044 1.00 0.00 C ATOM 1343 C GLN B 180 -18.583 -3.355 1.848 1.00 0.00 C ATOM 1344 O GLN B 180 -18.531 -2.960 3.012 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.670 -4.453 0.865 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.993 -5.222 2.150 1.00 0.00 C ATOM 1347 CD GLN B 180 -22.162 -6.163 1.887 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -23.317 -5.811 2.115 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -21.922 -7.350 1.374 1.00 0.00 N ATOM 0 H GLN B 180 -19.970 -3.162 -1.042 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.479 -2.457 1.620 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.607 -4.214 0.362 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -20.111 -5.112 0.201 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -20.121 -5.788 2.479 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -21.243 -4.527 2.952 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -20.962 -7.640 1.186 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -22.696 -7.981 1.164 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.549 -3.948 1.242 1.00 0.00 N ATOM 1359 CA PHE B 181 -16.261 -4.175 1.892 1.00 0.00 C ATOM 1360 C PHE B 181 -15.615 -2.832 2.243 1.00 0.00 C ATOM 1361 O PHE B 181 -14.989 -2.704 3.293 1.00 0.00 O ATOM 1362 CB PHE B 181 -15.362 -4.986 0.956 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.950 -5.171 1.469 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -13.652 -6.165 2.420 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -12.910 -4.389 0.938 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -12.324 -6.400 2.812 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.585 -4.644 1.312 1.00 0.00 C ATOM 1368 CZ PHE B 181 -11.283 -5.642 2.252 1.00 0.00 C ATOM 0 H PHE B 181 -17.586 -4.285 0.280 1.00 0.00 H new ATOM 0 HA PHE B 181 -16.403 -4.736 2.816 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.811 -5.966 0.796 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -15.324 -4.491 -0.014 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -14.450 -6.751 2.851 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -13.132 -3.593 0.243 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -12.104 -7.163 3.544 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -10.786 -4.066 0.872 1.00 0.00 H new ATOM 0 HZ PHE B 181 -10.259 -5.825 2.542 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.767 -1.836 1.361 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.241 -0.488 1.547 1.00 0.00 C ATOM 1380 C LEU B 182 -15.792 0.043 2.870 1.00 0.00 C ATOM 1381 O LEU B 182 -15.030 0.483 3.725 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.661 0.409 0.365 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.706 1.570 0.067 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.258 2.353 -1.129 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.485 2.502 1.256 1.00 0.00 C ATOM 0 H LEU B 182 -16.270 -1.953 0.482 1.00 0.00 H new ATOM 0 HA LEU B 182 -14.151 -0.494 1.578 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.749 -0.209 -0.528 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.651 0.815 0.570 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.728 1.146 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.592 3.185 -1.358 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.327 1.694 -1.995 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.249 2.737 -0.886 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -13.798 3.299 0.971 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.438 2.935 1.561 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.061 1.938 2.087 1.00 0.00 H new ATOM 1397 N THR B 183 -17.110 -0.042 3.071 1.00 0.00 N ATOM 1398 CA THR B 183 -17.732 0.421 4.302 1.00 0.00 C ATOM 1399 C THR B 183 -17.145 -0.316 5.513 1.00 0.00 C ATOM 1400 O THR B 183 -16.852 0.330 6.522 1.00 0.00 O ATOM 1401 CB THR B 183 -19.250 0.238 4.220 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.758 0.923 3.085 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.921 0.822 5.465 1.00 0.00 C ATOM 0 H THR B 183 -17.764 -0.430 2.391 1.00 0.00 H new ATOM 0 HA THR B 183 -17.522 1.483 4.430 1.00 0.00 H new ATOM 0 HB THR B 183 -19.462 -0.829 4.147 1.00 0.00 H new ATOM 0 HG1 THR B 183 -20.729 0.801 3.037 1.00 0.00 H new ATOM 0 HG21 THR B 183 -21.000 0.686 5.395 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.548 0.311 6.353 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.694 1.886 5.536 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.961 -1.642 5.432 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.397 -2.405 6.544 1.00 0.00 C ATOM 1413 C GLN B 184 -15.014 -1.852 6.909 1.00 0.00 C ATOM 1414 O GLN B 184 -14.698 -1.760 8.098 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.330 -3.904 6.224 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.701 -4.516 5.920 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.746 -6.008 6.236 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -17.767 -6.411 7.392 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.761 -6.867 5.233 1.00 0.00 N ATOM 0 H GLN B 184 -17.194 -2.201 4.611 1.00 0.00 H new ATOM 0 HA GLN B 184 -17.056 -2.294 7.405 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.673 -4.058 5.368 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.883 -4.430 7.068 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.465 -4.000 6.501 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.942 -4.361 4.868 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -17.743 -6.528 4.271 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.790 -7.869 5.420 1.00 0.00 H new ATOM 1428 N LEU B 185 -14.206 -1.474 5.909 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.878 -0.903 6.108 1.00 0.00 C ATOM 1430 C LEU B 185 -12.997 0.473 6.752 1.00 0.00 C ATOM 1431 O LEU B 185 -12.284 0.753 7.717 1.00 0.00 O ATOM 1432 CB LEU B 185 -12.092 -0.785 4.794 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.305 -2.053 4.441 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.689 -1.864 3.060 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -10.155 -2.339 5.417 1.00 0.00 C ATOM 0 H LEU B 185 -14.466 -1.560 4.926 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.330 -1.580 6.763 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.785 -0.559 3.984 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.401 0.055 4.866 1.00 0.00 H new ATOM 0 HG LEU B 185 -12.004 -2.888 4.485 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -10.124 -2.756 2.789 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.480 -1.699 2.328 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -10.022 -1.002 3.074 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.637 -3.249 5.113 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.455 -1.503 5.409 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.555 -2.468 6.423 1.00 0.00 H new ATOM 1447 N MET B 186 -13.893 1.325 6.235 1.00 0.00 N ATOM 1448 CA MET B 186 -14.110 2.666 6.764 1.00 0.00 C ATOM 1449 C MET B 186 -14.448 2.578 8.244 1.00 0.00 C ATOM 1450 O MET B 186 -13.962 3.395 9.022 1.00 0.00 O ATOM 1451 CB MET B 186 -15.248 3.401 6.032 1.00 0.00 C ATOM 1452 CG MET B 186 -14.882 3.765 4.595 1.00 0.00 C ATOM 1453 SD MET B 186 -16.165 4.700 3.716 1.00 0.00 S ATOM 1454 CE MET B 186 -15.678 6.375 4.203 1.00 0.00 C ATOM 0 H MET B 186 -14.486 1.097 5.437 1.00 0.00 H new ATOM 0 HA MET B 186 -13.191 3.232 6.611 1.00 0.00 H new ATOM 0 HB2 MET B 186 -16.138 2.772 6.028 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.501 4.309 6.580 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.963 4.350 4.603 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.672 2.849 4.042 1.00 0.00 H new ATOM 0 HE1 MET B 186 -16.338 7.099 3.725 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.753 6.475 5.286 1.00 0.00 H new ATOM 0 HE3 MET B 186 -14.650 6.560 3.892 1.00 0.00 H new ATOM 1464 N GLN B 187 -15.263 1.594 8.631 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.675 1.398 10.001 1.00 0.00 C ATOM 1466 C GLN B 187 -14.523 0.915 10.874 1.00 0.00 C ATOM 1467 O GLN B 187 -14.214 1.569 11.873 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.857 0.406 10.048 1.00 0.00 C ATOM 1469 CG GLN B 187 -18.197 1.040 9.645 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.475 2.311 10.444 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -18.507 2.295 11.675 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.571 3.445 9.768 1.00 0.00 N ATOM 0 H GLN B 187 -15.654 0.908 7.985 1.00 0.00 H new ATOM 0 HA GLN B 187 -15.996 2.358 10.404 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.645 -0.433 9.385 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -16.943 0.001 11.056 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -18.185 1.273 8.580 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -19.003 0.324 9.806 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.542 3.435 8.748 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.674 4.329 10.267 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.882 -0.203 10.528 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.800 -0.757 11.341 1.00 0.00 C ATOM 1483 C LYS B 188 -11.571 0.136 11.474 1.00 0.00 C ATOM 1484 O LYS B 188 -10.938 0.089 12.528 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.474 -2.182 10.882 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.729 -2.286 9.555 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.581 -3.746 9.092 1.00 0.00 C ATOM 1488 CE LYS B 188 -10.111 -4.165 8.944 1.00 0.00 C ATOM 1489 NZ LYS B 188 -9.352 -4.092 10.214 1.00 0.00 N ATOM 0 H LYS B 188 -14.095 -0.743 9.689 1.00 0.00 H new ATOM 0 HA LYS B 188 -13.171 -0.803 12.365 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.876 -2.667 11.654 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.406 -2.742 10.801 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.262 -1.716 8.794 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -10.742 -1.836 9.657 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -12.073 -4.404 9.808 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -12.091 -3.876 8.137 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -10.067 -5.184 8.560 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -9.630 -3.525 8.204 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -8.350 -4.305 10.032 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -9.436 -3.136 10.614 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -9.736 -4.784 10.888 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.253 0.987 10.496 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.080 1.862 10.574 1.00 0.00 C ATOM 1505 C GLU B 189 -10.433 3.347 10.685 1.00 0.00 C ATOM 1506 O GLU B 189 -9.540 4.175 10.552 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.096 1.582 9.422 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.558 