USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=11 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 30:sc= 0.719 USER MOD Set 1.2: B 188 LYS NZ :NH3+ -110:sc= 1.04 (180deg=0) USER MOD Single : A 86 ASN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.137 X(o=-0.14,f=-0.2) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot -29:sc= 0.0195 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 170 THR OG1 : rot 95:sc= 1.22 USER MOD Single : B 172 GLN : amide:sc= 0.732 K(o=0.73,f=0) USER MOD Single : B 177 ASN : amide:sc= 0 X(o=0,f=-0.32) 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 180:sc=-0.00138 (180deg=-0.00138) USER MOD Single : B 187 GLN : amide:sc= -2.65 K(o=-2.7,f=-0.16) USER MOD Single : B 190 GLN : amide:sc= 0.746 K(o=0.75,f=0) USER MOD Single : B 192 ASN : amide:sc= -1.47 K(o=-1.5,f=0.049) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 0.707 K(o=0.71,f=-0.91) USER MOD Single : B 201 GLN : amide:sc=-0.00202 K(o=-0.002,f=-3.1!) USER MOD Single : B 202 HIS : no HD1:sc= -0.69 K(o=-0.69,f=-1.5) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 207 TYR OH : rot 165: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 X(o=0,f=0) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 12:sc= 0.347 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.241 -12.253 2.830 1.00 0.00 N ATOM 132 CA GLU A 80 -10.744 -11.105 2.090 1.00 0.00 C ATOM 133 C GLU A 80 -9.804 -10.253 2.932 1.00 0.00 C ATOM 134 O GLU A 80 -8.778 -9.803 2.418 1.00 0.00 O ATOM 135 CB GLU A 80 -11.906 -10.236 1.610 1.00 0.00 C ATOM 136 CG GLU A 80 -12.816 -10.945 0.595 1.00 0.00 C ATOM 137 CD GLU A 80 -14.229 -10.366 0.534 1.00 0.00 C ATOM 138 OE1 GLU A 80 -14.630 -9.588 1.430 1.00 0.00 O ATOM 139 OE2 GLU A 80 -15.013 -10.817 -0.330 1.00 0.00 O ATOM 0 HA GLU A 80 -10.190 -11.492 1.235 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.502 -9.930 2.470 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.509 -9.327 1.158 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -12.363 -10.881 -0.394 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -12.876 -12.003 0.850 1.00 0.00 H new ATOM 146 N PHE A 81 -10.131 -10.024 4.207 1.00 0.00 N ATOM 147 CA PHE A 81 -9.275 -9.221 5.071 1.00 0.00 C ATOM 148 C PHE A 81 -7.859 -9.815 5.128 1.00 0.00 C ATOM 149 O PHE A 81 -6.884 -9.069 5.198 1.00 0.00 O ATOM 150 CB PHE A 81 -9.930 -9.039 6.458 1.00 0.00 C ATOM 151 CG PHE A 81 -11.058 -8.011 6.514 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.844 -6.739 5.962 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.289 -8.265 7.157 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.826 -5.739 6.025 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.278 -7.260 7.229 1.00 0.00 C ATOM 156 CZ PHE A 81 -13.046 -5.991 6.661 1.00 0.00 C ATOM 0 H PHE A 81 -10.974 -10.381 4.656 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.165 -8.220 4.653 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.321 -10.002 6.787 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.159 -8.748 7.171 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.903 -6.525 5.478 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.475 -9.234 7.596 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.639 -4.772 5.581 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.217 -7.465 7.722 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.802 -5.222 6.716 1.00 0.00 H new ATOM 166 N ALA A 82 -7.735 -11.139 5.047 1.00 0.00 N ATOM 167 CA ALA A 82 -6.470 -11.846 5.070 1.00 0.00 C ATOM 168 C ALA A 82 -5.635 -11.459 3.845 1.00 0.00 C ATOM 169 O ALA A 82 -4.494 -11.011 3.988 1.00 0.00 O ATOM 170 CB ALA A 82 -6.760 -13.350 5.091 1.00 0.00 C ATOM 0 H ALA A 82 -8.539 -11.761 4.961 1.00 0.00 H new ATOM 0 HA ALA A 82 -5.897 -11.579 5.958 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.820 -13.902 5.108 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.342 -13.596 5.979 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.325 -13.624 4.200 1.00 0.00 H new ATOM 176 N GLU A 83 -6.191 -11.625 2.641 1.00 0.00 N ATOM 177 CA GLU A 83 -5.522 -11.299 1.382 1.00 0.00 C ATOM 178 C GLU A 83 -5.146 -9.815 1.364 1.00 0.00 C ATOM 179 O GLU A 83 -4.033 -9.461 0.979 1.00 0.00 O ATOM 180 CB GLU A 83 -6.444 -11.639 0.209 1.00 0.00 C ATOM 181 CG GLU A 83 -5.810 -11.391 -1.173 1.00 0.00 C ATOM 182 CD GLU A 83 -4.668 -12.346 -1.531 1.00 0.00 C ATOM 183 OE1 GLU A 83 -4.812 -13.568 -1.291 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.653 -11.919 -2.130 1.00 0.00 O ATOM 0 H GLU A 83 -7.133 -11.995 2.514 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.609 -11.887 1.289 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.737 -12.686 0.281 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.355 -11.047 0.292 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.586 -11.472 -1.934 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.435 -10.368 -1.208 1.00 0.00 H new ATOM 191 N PHE A 84 -6.051 -8.945 1.820 1.00 0.00 N ATOM 192 CA PHE A 84 -5.819 -7.510 1.876 1.00 0.00 C ATOM 193 C PHE A 84 -4.530 -7.228 2.651 1.00 0.00 C ATOM 194 O PHE A 84 -3.619 -6.573 2.141 1.00 0.00 O ATOM 195 CB PHE A 84 -6.999 -6.823 2.564 1.00 0.00 C ATOM 196 CG PHE A 84 -6.846 -5.323 2.638 1.00 0.00 C ATOM 197 CD1 PHE A 84 -6.938 -4.566 1.461 1.00 0.00 C ATOM 198 CD2 PHE A 84 -6.630 -4.678 3.870 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.909 -3.167 1.514 1.00 0.00 C ATOM 200 CE2 PHE A 84 -6.624 -3.273 3.927 1.00 0.00 C ATOM 201 CZ PHE A 84 -6.787 -2.518 2.752 1.00 0.00 C ATOM 0 H PHE A 84 -6.970 -9.225 2.162 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.721 -7.121 0.863 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -7.916 -7.063 2.026 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.107 -7.222 3.573 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -7.032 -5.065 0.508 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -6.470 -5.259 4.766 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.980 -2.589 0.604 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -6.494 -2.773 4.875 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.818 -1.440 2.802 1.00 0.00 H new ATOM 211 N TYR A 85 -4.435 -7.747 3.881 1.00 0.00 N ATOM 212 CA TYR A 85 -3.259 -7.556 4.713 1.00 0.00 C ATOM 213 C TYR A 85 -2.022 -8.232 4.106 1.00 0.00 C ATOM 214 O TYR A 85 -0.909 -7.773 4.375 1.00 0.00 O ATOM 215 CB TYR A 85 -3.542 -7.997 6.155 1.00 0.00 C ATOM 216 CG TYR A 85 -4.437 -7.033 6.919 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.028 -5.696 7.106 1.00 0.00 C ATOM 218 CD2 TYR A 85 -5.662 -7.464 7.469 1.00 0.00 C ATOM 219 CE1 TYR A 85 -4.831 -4.804 7.835 1.00 0.00 C ATOM 220 CE2 TYR A 85 -6.483 -6.571 8.180 1.00 0.00 C ATOM 221 CZ TYR A 85 -6.046 -5.248 8.395 1.00 0.00 C ATOM 222 OH TYR A 85 -6.812 -4.402 9.130 1.00 0.00 O ATOM 0 H TYR A 85 -5.169 -8.305 4.317 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.026 -6.492 4.748 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.010 -8.981 6.140 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -2.596 -8.102 6.687 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.093 -5.357 6.686 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -5.973 -8.491 7.343 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -4.518 -3.779 7.966 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.441 -6.896 8.558 1.00 0.00 H new ATOM 0 HH TYR A 85 -6.685 -3.484 8.811 1.00 0.00 H new ATOM 232 N ASN A 86 -2.165 -9.289 3.296 1.00 0.00 N ATOM 233 CA ASN A 86 -1.037 -9.957 2.650 1.00 0.00 C ATOM 234 C ASN A 86 -0.439 -8.984 1.630 1.00 0.00 C ATOM 235 O ASN A 86 0.777 -8.780 1.617 1.00 0.00 O ATOM 236 CB ASN A 86 -1.469 -11.260 1.961 1.00 0.00 C ATOM 237 CG ASN A 86 -1.339 -12.477 2.856 1.00 0.00 C ATOM 238 OD1 ASN A 86 -0.429 -13.284 2.710 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.219 -12.622 3.831 1.00 0.00 N ATOM 0 H ASN A 86 -3.070 -9.703 3.072 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.296 -10.230 3.402 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.505 -11.165 1.635 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.865 -11.408 1.066 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.145 -13.412 4.472 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.973 -11.944 3.943 1.00 0.00 H new ATOM 246 N ARG A 87 -1.279 -8.356 0.802 1.00 0.00 N ATOM 247 CA ARG A 87 -0.845 -7.383 -0.204 1.00 0.00 C ATOM 248 C ARG A 87 -0.285 -6.147 0.500 1.00 0.00 C ATOM 249 O ARG A 87 0.734 -5.600 0.084 1.00 0.00 O ATOM 250 CB ARG A 87 -2.020 -7.064 -1.152 1.00 0.00 C ATOM 251 CG ARG A 87 -2.515 -8.277 -1.959 1.00 0.00 C ATOM 252 CD ARG A 87 -1.472 -8.776 -2.966 1.00 0.00 C ATOM 253 NE ARG A 87 -1.561 -10.224 -3.201 1.00 0.00 N ATOM 254 CZ ARG A 87 -0.659 -10.915 -3.909 1.00 0.00 C ATOM 255 NH1 ARG A 87 0.297 -10.284 -4.597 1.00 0.00 N ATOM 256 NH2 ARG A 87 -0.731 -12.240 -3.939 1.00 0.00 N ATOM 0 H ARG A 87 -2.287 -8.510 0.811 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.044 -7.790 -0.821 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.849 -6.666 -0.567 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.713 -6.280 -1.844 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.770 -9.086 -1.274 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.428 -8.008 -2.490 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.604 -8.249 -3.911 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.474 -8.531 -2.601 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.353 -10.730 -2.803 1.00 0.00 H new ATOM 0 HH11 ARG A 87 0.345 -9.265 -4.586 1.00 0.00 H new ATOM 0 HH12 ARG A 87 0.979 -10.821 -5.133 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -1.469 -12.722 -3.426 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -0.049 -12.776 -4.475 1.00 0.00 H new ATOM 270 N LEU A 88 -0.880 -5.722 1.620 1.00 0.00 N ATOM 271 CA LEU A 88 -0.355 -4.572 2.356 1.00 0.00 C ATOM 272 C LEU A 88 1.063 -4.870 2.827 1.00 0.00 C ATOM 