0.145 9.362 1.00 0.00 C ATOM 1509 CD GLU B 189 -8.181 -0.448 10.729 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.474 0.221 11.525 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -8.600 -1.593 11.017 1.00 0.00 O ATOM 0 H GLU B 189 -11.794 1.089 9.637 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.576 1.616 11.509 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -9.592 1.808 8.478 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.252 2.266 9.511 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.310 -0.493 8.898 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -7.680 0.125 8.716 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.681 3.705 11.018 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.163 5.088 11.145 1.00 0.00 C ATOM 1520 C GLN B 190 -11.214 6.045 11.887 1.00 0.00 C ATOM 1521 O GLN B 190 -11.125 7.226 11.540 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.574 5.100 11.781 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.622 4.685 13.266 1.00 0.00 C ATOM 1524 CD GLN B 190 -15.043 4.455 13.790 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -15.471 5.049 14.778 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -15.785 3.536 13.206 1.00 0.00 N ATOM 0 H GLN B 190 -12.408 3.016 11.213 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.205 5.480 10.129 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -13.991 6.103 11.686 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.219 4.431 11.211 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -13.042 3.772 13.399 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.142 5.458 13.867 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.433 3.041 12.386 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -16.711 3.319 13.574 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.510 5.556 12.915 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.591 6.368 13.707 1.00 0.00 C ATOM 1537 C ARG B 191 -8.215 6.551 13.061 1.00 0.00 C ATOM 1538 O ARG B 191 -7.524 7.502 13.421 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.390 5.743 15.103 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.694 5.374 15.832 1.00 0.00 C ATOM 1541 CD ARG B 191 -10.458 5.027 17.309 1.00 0.00 C ATOM 1542 NE ARG B 191 -10.231 6.236 18.113 1.00 0.00 N ATOM 1543 CZ ARG B 191 -9.315 6.465 19.060 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -8.453 5.538 19.462 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -9.283 7.670 19.615 1.00 0.00 N ATOM 0 H ARG B 191 -10.565 4.584 13.218 1.00 0.00 H new ATOM 0 HA ARG B 191 -10.057 7.351 13.776 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -8.780 4.846 15.001 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -8.828 6.442 15.722 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -11.394 6.207 15.764 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.160 4.525 15.332 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -11.319 4.485 17.699 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -9.598 4.363 17.396 1.00 0.00 H new ATOM 0 HE ARG B 191 -10.864 7.013 17.921 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -8.473 4.607 19.045 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -7.771 5.757 20.188 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -9.944 8.387 19.316 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -8.597 7.879 20.340 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.761 5.638 12.196 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.445 5.719 11.567 1.00 0.00 C ATOM 1561 C ASN B 192 -6.385 6.776 10.470 1.00 0.00 C ATOM 1562 O ASN B 192 -7.113 6.694 9.481 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.002 4.356 10.994 1.00 0.00 C ATOM 1564 CG ASN B 192 -4.537 4.396 10.542 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -3.849 5.398 10.689 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.020 3.317 9.991 1.00 0.00 N ATOM 0 H ASN B 192 -8.301 4.820 11.913 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.756 6.013 12.359 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.131 3.581 11.750 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -6.639 4.088 10.151 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.046 3.316 9.687 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -4.593 2.482 9.869 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.499 7.758 10.637 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.289 8.823 9.670 1.00 0.00 C ATOM 1575 C TYR B 193 -4.833 8.252 8.319 1.00 0.00 C ATOM 1576 O TYR B 193 -5.100 8.870 7.297 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.277 9.846 10.214 1.00 0.00 C ATOM 1578 CG TYR B 193 -2.892 9.282 10.482 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -1.954 9.184 9.435 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.550 8.816 11.767 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.705 8.578 9.657 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.302 8.209 11.995 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.381 8.068 10.933 1.00 0.00 C ATOM 1584 OH TYR B 193 0.825 7.467 11.128 1.00 0.00 O ATOM 0 H TYR B 193 -4.902 7.832 11.460 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.236 9.337 9.507 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.190 10.666 9.501 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -4.669 10.268 11.139 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.196 9.576 