273 O LEU A 88 1.908 -3.976 2.814 1.00 0.00 O ATOM 274 CB LEU A 88 -1.223 -4.223 3.572 1.00 0.00 C ATOM 275 CG LEU A 88 -2.326 -3.210 3.250 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.328 -3.164 4.407 1.00 0.00 C ATOM 277 CD2 LEU A 88 -1.704 -1.818 3.086 1.00 0.00 C ATOM 0 H LEU A 88 -1.711 -6.150 2.029 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.362 -3.718 1.678 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.677 -5.134 3.961 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.588 -3.821 4.361 1.00 0.00 H new ATOM 0 HG LEU A 88 -2.831 -3.506 2.330 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.114 -2.444 4.179 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -3.770 -4.151 4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -2.815 -2.865 5.321 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.486 -1.095 2.857 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.205 -1.531 4.011 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -0.978 -1.837 2.273 1.00 0.00 H new ATOM 289 N LYS A 89 1.319 -6.107 3.268 1.00 0.00 N ATOM 290 CA LYS A 89 2.629 -6.536 3.735 1.00 0.00 C ATOM 291 C LYS A 89 3.647 -6.370 2.613 1.00 0.00 C ATOM 292 O LYS A 89 4.746 -5.905 2.885 1.00 0.00 O ATOM 293 CB LYS A 89 2.554 -7.983 4.242 1.00 0.00 C ATOM 294 CG LYS A 89 3.786 -8.380 5.060 1.00 0.00 C ATOM 295 CD LYS A 89 3.610 -9.740 5.745 1.00 0.00 C ATOM 296 CE LYS A 89 3.597 -10.905 4.749 1.00 0.00 C ATOM 297 NZ LYS A 89 3.634 -12.204 5.445 1.00 0.00 N ATOM 0 H LYS A 89 0.611 -6.840 3.308 1.00 0.00 H new ATOM 0 HA LYS A 89 2.952 -5.916 4.571 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.660 -8.105 4.854 1.00 0.00 H new ATOM 0 HB3 LYS A 89 2.453 -8.658 3.392 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.658 -8.414 4.407 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.981 -7.617 5.814 1.00 0.00 H new ATOM 0 HD2 LYS A 89 4.418 -9.889 6.462 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.678 -9.740 6.310 1.00 0.00 H new ATOM 0 HE2 LYS A 89 2.702 -10.847 4.130 1.00 0.00 H new ATOM 0 HE3 LYS A 89 4.453 -10.824 4.080 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 3.624 -12.973 4.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.501 -12.267 6.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.803 -12.289 6.065 1.00 0.00 H new ATOM 311 N GLN A 90 3.294 -6.728 1.377 1.00 0.00 N ATOM 312 CA GLN A 90 4.174 -6.605 0.220 1.00 0.00 C ATOM 313 C GLN A 90 4.674 -5.160 0.087 1.00 0.00 C ATOM 314 O GLN A 90 5.884 -4.929 0.075 1.00 0.00 O ATOM 315 CB GLN A 90 3.433 -7.102 -1.040 1.00 0.00 C ATOM 316 CG GLN A 90 3.826 -8.527 -1.430 1.00 0.00 C ATOM 317 CD GLN A 90 5.261 -8.590 -1.942 1.00 0.00 C ATOM 318 OE1 GLN A 90 6.173 -9.015 -1.230 1.00 0.00 O ATOM 319 NE2 GLN A 90 5.499 -8.162 -3.170 1.00 0.00 N ATOM 0 H GLN A 90 2.378 -7.116 1.152 1.00 0.00 H new ATOM 0 HA GLN A 90 5.058 -7.230 0.348 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.358 -7.061 -0.865 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.646 -6.430 -1.871 1.00 0.00 H new ATOM 0 HG2 GLN A 90 3.717 -9.185 -0.568 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.147 -8.895 -2.199 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.733 -7.813 -3.746 1.00 0.00 H new ATOM 0 HE22 GLN A 90 6.449 -8.180 -3.541 1.00 0.00 H new ATOM 328 N ILE A 91 3.759 -4.186 0.044 1.00 0.00 N ATOM 329 CA ILE A 91 4.100 -2.766 -0.079 1.00 0.00 C ATOM 330 C ILE A 91 4.974 -2.344 1.115 1.00 0.00 C ATOM 331 O ILE A 91 6.062 -1.791 0.945 1.00 0.00 O ATOM 332 CB ILE A 91 2.815 -1.896 -0.176 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.853 -2.354 -1.298 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.187 -0.415 -0.402 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.443 -1.766 -1.144 1.00 0.00 C ATOM 0 H ILE A 91 2.756 -4.362 0.094 1.00 0.00 H new ATOM 0 HA ILE A 91 4.666 -2.610 -0.998 1.00 0.00 H new ATOM 0 HB ILE A 91 2.292 -2.018 0.773 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.262 -2.059 -2.265 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.791 -3.442 -1.296 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.278 0.183 -0.468 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.794 -0.061 0.431 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.752 -0.319 -1.329 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.190 -2.120 -1.958 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.019 -2.082 -0.191 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.497 -0.678 -1.174 1.00 0.00 H new ATOM 347 N LYS A 92 4.497 -2.621 2.331 1.00 0.00 N ATOM 348 CA LYS A 92 5.162 -2.278 3.581 1.00 0.00 C ATOM 349 C LYS A 92 6.595 -2.773 3.657 1.00 0.00 C ATOM 350 O LYS A 92 7.491 -1.957 3.843 1.00 0.00 O ATOM 351 CB LYS A 92 4.344 -2.811 4.768 1.00 0.00 C ATOM 352 CG LYS A 92 3.116 -1.934 5.018 1.00 0.00 C ATOM 353 CD LYS A 92 2.119 -2.599 5.956 1.00 0.00 C ATOM 354 CE LYS A 92 0.926 -1.665 6.145 1.00 0.00 C ATOM 355 NZ LYS A 92 -0.090 -2.253 7.038 1.00 0.00 N ATOM 0 H LYS A 92 3.610 -3.105 2.472 1.00 0.00 H new ATOM 0 HA LYS A 92 5.216 -1.190 3.624 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.030 -3.836 4.569 1.00 0.00 H new ATOM 0 HB3 LYS A 92 4.967 -2.837 5.662 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.432 -0.981 5.442 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.629 -1.714 4.068 1.00 0.00 H new ATOM 0 HD2 LYS A 92 1.790 -3.553 5.543 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.588 -2.812 6.917 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.268 -0.716 6.558 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.477 -1.447 5.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.885 -1.591 7.143 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -0.435 -3.146 6.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.332 -2.437 7.970 1.00 0.00 H new ATOM 1028 N SER B 160 3.606 9.594 -2.160 1.00 0.00 N ATOM 1029 CA SER B 160 4.771 8.728 -2.249 1.00 0.00 C ATOM 1030 C SER B 160 4.388 7.454 -3.019 1.00 0.00 C ATOM 1031 O SER B 160 3.209 7.101 -3.145 1.00 0.00 O ATOM 1032 CB SER B 160 5.275 8.394 -0.838 1.00 0.00 C ATOM 1033 OG SER B 160 4.325 7.635 -0.110 1.00 0.00 O ATOM 0 HA SER B 160 5.576 9.231 -2.784 1.00 0.00 H new ATOM 0 HB2 SER B 160 6.210 7.838 -0.907 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.493 9.317 -0.301 1.00 0.00 H new ATOM 0 HG SER B 160 3.423 7.851 -0.425 1.00 0.00 H new ATOM 1039 N ALA B 161 5.391 6.703 -3.490 1.00 0.00 N ATOM 1040 CA ALA B 161 5.153 5.455 -4.216 1.00 0.00 C ATOM 1041 C ALA B 161 4.523 4.384 -3.308 1.00 0.00 C ATOM 1042 O ALA B 161 4.036 3.365 -3.799 1.00 0.00 O ATOM 1043 CB ALA B 161 6.474 4.940 -4.789 1.00 0.00 C ATOM 0 H ALA B 161 6.377 6.941 -3.380 1.00 0.00 H new ATOM 0 HA ALA B 161 4.451 5.659 -5.025 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.298 4.010 -5.330 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.890 5.683 -5.470 1.00 0.00 H new ATOM 0 HB3 ALA B 161 7.177 4.759 -3.976 1.00 0.00 H new ATOM 1049 N PHE B 162 4.578 4.582 -1.988 1.00 0.00 N ATOM 1050 CA PHE B 162 4.029 3.683 -0.993 1.00 0.00 C ATOM 1051 C PHE B 162 2.512 3.834 -0.998 1.00 0.00 C ATOM 1052 O PHE B 162 1.801 2.912 -1.399 1.00 0.00 O ATOM 1053 CB PHE B 162 4.651 4.014 0.379 1.00 0.00 C ATOM 1054 CG PHE B 162 4.364 3.060 1.531 1.00 0.00 C ATOM 1055 CD1 PHE B 162 3.061 2.594 1.814 1.00 0.00 C ATOM 1056 CD2 PHE B 162 5.419 2.691 2.389 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.829 1.744 2.903 1.00 0.00 C ATOM 1058 CE2 PHE B 162 5.184 1.851 3.491 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.886 1.384 3.743 1.00 0.00 C ATOM 0 H PHE B 162 5.023 5.403 -1.578 1.00 0.00 H new ATOM 0 HA PHE B 162 4.266 2.643 -1.215 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.732 4.073 0.253 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.310 5.007 0.672 1.00 0.00 H new ATOM 0 HD1 PHE B 162 2.236 2.896 1.185 1.00 0.00 H new ATOM 0 HD2 PHE B 162 6.417 3.057 2.198 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.835 1.368 3.093 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.999 1.567 4.140 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.702 0.742 4.592 1.00 0.00 H new ATOM 1069 N ASP B 163 2.007 4.991 -0.555 1.00 0.00 N ATOM 1070 CA ASP B 163 0.570 5.258 -0.473 1.00 0.00 C ATOM 1071 C ASP B 163 -0.098 5.156 -1.833 1.00 0.00 C ATOM 1072 O ASP B 163 -1.268 4.786 -1.916 1.00 0.00 O ATOM 1073 CB ASP B 163 0.274 6.574 0.251 1.00 0.00 C ATOM 1074 CG ASP B 163 0.585 6.501 1.746 1.00 0.00 C ATOM 1075 OD1 ASP B 163 0.571 5.384 2.324 1.00 0.00 O ATOM 1076 OD2 ASP B 163 0.910 7.553 2.337 1.00 0.00 O ATOM 0 H ASP B 163 2.587 5.770 -0.243 1.00 0.00 H new ATOM 0 HA ASP B 163 0.123 4.476 0.141 1.00 0.00 H new ATOM 0 HB2 ASP B 163 0.861 7.374 -0.201 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.776 6.833 0.114 1.00 0.00 H new ATOM 1081 N LEU B 164 0.636 5.423 -2.915 1.00 0.00 N ATOM 1082 CA LEU B 164 0.111 5.311 -4.264 1.00 0.00 C ATOM 1083 C LEU B 164 -0.410 3.889 -4.479 1.00 0.00 C ATOM 1084 O LEU B 164 -1.513 3.699 -5.001 1.00 0.00 O ATOM 1085 CB LEU B 164 1.246 5.601 -5.251 1.00 0.00 C ATOM 1086 CG LEU B 164 0.888 5.292 -6.711 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.178 6.257 -7.246 1.00 0.00 C ATOM 1088 CD2 LEU B 164 2.176 5.378 -7.520 1.00 0.00 C ATOM 0 H LEU B 164 1.610 5.722 -2.873 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.703 6.019 -4.418 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.527 6.651 -5.170 1.00 0.00 H new ATOM 0 HB3 LEU B 164 2.120 5.014 -4.968 1.00 0.00 H new ATOM 0 HG LEU B 164 0.456 4.294 -6.792 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.407 6.008 -8.282 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.082 6.170 -6.644 1.00 0.00 H new ATOM 0 HD13 LEU B 164 0.197 7.279 -7.192 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.963 5.164 -8.567 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.594 6.381 -7.432 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.894 4.651 -7.140 1.00 0.00 H new ATOM 1100 N ASP B 165 0.417 2.913 -4.098 1.00 0.00 N ATOM 1101 CA ASP B 165 0.136 1.497 -4.216 1.00 0.00 C ATOM 1102 C ASP B 165 -0.993 1.099 -3.270 1.00 0.00 C ATOM 1103 O ASP B 165 -1.883 0.353 -3.662 1.00 0.00 O ATOM 1104 CB ASP B 165 1.412 0.691 -3.973 1.00 0.00 C ATOM 1105 CG ASP B 165 1.344 -0.636 -4.725 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.528 -1.521 -4.396 1.00 0.00 O ATOM 1107 OD2 ASP B 165 2.070 -0.757 -5.736 1.00 0.00 O ATOM 0 H ASP B 165 1.330 3.103 -3.686 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.203 1.274 -5.228 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.280 1.261 -4.303 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.538 0.507 -2.906 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.020 1.642 -2.046 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.060 1.356 -1.054 1.00 0.00 C ATOM 1114 C VAL B 166 -3.422 1.733 -1.653 1.00 0.00 C ATOM 1115 O VAL B 166 -4.373 0.948 -1.581 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.753 2.103 0.262 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -2.855 1.959 1.318 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.441 1.614 0.898 1.00 0.00 C ATOM 0 H VAL B 166 -0.313 2.298 -1.715 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.084 0.295 -0.807 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.678 3.150 -0.030 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.573 2.509 2.216 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.790 2.360 0.926 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -2.987 0.905 1.564 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.258 2.162 1.822 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.518 0.549 1.117 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.384 1.784 0.206 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.531 2.913 -2.267 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.764 3.374 -2.895 1.00 0.00 C ATOM 1130 C VAL B 167 -5.122 2.404 -4.029 1.00 0.00 C ATOM 1131 O VAL B 167 -6.260 1.937 -4.098 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.576 4.832 -3.366 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.774 5.357 -4.164 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.377 5.780 -2.171 1.00 0.00 C ATOM 0 H VAL B 167 -2.760 3.577 -2.341 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.600 3.378 -2.196 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.693 4.816 -4.006 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.585 6.386 -4.469 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.921 4.738 -5.049 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.669 5.321 -3.543 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.247 6.800 -2.533 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.251 5.734 -1.521 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.492 5.479 -1.611 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.160 2.075 -4.900 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.343 1.165 -6.032 1.00 0.00 C ATOM 1146 C LYS B 168 -4.790 -0.231 -5.585 1.00 0.00 C ATOM 1147 O LYS B 168 -5.613 -0.837 -6.276 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.045 1.144 -6.862 1.00 0.00 C ATOM 1149 CG LYS B 168 -2.998 2.360 -7.808 1.00 0.00 C ATOM 1150 CD LYS B 168 -1.638 2.548 -8.497 1.00 0.00 C ATOM 1151 CE LYS B 168 -1.560 1.982 -9.923 1.00 0.00 C ATOM 1152 NZ LYS B 168 -1.497 0.506 -9.970 1.00 0.00 N ATOM 0 H LYS B 168 -3.211 2.444 -4.834 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.154 1.528 -6.663 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.180 1.157 -6.199 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -2.990 0.222 -7.440 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -3.770 2.248 -8.570 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.237 3.260 -7.242 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.406 3.613 -8.530 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -0.869 2.072 -7.889 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -2.430 2.319 -10.487 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -0.680 2.391 -10.420 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -1.446 0.192 -10.960 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -0.653 0.178 -9.459 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -2.348 0.108 -9.524 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.287 -0.751 -4.469 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.616 -2.050 -3.891 1.00 0.00 C ATOM 1168 C LEU B 169 -6.061 -1.996 -3.403 1.00 0.00 C ATOM 1169 O LEU B 169 -6.896 -2.793 -3.829 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.638 -2.299 -2.722 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.656 -3.676 -2.027 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -2.633 -3.654 -0.880 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -4.998 -4.137 -1.459 1.00 0.00 C ATOM 0 H LEU B 169 -3.598 -0.247 -3.911 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.522 -2.861 -4.613 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.627 -2.128 -3.093 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.830 -1.542 -1.962 1.00 0.00 H new ATOM 0 HG LEU B 169 -3.419 -4.391 -2.815 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.631 -4.620 -0.376 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -1.640 -3.452 -1.282 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -2.902 -2.874 -0.168 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.880 -5.117 -0.997 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.341 -3.422 -0.711 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.731 -4.201 -2.263 1.00 0.00 H new ATOM 1185 N THR B 170 -6.355 -1.033 -2.532 1.00 0.00 N ATOM 1186 CA THR B 170 -7.667 -0.834 -1.939 1.00 0.00 C ATOM 1187 C THR B 170 -8.757 -0.706 -3.013 1.00 0.00 C ATOM 1188 O THR B 170 -9.761 -1.419 -2.970 1.00 0.00 O ATOM 1189 CB THR B 170 -7.612 0.340 -0.943 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.454 0.257 -0.127 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.810 0.324 0.009 1.00 0.00 C ATOM 0 H THR B 170 -5.665 -0.353 -2.213 1.00 0.00 H new ATOM 0 HA THR B 170 -7.951 -1.716 -1.365 1.00 0.00 H new ATOM 0 HB THR B 170 -7.609 1.249 -1.545 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.741 0.807 -0.514 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.739 1.166 0.698 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.733 0.403 -0.566 1.00 0.00 H new ATOM 0 HG23 THR B 170 -8.813 -0.608 0.574 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.547 0.157 -4.011 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.517 0.380 -5.080 1.00 0.00 C ATOM 1201 C ALA B 171 -9.759 -0.859 -5.959 1.00 0.00 C ATOM 1202 O ALA B 171 -10.814 -0.973 -6.580 1.00 0.00 O ATOM 1203 CB ALA B 171 -9.048 1.557 -5.940 1.00 0.00 C ATOM 0 H ALA B 171 -7.700 0.719 -4.098 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.474 0.603 -4.608 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.766 1.731 -6.741 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.970 2.451 -5.322 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -8.073 1.328 -6.370 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.805 -1.790 -6.041 1.00 0.00 N ATOM 1210 CA GLN B 172 -8.946 -2.994 -6.853 1.00 0.00 C ATOM 1211 C GLN B 172 -9.934 -3.979 -6.250 1.00 0.00 C ATOM 1212 O GLN B 172 -10.805 -4.460 -6.981 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.594 -3.697 -7.028 1.00 0.00 C ATOM 1214 CG GLN B 172 -6.880 -3.253 -8.301 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.464 -3.804 -8.315 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -5.124 -4.690 -9.090 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -4.623 -3.297 -7.431 1.00 0.00 N ATOM 0 H GLN B 172 -7.915 -1.727 -5.546 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.325 -2.669 -7.822 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -6.962 -3.487 -6.165 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.747 -4.776 -7.056 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.426 -3.605 -9.177 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.857 -2.165 -8.356 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -4.932 -2.560 -6.797 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -3.665 -3.643 -7.382 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.809 -4.305 -4.959 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.723 -5.275 -4.385 1.00 0.00 C ATOM 1228 C PHE B 173 -12.102 -4.689 -4.108 1.00 0.00 C ATOM 1229 O PHE B 173 -13.069 -5.427 -4.264 1.00 0.00 O ATOM 1230 CB PHE B 173 -10.174 -5.895 -3.121 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.901 -6.731 -3.221 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.659 -6.220 -3.659 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.943 -8.030 -2.697 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.495 -7.010 -3.575 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.774 -8.779 -2.524 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.547 -8.288 -2.990 1.00 0.00 C ATOM 0 H PHE B 173 -9.111 -3.925 -4.320 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.830 -6.054 -5.140 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.989 -5.091 -2.409 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.954 -6.526 -2.694 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.601 -5.219 -4.060 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.894 -8.461 -2.422 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.560 -6.633 -3.961 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -7.817 -9.738 -2.030 1.00 0.00 H new ATOM 0 HZ PHE B 173 -5.651 -8.884 -2.901 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.236 -3.412 -3.721 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.572 -2.838 -3.480 1.00 0.00 C ATOM 1248 C VAL B 174 -14.385 -2.972 -4.778 1.00 0.00 C ATOM 