8.458 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -3.250 8.926 12.582 1.00 0.00 H new ATOM 0 HE1 TYR B 193 0.008 8.502 8.850 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -1.048 7.851 12.982 1.00 0.00 H new ATOM 0 HH TYR B 193 0.896 7.171 12.059 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.192 7.078 8.263 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.743 6.488 7.000 1.00 0.00 C ATOM 1596 C GLN B 194 -4.930 6.062 6.123 1.00 0.00 C ATOM 1597 O GLN B 194 -4.779 5.892 4.918 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.814 5.296 7.295 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.679 5.128 6.282 1.00 0.00 C ATOM 1600 CD GLN B 194 -2.093 4.297 5.070 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -2.414 3.111 5.198 1.00 0.00 O ATOM 1602 NE2 GLN B 194 -2.112 4.863 3.877 1.00 0.00 N ATOM 0 H GLN B 194 -3.972 6.516 9.085 1.00 0.00 H new ATOM 0 HA GLN B 194 -3.190 7.241 6.439 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.385 5.420 8.289 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.407 4.382 7.316 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -1.347 6.111 5.948 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.828 4.653 6.770 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -1.847 5.842 3.773 1.00 0.00 H new ATOM 0 HE22 GLN B 194 -2.392 4.321 3.060 1.00 0.00 H new ATOM 1611 N PHE B 195 -6.108 5.850 6.710 1.00 0.00 N ATOM 1612 CA PHE B 195 -7.332 5.452 6.021 1.00 0.00 C ATOM 1613 C PHE B 195 -8.231 6.682 5.778 1.00 0.00 C ATOM 1614 O PHE B 195 -9.385 6.533 5.371 1.00 0.00 O ATOM 1615 CB PHE B 195 -8.030 4.353 6.855 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.389 2.978 6.719 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -6.118 2.710 7.262 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -8.043 1.972 5.985 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -5.486 1.476 7.020 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -7.403 0.748 5.728 1.00 0.00 C ATOM 1621 CZ PHE B 195 -6.117 0.501 6.228 1.00 0.00 C ATOM 0 H PHE B 195 -6.239 5.955 7.716 1.00 0.00 H new ATOM 0 HA PHE B 195 -7.107 5.039 5.038 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -8.021 4.646 7.905 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -9.075 4.288 6.551 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -5.625 3.456 7.868 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -9.044 2.142 5.616 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -4.513 1.277 7.444 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -7.905 -0.007 5.142 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.616 -0.430 6.007 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.748 7.906 6.031 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.525 9.134 5.837 1.00 0.00 C ATOM 1633 C ASP B 196 -8.849 9.417 4.372 1.00 0.00 C ATOM 1634 O ASP B 196 -9.875 10.052 4.116 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.897 10.350 6.533 1.00 0.00 C ATOM 1636 CG ASP B 196 -6.695 10.998 5.851 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -6.101 10.411 4.925 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -6.339 12.112 6.306 1.00 0.00 O ATOM 0 H ASP B 196 -6.803 8.071 6.377 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.480 8.950 6.328 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -8.670 11.110 6.649 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.594 10.047 7.535 1.00 0.00 H new ATOM 1643 N PHE B 197 -8.078 8.888 3.413 1.00 0.00 N ATOM 1644 CA PHE B 197 -8.355 9.121 1.999 1.00 0.00 C ATOM 1645 C PHE B 197 -9.662 8.462 1.556 1.00 0.00 C ATOM 1646 O PHE B 197 -10.218 8.837 0.522 1.00 0.00 O ATOM 1647 CB PHE B 197 -7.176 8.750 1.095 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.906 7.271 0.961 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.685 6.489 0.083 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -5.879 6.676 1.712 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.470 5.105 -0.003 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -5.652 5.296 1.607 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.463 4.511 0.770 1.00 0.00 C ATOM 0 H PHE B 197 -7.264 8.300 3.594 1.00 0.00 H new ATOM 0 HA PHE B 197 -8.491 10.196 1.884 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -7.358 9.161 0.102 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -6.278 9.233 1.480 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.447 6.956 -0.523 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.267 7.278 2.367 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.077 4.501 -0.661 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -4.853 4.836 2.170 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.309 3.443 0.722 1.00 0.00 H new ATOM 1663 N LEU B 198 -10.163 7.487 2.324 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.421 6.817 2.024 1.00 0.00 C ATOM 1665 C LEU B 198 -12.587 7.790 2.189 1.00 0.00 C ATOM 1666 O LEU B 198 -13.682 7.495 1.710 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.650 5.616 2.955 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.601 4.502 2.821 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.925 3.389 3.826 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.565 3.926 1.401 1.00 0.00 C ATOM 0 H LEU B 198 -9.704 7.145 3.168 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.367 6.464 0.994 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.659 5.968 3.987 