1249 O VAL B 174 -15.550 -3.336 -4.741 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.493 -1.381 -2.971 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.788 -1.277 -1.609 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.823 -0.468 -3.980 1.00 0.00 C ATOM 0 H VAL B 174 -11.458 -2.769 -3.571 1.00 0.00 H new ATOM 0 HA VAL B 174 -14.076 -3.386 -2.683 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.523 -1.050 -2.839 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.757 -0.234 -1.294 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.335 -1.863 -0.871 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.771 -1.660 -1.695 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.787 0.547 -3.585 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.809 -0.819 -4.171 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.391 -0.475 -4.910 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.747 -2.784 -5.940 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.404 -2.901 -7.233 1.00 0.00 C ATOM 1264 C ALA B 175 -14.773 -4.345 -7.592 1.00 0.00 C ATOM 1265 O ALA B 175 -15.527 -4.566 -8.536 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.432 -2.397 -8.294 1.00 0.00 C ATOM 0 H ALA B 175 -12.757 -2.546 -6.002 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.327 -2.323 -7.188 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.896 -2.472 -9.277 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.179 -1.357 -8.091 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.525 -3.002 -8.274 1.00 0.00 H new ATOM 1272 N ARG B 176 -14.212 -5.330 -6.889 1.00 0.00 N ATOM 1273 CA ARG B 176 -14.431 -6.756 -7.106 1.00 0.00 C ATOM 1274 C ARG B 176 -15.370 -7.403 -6.085 1.00 0.00 C ATOM 1275 O ARG B 176 -16.059 -8.355 -6.438 1.00 0.00 O ATOM 1276 CB ARG B 176 -13.049 -7.423 -7.090 1.00 0.00 C ATOM 1277 CG ARG B 176 -13.009 -8.726 -7.889 1.00 0.00 C ATOM 1278 CD ARG B 176 -11.550 -9.168 -7.988 1.00 0.00 C ATOM 1279 NE ARG B 176 -11.329 -10.294 -8.907 1.00 0.00 N ATOM 1280 CZ ARG B 176 -10.122 -10.847 -9.088 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -9.081 -10.385 -8.404 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -9.944 -11.841 -9.946 1.00 0.00 N ATOM 0 H ARG B 176 -13.566 -5.145 -6.121 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.937 -6.895 -8.062 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -12.312 -6.730 -7.497 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -12.761 -7.626 -6.059 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -13.608 -9.493 -7.399 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -13.432 -8.578 -8.883 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -10.946 -8.322 -8.314 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -11.197 -9.448 -6.995 1.00 0.00 H new ATOM 0 HE ARG B 176 -12.124 -10.668 -9.426 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -9.204 -9.615 -7.747 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -8.159 -10.801 -8.536 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -10.734 -12.199 -10.483 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -9.017 -12.248 -10.069 1.00 0.00 H new ATOM 1296 N ASN B 177 -15.388 -6.914 -4.840 1.00 0.00 N ATOM 1297 CA ASN B 177 -16.231 -7.451 -3.764 1.00 0.00 C ATOM 1298 C ASN B 177 -17.421 -6.554 -3.465 1.00 0.00 C ATOM 1299 O ASN B 177 -18.415 -7.033 -2.918 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.409 -7.742 -2.496 1.00 0.00 C ATOM 1301 CG ASN B 177 -14.409 -8.862 -2.769 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.752 -9.897 -3.337 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -13.141 -8.694 -2.440 1.00 0.00 N ATOM 0 H ASN B 177 -14.811 -6.125 -4.547 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.633 -8.399 -4.120 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.882 -6.842 -2.179 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -16.073 -8.027 -1.680 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -12.457 -9.419 -2.657 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.845 -7.839 -1.969 1.00 0.00 H new ATOM 1310 N GLY B 178 -17.347 -5.268 -3.802 1.00 0.00 N ATOM 1311 CA GLY B 178 -18.404 -4.292 -3.620 1.00 0.00 C ATOM 1312 C GLY B 178 -18.123 -3.216 -2.581 1.00 0.00 C ATOM 1313 O GLY B 178 -17.096 -3.194 -1.896 1.00 0.00 O ATOM 0 H GLY B 178 -16.511 -4.867 -4.227 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -18.598 -3.808 -4.577 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -19.316 -4.817 -3.338 1.00 0.00 H new ATOM 1317 N ARG B 179 -19.092 -2.302 -2.480 1.00 0.00 N ATOM 1318 CA ARG B 179 -19.063 -1.164 -1.573 1.00 0.00 C ATOM 1319 C ARG B 179 -19.087 -1.583 -0.110 1.00 0.00 C ATOM 1320 O ARG B 179 -18.484 -0.861 0.687 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.234 -0.220 -1.905 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.294 1.073 -1.064 1.00 0.00 C ATOM 1323 CD ARG B 179 -19.024 1.922 -1.088 1.00 0.00 C ATOM 1324 NE ARG B 179 -18.696 2.359 -2.452 1.00 0.00 N ATOM 1325 CZ ARG B 179 -18.626 3.613 -2.909 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -18.704 4.652 -2.083 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -18.464 3.815 -4.205 1.00 0.00 N ATOM 0 H ARG B 179 -19.940 -2.339 -3.045 1.00 0.00 H new ATOM 0 HA ARG B 179 -18.120 -0.637 -1.718 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.172 0.053 -2.958 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.168 -0.765 -1.771 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -21.126 1.681 -1.420 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.514 0.806 -0.030 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -19.155 2.794 -0.447 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -18.193 1.348 -0.679 1.00 0.00 H new ATOM 0 HE ARG B 179 -18.499 1.621 -3.128 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -18.819 4.499 -1.081 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -18.648 5.602 -2.451 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -18.394 3.020 -4.840 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -18.409 4.766 -4.570 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.726 -2.698 0.266 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.750 -3.084 1.671 1.00 0.00 C ATOM 1343 C GLN B 180 -18.321 -3.270 2.175 1.00 0.00 C ATOM 1344 O GLN B 180 -17.995 -2.704 3.217 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.665 -4.289 1.950 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.712 -4.560 3.462 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.928 -5.370 3.904 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -23.008 -4.822 4.108 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -21.781 -6.667 4.123 1.00 0.00 N ATOM 0 H GLN B 180 -20.218 -3.329 -0.367 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.203 -2.274 2.244 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.669 -4.091 1.574 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -20.295 -5.169 1.424 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -19.807 -5.092 3.755 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -20.708 -3.608 3.993 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -20.881 -7.114 3.951 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -22.568 -7.219 4.464 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.455 -3.990 1.449 1.00 0.00 N ATOM 1359 CA PHE B 181 -16.068 -4.197 1.860 1.00 0.00 C ATOM 1360 C PHE B 181 -15.379 -2.851 2.149 1.00 0.00 C ATOM 1361 O PHE B 181 -14.615 -2.734 3.110 1.00 0.00 O ATOM 1362 CB PHE B 181 -15.331 -5.001 0.778 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.849 -5.154 1.052 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -13.397 -6.008 2.075 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -12.925 -4.384 0.325 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -12.026 -6.082 2.377 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.556 -4.442 0.635 1.00 0.00 C ATOM 1368 CZ PHE B 181 -11.109 -5.296 1.658 1.00 0.00 C ATOM 0 H PHE B 181 -17.698 -4.441 0.567 1.00 0.00 H new ATOM 0 HA PHE B 181 -16.043 -4.770 2.787 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.783 -5.990 0.698 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -15.467 -4.510 -0.186 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -14.104 -6.607 2.629 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -13.269 -3.745 -0.475 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -11.678 -6.741 3.159 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -10.850 -3.833 0.090 1.00 0.00 H new ATOM 0 HZ PHE B 181 -10.056 -5.348 1.893 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.655 -1.832 1.323 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.101 -0.492 1.473 1.00 0.00 C ATOM 1380 C LEU B 182 -15.591 0.097 2.798 1.00 0.00 C ATOM 1381 O LEU B 182 -14.778 0.528 3.618 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.539 0.403 0.297 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.672 1.653 0.044 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.293 2.483 -1.078 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.508 2.574 1.257 1.00 0.00 C ATOM 0 H LEU B 182 -16.280 -1.924 0.522 1.00 0.00 H new ATOM 0 HA LEU B 182 -14.012 -0.543 1.473 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.546 -0.200 -0.611 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.565 0.726 0.473 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.684 1.270 -0.210 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.681 3.367 -1.258 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.343 1.885 -1.988 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.298 2.790 -0.790 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -13.884 3.425 0.986 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.487 2.930 1.579 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.036 2.023 2.071 1.00 0.00 H new ATOM 1397 N THR B 183 -16.909 0.127 3.015 