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.636 5.197 2.752 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.619 4.926 3.029 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.185 2.593 3.738 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.904 3.795 4.838 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.917 2.987 3.617 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -9.811 3.141 1.346 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.541 3.510 1.152 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.317 4.717 0.694 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.401 8.905 2.897 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.432 9.906 3.110 1.00 0.00 C ATOM 1684 C ARG B 199 -13.206 10.980 2.041 1.00 0.00 C ATOM 1685 O ARG B 199 -12.058 11.316 1.749 1.00 0.00 O ATOM 1686 CB ARG B 199 -13.339 10.448 4.551 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.409 9.313 5.598 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.431 9.799 7.053 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.698 10.473 7.382 1.00 0.00 N ATOM 1690 CZ ARG B 199 -14.907 11.787 7.515 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -13.899 12.643 7.607 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -16.156 12.228 7.531 1.00 0.00 N ATOM 0 H ARG B 199 -11.513 9.136 3.343 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.441 9.506 3.011 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -12.406 10.998 4.673 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -14.150 11.155 4.726 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.303 8.717 5.412 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.552 8.654 5.460 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -13.285 8.951 7.722 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -12.600 10.484 7.221 1.00 0.00 H new ATOM 0 HE ARG B 199 -15.508 9.869 7.525 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -12.938 12.304 7.577 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -14.085 13.641 7.708 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -16.930 11.570 7.443 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -16.343 13.226 7.631 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.266 11.575 1.473 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.154 12.603 0.437 1.00 0.00 C ATOM 1708 C PRO B 200 -13.410 13.860 0.877 1.00 0.00 C ATOM 1709 O PRO B 200 -13.037 14.676 0.032 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.575 12.907 -0.015 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.385 12.521 1.214 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.664 11.286 1.726 1.00 0.00 C ATOM 0 HA PRO B 200 -13.542 12.226 -0.382 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.705 13.957 -0.276 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.859 12.323 -0.891 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.396 13.319 1.957 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.423 12.306 0.962 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.854 11.123 2.787 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.988 10.387 1.202 1.00 0.00 H new ATOM 1720 N GLN B 201 -13.172 14.018 2.179 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.440 15.137 2.751 1.00 0.00 C ATOM 1722 C GLN B 201 -10.953 15.112 2.356 1.00 0.00 C ATOM 1723 O GLN B 201 -10.170 15.914 2.866 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.585 15.148 4.279 1.00 0.00 C ATOM 1725 CG GLN B 201 -13.989 15.560 4.732 1.00 0.00 C ATOM 1726 CD GLN B 201 -13.955 16.035 6.177 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -14.378 15.334 7.094 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -13.414 17.217 6.413 1.00 0.00 N ATOM 0 H GLN B 201 -13.494 13.351 2.880 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.873 16.051 2.345 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -12.357 14.156 4.669 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -11.853 15.834 4.705 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -14.368 16.354 4.089 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -14.673 14.717 4.634 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -13.069 17.784 5.638 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -13.342 17.563 7.370 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.522 14.176 1.512 1.00 0.00 N ATOM 1738 CA HIS B 202 -9.160 14.039 1.048 1.00 0.00 C ATOM 1739 C HIS B 202 -9.201 14.122 -0.472 1.00 0.00 C ATOM 1740 O HIS B 202 -9.995 13.416 -1.094 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.620 12.685 1.519 1.00 0.00 C ATOM 1742 CG HIS B 202 -7.151 12.717 1.831 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -6.117 12.650 0.926 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.612 12.816 3.084 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -4.974 12.734 1.624 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -5.223 12.889 2.930 1.00 0.00 N ATOM 0 H HIS B 202 -11.145 13.468 1.122 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.506 14.818 1.440 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -9.168 12.370 2.407 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.806 11.937 0.748 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -7.156 12.834 4.017 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -3.986 12.683 1.190 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.535 13.032 3.669 1.00 0.00 H