1.00 0.00 N ATOM 1398 CA THR B 183 -17.476 0.682 4.232 1.00 0.00 C ATOM 1399 C THR B 183 -16.901 -0.013 5.464 1.00 0.00 C ATOM 1400 O THR B 183 -16.566 0.683 6.419 1.00 0.00 O ATOM 1401 CB THR B 183 -19.011 0.598 4.222 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.577 1.136 3.036 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.612 1.355 5.414 1.00 0.00 C ATOM 0 H THR B 183 -17.600 -0.230 2.356 1.00 0.00 H new ATOM 0 HA THR B 183 -17.202 1.736 4.276 1.00 0.00 H new ATOM 0 HB THR B 183 -19.250 -0.464 4.282 1.00 0.00 H new ATOM 0 HG1 THR B 183 -20.553 1.059 3.075 1.00 0.00 H new ATOM 0 HG21 THR B 183 -20.699 1.279 5.382 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.245 0.920 6.344 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.320 2.404 5.364 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.756 -1.345 5.459 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.226 -2.064 6.610 1.00 0.00 C ATOM 1413 C GLN B 184 -14.869 -1.488 7.000 1.00 0.00 C ATOM 1414 O GLN B 184 -14.660 -1.226 8.182 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.195 -3.577 6.370 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.613 -4.130 6.175 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.725 -5.591 6.586 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -17.904 -5.903 7.762 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.623 -6.500 5.634 1.00 0.00 N ATOM 0 H GLN B 184 -17.000 -1.940 4.668 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.896 -1.921 7.458 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.590 -3.797 5.490 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.720 -4.074 7.216 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.316 -3.536 6.759 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.900 -4.026 5.129 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -17.475 -6.211 4.667 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.693 -7.491 5.865 1.00 0.00 H new ATOM 1428 N LEU B 185 -13.972 -1.257 6.033 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.661 -0.664 6.301 1.00 0.00 C ATOM 1430 C LEU B 185 -12.804 0.675 7.013 1.00 0.00 C ATOM 1431 O LEU B 185 -12.109 0.926 7.996 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.850 -0.483 5.010 1.00 0.00 C ATOM 1433 CG LEU B 185 -10.943 -1.667 4.667 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.408 -1.460 3.244 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -9.782 -1.733 5.676 1.00 0.00 C ATOM 0 H LEU B 185 -14.135 -1.475 5.050 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.123 -1.354 6.950 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.539 -0.316 4.182 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.238 0.414 5.102 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.496 -2.605 4.719 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -9.757 -2.292 2.975 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.243 -1.412 2.545 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -9.843 -0.529 3.200 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.136 -2.576 5.432 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.206 -0.809 5.629 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.181 -1.861 6.682 1.00 0.00 H new ATOM 1447 N MET B 186 -13.701 1.537 6.533 1.00 0.00 N ATOM 1448 CA MET B 186 -13.922 2.851 7.129 1.00 0.00 C ATOM 1449 C MET B 186 -14.399 2.737 8.584 1.00 0.00 C ATOM 1450 O MET B 186 -14.260 3.692 9.341 1.00 0.00 O ATOM 1451 CB MET B 186 -14.908 3.675 6.285 1.00 0.00 C ATOM 1452 CG MET B 186 -14.421 3.828 4.836 1.00 0.00 C ATOM 1453 SD MET B 186 -15.443 4.884 3.773 1.00 0.00 S ATOM 1454 CE MET B 186 -14.820 6.503 4.283 1.00 0.00 C ATOM 0 H MET B 186 -14.291 1.344 5.724 1.00 0.00 H new ATOM 0 HA MET B 186 -12.966 3.375 7.141 1.00 0.00 H new ATOM 0 HB2 MET B 186 -15.885 3.193 6.292 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.036 4.661 6.733 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.409 4.231 4.853 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.362 2.837 4.385 1.00 0.00 H new ATOM 0 HE1 MET B 186 -15.339 7.284 3.728 1.00 0.00 H new ATOM 0 HE2 MET B 186 -14.993 6.640 5.350 1.00 0.00 H new ATOM 0 HE3 MET B 186 -13.751 6.562 4.079 1.00 0.00 H new ATOM 1464 N GLN B 187 -14.986 1.610 9.001 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.455 1.407 10.370 1.00 0.00 C ATOM 1466 C GLN B 187 -14.405 0.702 11.228 1.00 0.00 C ATOM 1467 O GLN B 187 -14.143 1.175 12.338 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.815 0.700 10.394 1.00 0.00 C ATOM 1469 CG GLN B 187 -17.904 1.327 9.498 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.267 2.788 9.768 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -19.435 3.119 9.944 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -17.344 3.736 9.747 1.00 0.00 N ATOM 0 H GLN B 187 -15.149 0.809 8.391 1.00 0.00 H new ATOM 0 HA GLN B 187 -15.606 2.388 10.820 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.672 -0.337 10.090 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -17.179 0.684 11.421 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -17.579 1.245 8.461 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -18.810 0.729 9.596 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -16.364 3.491 9.603 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -17.612 4.712 9.875 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.784 -0.382 10.748 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.762 -1.101 11.519 1.00 0.00 C ATOM 1483 C LYS B 188 -11.514 -0.252 11.755 1.00 0.00 C ATOM 1484 O LYS B 188 -10.781 -0.496 12.713 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.438 -2.478 10.926 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.764 -2.457 9.554 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.195 -3.825 9.176 1.00 0.00 C ATOM 1488 CE LYS B 188 -9.918 -4.148 9.941 1.00 0.00 C ATOM 1489 NZ LYS B 188 -9.419 -5.469 9.534 1.00 0.00 N ATOM 0 H LYS B 188 -13.971 -0.781 9.828 1.00 0.00 H new ATOM 0 HA LYS B 188 -13.193 -1.293 12.502 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.791 -3.012 11.622 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.363 -3.049 10.849 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.486 -2.143 8.800 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -10.963 -1.718 9.555 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -11.941 -4.595 9.376 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.991 -3.849 8.105 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -9.163 -3.387 9.745 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -10.112 -4.136 11.014 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -9.542 -6.143 10.316 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -9.951 -5.801 8.704 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -8.410 -5.400 9.293 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.290 0.765 10.920 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.160 1.680 11.015 1.00 0.00 C ATOM 1505 C GLU B 189 -10.645 3.114 11.253 1.00 0.00 C ATOM 1506 O GLU B 189 -9.929 4.067 10.940 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.263 1.546 9.768 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.461 0.241 9.736 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.242 0.257 10.663 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.312 0.784 11.797 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -6.197 -0.304 10.265 1.00 0.00 O ATOM 0 H GLU B 189 -11.910 0.977 10.138 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.548 1.415 11.877 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -9.884 1.605 8.874 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.573 2.389 9.733 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.113 -0.585 10.019 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -8.130 0.051 8.715 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.845 3.308 11.813 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.410 4.637 12.070 1.00 0.00 C ATOM 1520 C GLN B 190 -11.537 5.548 12.947 1.00 0.00 C ATOM 1521 O GLN B 190 -11.763 6.761 12.975 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.809 4.506 12.687 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.789 3.942 14.116 1.00 0.00 C ATOM 1524 CD GLN B 190 -15.204 3.725 14.621 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -15.721 4.522 15.400 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -15.851 2.663 14.177 1.00 0.00 N ATOM 0 H GLN B 190 -12.454 2.543 12.102 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.461 5.124 11.096 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -14.288 5.485 12.696 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.418 3.859 12.056 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -13.242 3.000 14.134 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.262 4.629 14.777 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.393 2.020 13.531 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -16.809 2.485 14.480 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.577 4.998 13.697 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.685 5.771 14.560 1.00 0.00 C ATOM 1537 C ARG B 191 -8.300 5.944 13.946 1.00 0.00 C ATOM 1538 O ARG B 191 -7.489 6.695 14.487 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.553 5.069 15.916 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.868 5.047 16.713 1.00 0.00 C ATOM 1541 CD ARG B 191 -10.635 4.848 18.214 1.00 0.00 C ATOM 1542 NE ARG B 191 -9.829 5.944 18.779 1.00 0.00 N ATOM 1543 CZ ARG B 191 -10.062 6.658 19.881 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -11.147 6.480 20.618 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -9.180 7.570 20.253 1.00 0.00 N ATOM 0 H ARG B 191 -10.397 3.994 13.721 1.00 0.00 H new ATOM 0 HA ARG B 191 -10.121 6.762 14.683 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.214 4.045 15.757 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -8.786 