new ATOM 1754 N SER B 203 -8.325 14.922 -1.083 1.00 0.00 N ATOM 1755 CA SER B 203 -8.261 15.079 -2.539 1.00 0.00 C ATOM 1756 C SER B 203 -8.117 13.713 -3.227 1.00 0.00 C ATOM 1757 O SER B 203 -8.763 13.439 -4.242 1.00 0.00 O ATOM 1758 CB SER B 203 -7.111 16.047 -2.846 1.00 0.00 C ATOM 1759 OG SER B 203 -6.940 16.332 -4.218 1.00 0.00 O ATOM 0 H SER B 203 -7.637 15.482 -0.580 1.00 0.00 H new ATOM 0 HA SER B 203 -9.184 15.501 -2.938 1.00 0.00 H new ATOM 0 HB2 SER B 203 -7.286 16.981 -2.312 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.184 15.626 -2.456 1.00 0.00 H new ATOM 0 HG SER B 203 -6.192 16.955 -4.332 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.345 12.812 -2.603 1.00 0.00 N ATOM 1766 CA LEU B 204 -7.097 11.461 -3.093 1.00 0.00 C ATOM 1767 C LEU B 204 -8.390 10.683 -3.316 1.00 0.00 C ATOM 1768 O LEU B 204 -8.375 9.774 -4.138 1.00 0.00 O ATOM 1769 CB LEU B 204 -6.184 10.674 -2.135 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.729 11.163 -2.066 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.964 10.365 -1.004 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -4.013 11.045 -3.417 1.00 0.00 C ATOM 0 H LEU B 204 -6.868 13.013 -1.724 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.594 11.573 -4.054 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.612 10.717 -1.134 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.184 9.627 -2.437 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.751 12.219 -1.797 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.933 10.715 -0.959 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.438 10.505 -0.032 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.977 9.307 -1.265 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.988 11.403 -3.318 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -4.005 10.002 -3.734 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.537 11.646 -4.160 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.495 11.014 -2.639 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.768 10.327 -2.816 1.00 0.00 C ATOM 1786 C PHE B 205 -11.170 10.365 -4.286 1.00 0.00 C ATOM 1787 O PHE B 205 -11.609 9.352 -4.821 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.861 10.985 -1.965 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.224 10.317 -2.070 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -14.109 10.636 -3.123 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.631 9.401 -1.087 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -15.370 10.021 -3.207 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -14.907 8.814 -1.150 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.774 9.112 -2.215 1.00 0.00 C ATOM 0 H PHE B 205 -9.526 11.768 -1.953 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.653 9.292 -2.494 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.546 10.979 -0.922 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.957 12.029 -2.262 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -13.815 11.358 -3.870 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -12.961 9.146 -0.279 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -16.028 10.247 -4.033 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.223 8.130 -0.376 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.746 8.645 -2.271 1.00 0.00 H new ATOM 1804 N ASN B 206 -11.029 11.520 -4.949 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.381 11.693 -6.356 1.00 0.00 C ATOM 1806 C ASN B 206 -10.543 10.775 -7.238 1.00 0.00 C ATOM 1807 O ASN B 206 -11.055 10.229 -8.210 1.00 0.00 O ATOM 1808 CB ASN B 206 -11.163 13.152 -6.788 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.205 14.151 -6.297 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.199 15.305 -6.723 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -13.096 13.774 -5.393 1.00 0.00 N ATOM 0 H ASN B 206 -10.663 12.367 -4.515 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.434 11.435 -6.473 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -10.183 13.474 -6.434 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -11.136 13.189 -7.877 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.784 14.442 -5.045 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -13.095 12.815 -5.045 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.259 10.621 -6.920 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.330 9.772 -7.654 1.00 0.00 C ATOM 1820 C TYR B 207 -8.516 8.285 -7.293 1.00 0.00 C ATOM 1821 O TYR B 207 -8.162 7.409 -8.075 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.913 10.274 -7.350 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.819 9.457 -7.995 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.459 9.678 -9.336 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -5.203 8.430 -7.261 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.486 8.869 -9.944 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.236 7.623 -7.868 1.00 0.00 C ATOM 1828 CZ TYR B 207 -3.870 7.826 -9.219 1.00 0.00 C ATOM 1829 OH TYR B 207 -2.959 7.011 -9.822 1.00 0.00 O ATOM 0 H TYR B 207 -8.828 11.095 -6.126 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.520 9.835 -8.726 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.825 11.308 -7.685 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.763 10.275 -6.270 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -5.931 10.470 -9.898 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.476 8.264 -6.229 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -4.207 9.046 -10.972 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.763 6.836 -7.299 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.492 7.507 -10.527 1.00 0.00 H new ATOM 1839 N PHE B 208 -9.120 7.983 -6.148 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.380 6.632 -5.682 1.00 0.00 C ATOM 1841 C PHE B 208 -10.681 6.131 -6.303 1.00 0.00 C ATOM 1842 O PHE B 208 -10.679 5.061 -6.911 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.388 6.644 -4.152 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.089 5.468 -3.492 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -9.402 4.274 -3.203 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -11.459 5.571 -3.177 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -10.076 3.206 -2.583 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -12.136 4.491 -2.589 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.441 3.313 -2.270 1.00 0.00 C ATOM 0 H PHE B 208 -9.451 8.698 -5.500 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.603 5.934 -5.994 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.357 6.673 -3.801 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.865 7.564 -3.816 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -8.357 4.178 -3.457 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -11.991 6.486 -3.389 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -9.541 2.298 -2.346 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -13.193 4.566 -2.382 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.953 2.494 -1.787 1.00 0.00 H new ATOM 1859 N THR B 209 -11.779 6.891 -6.204 1.00 0.00 N ATOM 1860 CA THR B 209 -13.067 6.501 -6.773 1.00 0.00 C ATOM 1861 C THR B 209 -12.883 6.232 -8.268 1.00 0.00 C ATOM 1862 O THR B 209 -13.261 5.161 -8.734 1.00 0.00 O ATOM 1863 CB THR B 209 -14.160 7.532 -6.416 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.444 7.098 -6.794 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.974 8.911 -7.048 1.00 0.00 C ATOM 0 H THR B 209 -11.795 7.792 -5.727 1.00 0.00 H new ATOM 0 HA THR B 209 -13.428 5.570 -6.336 1.00 0.00 H new ATOM 0 HB THR B 209 -14.062 7.619 -5.334 1.00 0.00 H new ATOM 0 HG1 THR B 209 -16.105 7.779 -6.548 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.789 9.566 -6.740 1.00 0.00 H new ATOM 0 HG22 THR B 209 -13.025 9.336 -6.722 1.00 0.00 H new ATOM 0 HG23 THR B 209 -13.975 8.817 -8.134 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.179 7.111 -8.998 1.00 0.00 N ATOM 1874 CA LYS B 210 -11.930 6.948 -10.431 1.00 0.00 C ATOM 1875 C LYS B 210 -11.206 5.646 -10.785 1.00 0.00 C ATOM 1876 O LYS B 210 -11.046 5.354 -11.966 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.244 8.192 -10.992 1.00 0.00 C ATOM 1878 CG LYS B 210 -9.808 8.363 -10.537 1.00 0.00 C ATOM 1879 CD LYS B 210 -9.156 9.546 -11.258 1.00 0.00 C ATOM 1880 CE LYS B 210 -9.890 10.875 -11.016 1.00 0.00 C ATOM 1881 NZ LYS B 210 -9.480 11.934 -11.955 1.00 0.00 N ATOM 0 H LYS B 210 -11.766 7.957 -8.605 1.00 0.00 H new ATOM 0 HA LYS B 210 -12.899 6.851 -10.921 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -11.266 8.147 -12.081 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.815 9.073 -10.698 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -9.778 8.525 -9.459 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -9.245 7.451 -10.738 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -8.122 9.642 -10.925 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -9.129 9.342 -12.328 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -10.964 10.713 -11.105 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -9.702 11.208 -9.995 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -10.006 12.806 -11.746 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -8.460 12.112 -11.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -9.684 11.632 -12.929 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.627 4.937 -9.814 1.00 0.00 N ATOM 1896 CA LEU B 211 -9.977 3.648 -10.013 1.00 0.00 C ATOM 1897 C LEU B 211 -11.018 2.565 -9.750 1.00 0.00 C ATOM 1898 O LEU B 211 -11.114 1.631 -10.543 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.740 3.454 -9.126 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.573 4.364 -9.531 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.508 4.348 -8.426 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.955 3.931 -10.871 1.00 0.00 C ATOM 0 H LEU B 211 -10.599 5.254 -8.845 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.605 3.593 -11.036 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.007 3.653 -8.088 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.419 2.414 -9.179 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.956 5.376 -9.660 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.678 4.994 -8.712 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.945 4.709 -7.495 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.144 3.330 -8.286 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -6.132 4.599 -11.125 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.581 2.910 -10.787 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.713 3.976 -11.653 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.780 2.669 -8.655 1.00 0.00 N ATOM 1915 CA VAL B 212 -12.817 1.705 -8.297 1.00 0.00 C ATOM 1916 C VAL B 212 -13.831 1.602 -9.435 1.00 0.00 C ATOM 1917 O VAL B 212 -14.069 