5.571 16.505 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -11.404 5.982 16.552 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.505 4.246 16.337 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -11.594 4.795 18.730 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -10.130 3.897 18.383 1.00 0.00 H new ATOM 0 HE ARG B 191 -8.985 6.188 18.261 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -11.837 5.779 20.349 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -11.293 7.044 21.455 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -8.336 7.719 19.700 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -9.343 8.125 21.093 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.976 5.211 12.888 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.694 5.260 12.198 1.00 0.00 C ATOM 1561 C ASN B 192 -6.750 6.371 11.153 1.00 0.00 C ATOM 1562 O ASN B 192 -7.842 6.681 10.666 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.469 3.874 11.588 1.00 0.00 C ATOM 1564 CG ASN B 192 -5.025 3.607 11.233 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -4.235 3.270 12.110 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.649 3.764 9.980 1.00 0.00 N ATOM 0 H ASN B 192 -8.623 4.541 12.472 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.859 5.489 12.859 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.810 3.115 12.292 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -7.081 3.775 10.692 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.677 3.605 9.715 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -5.330 4.045 9.275 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.616 6.952 10.760 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.586 8.026 9.759 1.00 0.00 C ATOM 1575 C TYR B 193 -5.020 7.575 8.411 1.00 0.00 C ATOM 1576 O TYR B 193 -5.261 8.237 7.415 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.739 9.200 10.279 1.00 0.00 C ATOM 1578 CG TYR B 193 -3.258 8.881 10.367 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -2.431 9.016 9.233 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.721 8.382 11.566 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -1.094 8.585 9.276 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.383 7.973 11.624 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.574 8.041 10.471 1.00 0.00 C ATOM 1584 OH TYR B 193 0.681 7.532 10.525 1.00 0.00 O ATOM 0 H TYR B 193 -4.697 6.696 11.122 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.621 8.328 9.600 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.880 10.059 9.623 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -5.100 9.490 11.266 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.827 9.452 8.328 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -3.343 8.314 12.446 1.00 0.00 H new ATOM 0 HE1 TYR B 193 -0.468 8.669 8.400 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -0.971 7.605 12.552 1.00 0.00 H new ATOM 0 HH TYR B 193 0.863 7.205 11.431 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.321 6.439 8.333 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.710 5.989 7.074 1.00 0.00 C ATOM 1596 C GLN B 194 -4.670 5.696 5.913 1.00 0.00 C ATOM 1597 O GLN B 194 -4.240 5.576 4.769 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.816 4.777 7.347 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.374 4.923 6.864 1.00 0.00 C ATOM 1600 CD GLN B 194 -1.192 5.427 5.434 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -1.228 6.627 5.202 1.00 0.00 O ATOM 1602 NE2 GLN B 194 -0.941 4.546 4.475 1.00 0.00 N ATOM 0 H GLN B 194 -4.163 5.814 9.123 1.00 0.00 H new ATOM 0 HA GLN B 194 -3.132 6.844 6.722 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.807 4.584 8.420 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.258 3.902 6.869 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -0.854 5.605 7.537 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.883 3.954 6.951 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -0.916 3.550 4.692 1.00 0.00 H new ATOM 0 HE22 GLN B 194 -0.773 4.865 3.521 1.00 0.00 H new ATOM 1611 N PHE B 195 -5.950 5.481 6.194 1.00 0.00 N ATOM 1612 CA PHE B 195 -6.990 5.221 5.199 1.00 0.00 C ATOM 1613 C PHE B 195 -7.874 6.460 5.036 1.00 0.00 C ATOM 1614 O PHE B 195 -8.972 6.354 4.489 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.825 3.979 5.539 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.055 2.681 5.610 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -6.748 1.995 4.421 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -6.662 2.149 6.851 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.056 0.775 4.478 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.985 0.921 6.906 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.698 0.223 5.719 1.00 0.00 C ATOM 0 H PHE B 195 -6.306 5.482 7.150 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.500 5.008 4.249 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -8.316 4.143 6.498 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.612 3.875 4.792 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -7.044 2.406 3.467 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -6.881 2.686 7.762 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -5.798 0.259 3.565 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -5.684 0.512 7.859 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.203 -0.736 5.762 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.442 7.627 5.524 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.191 8.874 5.419 1.00 0.00 C ATOM 1633 C ASP B 196 -8.476 9.248 3.961 1.00 0.00 C ATOM 1634 O ASP B 196 -9.413 10.010 3.712 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.521 10.014 6.197 1.00 0.00 C ATOM 1636 CG ASP B 196 -6.236 10.583 5.595 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -5.554 9.895 4.806 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -5.972 11.770 5.901 1.00 0.00 O ATOM 0 H ASP B 196 -6.550 7.729 6.009 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.159 8.707 5.891 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -8.240 10.827 6.299 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.299 9.657 7.203 1.00 0.00 H new ATOM 1643 N PHE B 197 -7.744 8.674 2.998 1.00 0.00 N ATOM 1644 CA PHE B 197 -7.940 8.899 1.572 1.00 0.00 C ATOM 1645 C PHE B 197 -9.302 8.345 1.127 1.00 0.00 C ATOM 1646 O PHE B 197 -9.818 8.733 0.077 1.00 0.00 O ATOM 1647 CB PHE B 197 -6.792 8.278 0.759 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.665 6.765 0.842 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.496 5.935 0.062 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -5.685 6.183 1.670 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.361 4.536 0.123 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -5.546 4.785 1.721 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.391 3.960 0.959 1.00 0.00 C ATOM 0 H PHE B 197 -6.983 8.026 3.200 1.00 0.00 H new ATOM 0 HA PHE B 197 -7.934 9.973 1.385 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -6.921 8.556 -0.287 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -5.854 8.721 1.093 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.240 6.375 -0.585 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.040 6.811 2.266 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.003 3.905 -0.473 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -4.786 4.343 2.349 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.294 2.886 1.016 1.00 0.00 H new ATOM 1663 N LEU B 198 -9.888 7.417 1.898 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.190 6.834 1.600 1.00 0.00 C ATOM 1665 C LEU B 198 -12.298 7.858 1.841 1.00 0.00 C ATOM 1666 O LEU B 198 -13.410 7.645 1.354 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.472 5.603 2.483 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.547 4.395 2.254 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.905 3.286 3.253 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.682 3.844 0.830 1.00 0.00 C ATOM 0 H LEU B 198 -9.463 7.052 2.750 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.173 6.530 0.553 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.396 5.903 3.528 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.502 5.286 2.316 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.519 4.726 2.398 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.252 2.428 3.094 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.776 3.657 4.270 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.942 2.984 3.106 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -10.014 2.992 0.705 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.711 3.527 0.659 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.417 4.621 0.113 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.044 8.921 2.615 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.023 9.958 2.909 1.00 0.00 C ATOM 1684 C ARG B 199 -12.895 11.081 1.882 1.00 0.00 C ATOM 1685 O ARG B 199 -11.779 11.405 1.480 1.00 0.00 O ATOM 1686 CB ARG B 199 -12.776 10.548 4.306 1.00 0.00 C ATOM 1687 CG ARG B 199 -12.921 9.525 5.443 1.00 0.00 C ATOM 1688 CD ARG B 199 -12.895 10.213 6.813 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.052 11.109 6.971 1.00 0.00 N ATOM 1690 CZ ARG B 199 -14.375 11.808 8.057 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -13.591 11.862 9.128 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -15.535 12.449 8.065 1.00 0.00 N ATOM 0 H ARG B 199 -11.139 9.081 3.057 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.019 9.516 2.871 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -11.773 10.974 4.339 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.476 11.366 4.474 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -13.856 8.977 5.326 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.114 8.795 5.384 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -12.901 9.461 7.602 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -11.972 10.782 6.922 1.00 0.00 H new ATOM 0 HE ARG B 199 -14.670 11.204 6.165 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -12.705 11.356 9.138 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -13.875 12.409 9.941 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -16.151 12.398 7.254 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -15.811 12.993 8.882 1.00 0.00 H new ATOM 1706 N PRO B 200 -13.997 11.769 1.536 1.00 0.00 N ATOM 1707 CA PRO B 200 -13.989 12.866 0.571 1.00 0.00 C ATOM 1708 C PRO B 200 -13.154 14.072 1.016 1.00 0.00 C ATOM 1709 O PRO B 200 -12.894 14.974 0.220 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.455 13.233 0.357 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.156 12.729 1.613 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.356 11.480 1.956 1.00 0.00 C ATOM 0 HA PRO B 200 -13.508 12.550 -0.355 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.582 14.309 0.235 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.857 12.761 -0.540 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.126 13.464 2.417 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.206 12.501 1.428 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.401 11.265 3.024 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.750 10.606 1.438 1.00 0.00 H new ATOM 1720 N GLN B 201 -12.749 14.111 2.284 1.00 0.00 N ATOM 1721 CA GLN B 201 -11.925 15.153 2.880 1.00 0.00 C ATOM 1722 C GLN B 201 -10.525 15.170 2.248 1.00 0.00 C ATOM 1723 O GLN B 201 -9.837 16.184 2.350 1.00 0.00 O ATOM 1724 CB GLN B 201 -11.782 14.868 4.388 1.00 0.00 C ATOM 1725 CG GLN B 201 -12.712 15.663 5.308 1.00 0.00 C ATOM 1726 CD GLN B 201 -14.174 15.224 5.313 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -14.750 14.832 4.298 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -14.837 15.317 6.451 1.00 0.00 N ATOM 0 H GLN B 201 -13.000 13.382 2.952 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.401 16.119 2.709 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -11.957 13.805 4.556 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -10.752 15.071 4.681 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -12.329 15.597 6.326 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -12.668 16.713 5.019 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -14.362 15.642 7.293 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -15.825 15.064 6.488 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.100 14.092 1.587 1.00 0.00 N ATOM 1738 CA HIS B 202 -8.788 13.990 0.972 1.00 0.00 C ATOM 1739 C HIS B 202 -8.853 14.185 -0.538 1.00 0.00 C ATOM 1740 O HIS B 202 -9.708 13.596 -1.193 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.265 12.577 1.264 1.00 0.00 C ATOM 1742 CG HIS B 202 -6.767 12.467 1.352 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -5.824 12.966 0.477 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.100 11.916 2.408 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -4.613 12.731 1.003 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -4.738 12.109 2.183 1.00 0.00 N ATOM 0 H HIS B 202 -10.671 13.256 1.466 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.138 14.766 1.377 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -8.697 12.231 2.203 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.620 11.904 0.483 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -6.545 11.422 3.259 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -3.675 13.003 0.543 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -3.977 11.829 2.802 1.00 0.00 H new ATOM 1754 N SER B 203 -7.885 14.895 -1.122 1.00 0.00 N ATOM 1755 CA SER B 203 -7.811 15.124 -2.569 1.00 0.00 C ATOM 1756 C SER B 203 -7.610 13.810 -3.343 1.00 0.00 C ATOM 1757 O SER B 203 -7.849 13.736 -4.551 1.00 0.00 O ATOM 1758 CB SER B 203 -6.644 16.071 -2.854 1.00 0.00 C ATOM 1759 OG SER B 203 -6.771 17.264 -2.106 1.00 0.00 O ATOM 0 H SER B 203 -7.124 15.331 -0.601 1.00 0.00 H new ATOM 0 HA SER B 203 -8.753 15.561 -2.901 1.00 0.00 H new ATOM 0 HB2 SER B 203 -5.703 15.580 -2.607 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.612 16.305 -3.918 1.00 0.00 H new ATOM 0 HG SER B 203 -6.014 17.855 -2.302 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.128 12.772 -2.649 1.00 0.00 N ATOM 1766 CA LEU B 204 -6.885 11.446 -3.190 1.00 0.00 C ATOM 1767 C LEU B 204 -8.199 10.707 -3.415 1.00 0.00 C ATOM 1768 O LEU B 204 -8.226 9.777 -4.219 1.00 0.00 O ATOM 1769 CB LEU B 204 -6.014 10.632 -2.217 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.538 11.056 -2.150 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.830 10.179 -1.111 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.853 10.941 -3.519 1.00 0.00 C ATOM 0 H LEU B 204 -6.891 12.844 -1.660 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.369 11.558 -4.144 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.444 10.709 -1.218 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.061 9.581 -2.504 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.479 12.104 -1.857 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.780 10.465 -1.049 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.302 10.315 -0.138 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.904 9.133 -1.407 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.811 11.249 -3.432 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -3.898 9.908 -3.863 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.363 11.584 -4.236 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.282 11.113 -2.747 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.588 10.486 -2.874 1.00 0.00 C ATOM 1786 C PHE B 205 -11.011 10.445 -4.336 1.00 0.00 C ATOM 1787 O PHE B 205 -11.410 9.388 -4.825 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.598 11.257 -2.026 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.009 10.713 -2.070 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.412 9.731 -1.149 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.942 11.248 -2.976 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -14.752 9.303 -1.116 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -15.271 10.803 -2.956 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.680 9.831 -2.028 1.00 0.00 C ATOM 0 H PHE B 205 -9.270 11.898 -2.095 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.542 9.458 -2.515 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.256 11.259 -0.991 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.613 12.295 -2.358 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -12.692 9.304 -0.466 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -13.635 12.001 -3.687 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.067 8.569 -0.389 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.984 11.210 -3.658 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.705 9.491 -2.016 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.857 11.559 -5.067 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.228 11.629 -6.479 1.00 0.00 C ATOM 1806 C ASN B 206 -10.422 10.673 -7.364 1.00 0.00 C ATOM 1807 O ASN B 206 -10.881 10.341 -8.461 1.00 0.00 O ATOM 1808 CB ASN B 206 -11.130 13.060 -7.012 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.519 13.633 -7.244 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -13.094 13.442 -8.311 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -13.085 14.291 -6.250 1.00 0.00 N ATOM 0 H ASN B 206 -10.474 12.428 -4.695 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.267 11.305 -6.528 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -10.586 13.683 -6.302 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.565 13.070 -7.944 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -14.030 14.659 -6.355 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -12.577 14.431 -5.377 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.211 10.275 -6.960 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.382 9.338 -7.717 1.00 0.00 C ATOM 1820 C TYR B 207 -8.730 7.912 -7.260 1.00 0.00 C ATOM 1821 O TYR B 207 -8.688 6.975 -8.052 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.898 9.675 -7.498 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.914 8.617 -7.964 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.643 8.431 -9.332 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -5.260 7.813 -7.012 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.728 7.444 -9.744 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.351 6.820 -7.413 1.00 0.00 C ATOM 1828 CZ TYR B 207 -4.071 6.640 -8.787 1.00 0.00 C ATOM 1829 OH TYR B 207 -3.157 5.712 -9.192 1.00 0.00 O ATOM 0 H TYR B 207 -8.778 10.597 -6.094 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.574 9.414 -8.787 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.675 10.608 -8.016 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.737 9.854 -6.435 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -6.138 9.047 -10.068 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.459 7.961 -5.961 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -4.528 7.301 -10.796 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.868 6.197 -6.675 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.628 5.416 -8.422 1.00 0.00 H new ATOM 1839 N PHE B 208 -9.106 7.724 -5.996 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.486 6.421 -5.484 1.00 0.00 C ATOM 1841 C PHE B 208 -10.795 6.008 -6.167 1.00 0.00 C ATOM 1842 O PHE B 208 -10.845 4.951 -6.791 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.600 6.470 -3.953 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.276 5.250 -3.356 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -11.681 5.211 -3.264 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -9.525 4.126 -2.964 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -12.328 4.050 -2.816 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -10.174 