0.497 -9.906 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.538 2.101 -6.989 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.586 1.058 -6.568 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.567 2.282 -5.812 1.00 0.00 C ATOM 0 H VAL B 212 -11.690 3.435 -7.988 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.339 0.739 -8.134 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.023 3.051 -7.214 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.067 1.378 -5.644 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.336 0.959 -7.352 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.099 0.096 -6.409 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.126 2.560 -4.918 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.036 1.348 -5.632 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -11.849 3.067 -6.050 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.367 2.730 -9.925 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.374 2.755 -10.993 1.00 0.00 C ATOM 1932 C GLU B 213 -14.909 2.051 -12.266 1.00 0.00 C ATOM 1933 O GLU B 213 -15.739 1.548 -13.025 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.834 4.191 -11.316 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.206 4.976 -10.051 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.339 5.983 -10.227 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -17.308 6.787 -11.186 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -18.242 6.048 -9.360 1.00 0.00 O ATOM 0 H GLU B 213 -14.111 3.658 -9.587 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.226 2.197 -10.605 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -15.039 4.715 -11.847 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.694 4.154 -11.985 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -16.487 4.268 -9.272 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -15.321 5.505 -9.697 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.597 2.060 -12.500 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.927 1.442 -13.644 1.00 0.00 C ATOM 1947 C GLN B 214 -12.701 -0.046 -13.412 1.00 0.00 C ATOM 1948 O GLN B 214 -12.815 -0.841 -14.348 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.579 2.137 -13.887 1.00 0.00 C ATOM 1950 CG GLN B 214 -11.843 3.511 -14.478 1.00 0.00 C ATOM 1951 CD GLN B 214 -10.641 4.077 -15.209 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -10.282 3.613 -16.291 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -10.033 5.107 -14.648 1.00 0.00 N ATOM 0 H GLN B 214 -12.942 2.520 -11.868 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.567 1.557 -14.519 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.026 2.227 -12.952 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.965 1.545 -14.565 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -12.686 3.449 -15.167 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -12.133 4.195 -13.680 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -10.359 5.464 -13.750 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -9.238 5.545 -15.113 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.333 -0.408 -12.186 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.107 -1.791 -11.802 1.00 0.00 C ATOM 1964 C TYR B 215 -13.462 -2.521 -11.781 1.00 0.00 C ATOM 1965 O TYR B 215 -13.497 -3.702 -12.129 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.344 -1.879 -10.468 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.863 -1.500 -10.484 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -8.994 -2.016 -11.465 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.331 -0.688 -9.460 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.622 -1.701 -11.443 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.953 -0.394 -9.413 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.088 -0.900 -10.410 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.749 -0.633 -10.375 1.00 0.00 O ATOM 0 H TYR B 215 -12.183 0.258 -11.428 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.468 -2.289 -12.531 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.849 -1.237 -9.747 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.427 -2.901 -10.098 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.383 -2.659 -12.241 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.988 -0.287 -8.703 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -6.973 -2.075 -12.222 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.558 0.218 -8.615 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.548 -0.067 -9.600 1.00 0.00 H new ATOM 1983 N THR B 216 -14.565 -1.867 -11.387 1.00 0.00 N ATOM 1984 CA THR B 216 -15.895 -2.481 -11.386 1.00 0.00 C ATOM 1985 C THR B 216 -16.451 -2.526 -12.818 1.00 0.00 C ATOM 1986 O THR B 216 -15.926 -1.861 -13.713 1.00 0.00 O ATOM 1987 CB THR B 216 -16.874 -1.677 -10.497 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.784 -0.280 -10.684 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.670 -1.929 -9.012 1.00 0.00 C ATOM 0 H THR B 216 -14.557 -0.900 -11.062 1.00 0.00 H new ATOM 0 HA THR B 216 -15.799 -3.491 -10.988 1.00 0.00 H new ATOM 0 HB THR B 216 -17.853 -2.035 -10.815 1.00 0.00 H new ATOM 0 HG1 THR B 216 -15.943 0.048 -10.301 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.385 -1.337 -8.441 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.821 -2.987 -8.798 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.656 -1.643 -8.730 1.00 0.00 H new