2.980 -2.474 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.576 2.941 -2.397 1.00 0.00 C ATOM 0 H PHE B 208 -9.154 8.472 -5.305 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.729 5.670 -5.709 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.602 6.568 -3.525 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -10.158 7.361 -3.667 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -12.262 6.078 -3.540 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -8.448 4.144 -3.040 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -13.407 4.009 -2.793 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -9.593 2.127 -2.156 1.00 0.00 H new ATOM 0 HZ PHE B 208 -12.074 2.061 -2.017 1.00 0.00 H new ATOM 1859 N THR B 209 -11.835 6.847 -6.101 1.00 0.00 N ATOM 1860 CA THR B 209 -13.139 6.565 -6.698 1.00 0.00 C ATOM 1861 C THR B 209 -13.004 6.261 -8.192 1.00 0.00 C ATOM 1862 O THR B 209 -13.520 5.242 -8.643 1.00 0.00 O ATOM 1863 CB THR B 209 -14.135 7.694 -6.355 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.457 7.348 -6.704 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.826 9.032 -7.031 1.00 0.00 C ATOM 0 H THR B 209 -11.791 7.749 -5.626 1.00 0.00 H new ATOM 0 HA THR B 209 -13.559 5.657 -6.265 1.00 0.00 H new ATOM 0 HB THR B 209 -14.028 7.815 -5.277 1.00 0.00 H new ATOM 0 HG1 THR B 209 -16.060 8.085 -6.471 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.573 9.769 -6.737 1.00 0.00 H new ATOM 0 HG22 THR B 209 -12.838 9.375 -6.725 1.00 0.00 H new ATOM 0 HG23 THR B 209 -13.847 8.906 -8.114 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.249 7.068 -8.955 1.00 0.00 N ATOM 1874 CA LYS B 210 -12.087 6.834 -10.391 1.00 0.00 C ATOM 1875 C LYS B 210 -11.538 5.436 -10.675 1.00 0.00 C ATOM 1876 O LYS B 210 -11.931 4.809 -11.654 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.259 7.956 -11.044 1.00 0.00 C ATOM 1878 CG LYS B 210 -9.742 7.823 -10.936 1.00 0.00 C ATOM 1879 CD LYS B 210 -8.982 8.752 -11.876 1.00 0.00 C ATOM 1880 CE LYS B 210 -9.084 8.197 -13.299 1.00 0.00 C ATOM 1881 NZ LYS B 210 -8.068 8.781 -14.190 1.00 0.00 N ATOM 0 H LYS B 210 -11.746 7.882 -8.601 1.00 0.00 H new ATOM 0 HA LYS B 210 -13.072 6.867 -10.856 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -11.524 8.008 -12.100 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.553 8.905 -10.595 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -9.439 8.030 -9.910 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -9.459 6.792 -11.150 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -9.398 9.758 -11.832 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -7.938 8.826 -11.573 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -8.967 7.114 -13.275 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -10.078 8.401 -13.698 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -8.171 8.379 -15.144 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -8.195 9.812 -14.233 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -7.119 8.564 -13.824 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.616 4.946 -9.838 1.00 0.00 N ATOM 1896 CA LEU B 211 -10.048 3.624 -10.028 1.00 0.00 C ATOM 1897 C LEU B 211 -11.131 2.581 -9.790 1.00 0.00 C ATOM 1898 O LEU B 211 -11.167 1.602 -10.529 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.853 3.372 -9.095 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.561 4.117 -9.467 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.527 3.866 -8.361 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.978 3.667 -10.811 1.00 0.00 C ATOM 0 H LEU B 211 -10.254 5.450 -9.028 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.676 3.553 -11.050 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.138 3.656 -8.082 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.644 2.302 -9.079 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.801 5.176 -9.563 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.600 4.386 -8.604 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.913 4.237 -7.411 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.332 2.797 -8.281 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -6.067 4.229 -11.019 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.746 2.603 -10.769 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.705 3.849 -11.602 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.987 2.751 -8.777 1.00 0.00 N ATOM 1915 CA VAL B 212 -13.046 1.790 -8.499 1.00 0.00 C ATOM 1916 C VAL B 212 -13.988 1.759 -9.693 1.00 0.00 C ATOM 1917 O VAL B 212 -14.217 0.685 -10.233 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.795 2.118 -7.193 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.865 1.062 -6.882 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.830 2.188 -6.003 1.00 0.00 C ATOM 0 H VAL B 212 -11.963 3.547 -8.139 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.608 0.803 -8.351 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.270 3.088 -7.341 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.375 1.323 -5.955 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.589 1.026 -7.696 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.392 0.086 -6.774 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.387 2.421 -5.096 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.329 1.228 -5.884 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -12.087 2.965 -6.182 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.476 2.914 -10.149 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.395 3.033 -11.275 1.00 0.00 C ATOM 1932 C GLU B 213 -14.811 2.345 -12.517 1.00 0.00 C ATOM 1933 O GLU B 213 -15.522 1.625 -13.222 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.692 4.522 -11.532 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.348 5.238 -10.339 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.829 4.906 -10.171 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.149 3.906 -9.490 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -18.682 5.688 -10.662 1.00 0.00 O ATOM 0 H GLU B 213 -14.235 3.813 -9.733 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.334 2.531 -11.041 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -14.761 5.031 -11.782 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.346 4.608 -12.400 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.817 4.968 -9.426 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.237 6.315 -10.466 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.512 2.522 -12.778 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.811 1.922 -13.906 1.00 0.00 C ATOM 1947 C GLN B 214 -12.657 0.402 -13.727 1.00 0.00 C ATOM 1948 O GLN B 214 -12.658 -0.347 -14.713 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.429 2.594 -13.997 1.00 0.00 C ATOM 1950 CG GLN B 214 -10.497 1.958 -15.037 1.00 0.00 C ATOM 1951 CD GLN B 214 -9.124 2.611 -15.045 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -8.734 3.278 -16.006 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.354 2.436 -13.982 1.00 0.00 N ATOM 0 H GLN B 214 -12.909 3.101 -12.194 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.381 2.076 -14.822 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.563 3.648 -14.240 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.950 2.551 -13.019 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -10.391 0.894 -14.827 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -10.945 2.044 -16.027 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -8.690 1.882 -13.194 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -7.425 2.856 -13.951 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.460 -0.060 -12.491 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.278 -1.467 -12.176 1.00 0.00 C ATOM 1964 C TYR B 215 -13.600 -2.229 -12.056 1.00 0.00 C ATOM 1965 O TYR B 215 -13.602 -3.437 -12.322 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.398 -1.619 -10.928 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.957 -1.130 -11.030 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -9.258 -1.086 -12.256 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.306 -0.712 -9.853 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.926 -0.639 -12.299 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.971 -0.276 -9.884 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.272 -0.256 -11.109 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.958 0.083 -11.146 1.00 0.00 O ATOM 0 H TYR B 215 -12.423 0.547 -11.672 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.761 -1.929 -13.017 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.879 -1.086 -10.108 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.379 -2.674 -10.654 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.749 -1.398 -13.166 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.840 -0.727 -8.914 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -7.403 -0.589 -13.243 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.482 0.042 -8.975 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.657 0.323 -10.245 1.00 0.00 H new ATOM 1983 N THR B 216 -14.708 -1.576 -11.704 1.00 0.00 N ATOM 1984 CA THR B 216 -16.008 -2.229 -11.597 1.00 0.00 C ATOM 1985 C THR B 216 -16.496 -2.649 -12.985 1.00 0.00 C ATOM 1986 O THR B 216 -15.955 -2.214 -14.010 1.00 0.00 O ATOM 1987 CB THR B 216 -17.040 -1.289 -10.949 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.961 0.050 -11.406 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.896 -1.283 -9.434 1.00 0.00 C ATOM 0 H THR B 216 -14.727 -0.580 -11.486 1.00 0.00 H new ATOM 0 HA THR B 216 -15.897 -3.112 -10.967 1.00 0.00 H new ATOM 0 HB THR B 216 -18.010 -1.688 -11.247 1.00 0.00 H new ATOM 0 HG1 THR B 216 -16.380 0.093 -12.194 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.637 -0.611 -9.001 1.00 0.00 H new ATOM 0 HG22 THR B 216 -17.052 -2.291 -9.050 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.896 -0.943 -9.165 1.00 0.00 H new