USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=12 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 1:sc= -1.14 USER MOD Set 1.2: B 188 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.093) USER MOD Single : A 86 ASN : amide:sc= -0.0173 K(o=-0.017,f=-1.1) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.363 X(o=-0.36,f=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot -27:sc= 0.395 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 170 THR OG1 : rot -72:sc= 0.617 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 177 ASN : amide:sc= 1.14 K(o=1.1,f=-1.1) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=-0.14) 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 171:sc= 0 (180deg=-0.14) USER MOD Single : B 187 GLN : amide:sc= -0.0158 X(o=-0.016,f=-0.016) USER MOD Single : B 190 GLN : amide:sc= -0.0601 X(o=-0.06,f=0) USER MOD Single : B 192 ASN : amide:sc= 0.556 K(o=0.56,f=-2!) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 0.252 X(o=0.25,f=0) USER MOD Single : B 201 GLN : amide:sc= -0.0214 X(o=-0.021,f=-0.21) USER MOD Single : B 202 HIS : no HD1:sc= -0.082 K(o=-0.082,f=-0.72) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= -0.151 X(o=-0.15,f=0) USER MOD Single : B 207 TYR OH : rot 130: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= -0.542 X(o=-0.54,f=-0.47) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 26:sc= -0.115 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.201 -12.680 2.545 1.00 0.00 N ATOM 132 CA GLU A 80 -10.886 -11.479 1.785 1.00 0.00 C ATOM 133 C GLU A 80 -9.955 -10.578 2.600 1.00 0.00 C ATOM 134 O GLU A 80 -8.954 -10.090 2.074 1.00 0.00 O ATOM 135 CB GLU A 80 -12.203 -10.778 1.433 1.00 0.00 C ATOM 136 CG GLU A 80 -12.891 -11.461 0.253 1.00 0.00 C ATOM 137 CD GLU A 80 -12.036 -11.399 -1.017 1.00 0.00 C ATOM 138 OE1 GLU A 80 -11.392 -10.353 -1.281 1.00 0.00 O ATOM 139 OE2 GLU A 80 -11.952 -12.430 -1.723 1.00 0.00 O ATOM 0 HA GLU A 80 -10.363 -11.726 0.861 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.865 -10.786 2.299 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -12.009 -9.733 1.190 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -13.095 -12.502 0.504 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -13.853 -10.984 0.067 1.00 0.00 H new ATOM 146 N PHE A 81 -10.260 -10.364 3.886 1.00 0.00 N ATOM 147 CA PHE A 81 -9.405 -9.528 4.729 1.00 0.00 C ATOM 148 C PHE A 81 -7.985 -10.102 4.825 1.00 0.00 C ATOM 149 O PHE A 81 -7.045 -9.330 5.001 1.00 0.00 O ATOM 150 CB PHE A 81 -10.005 -9.337 6.131 1.00 0.00 C ATOM 151 CG PHE A 81 -11.034 -8.224 6.234 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.645 -6.897 5.973 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.369 -8.496 6.599 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.586 -5.858 6.052 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.307 -7.450 6.687 1.00 0.00 C ATOM 156 CZ PHE A 81 -12.916 -6.127 6.418 1.00 0.00 C ATOM 0 H PHE A 81 -11.078 -10.751 4.356 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.346 -8.549 4.254 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.469 -10.273 6.444 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.196 -9.132 6.833 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.620 -6.677 5.711 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.673 -9.510 6.812 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.286 -4.845 5.830 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.329 -7.665 6.962 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.633 -5.323 6.492 1.00 0.00 H new ATOM 166 N ALA A 82 -7.820 -11.428 4.733 1.00 0.00 N ATOM 167 CA ALA A 82 -6.522 -12.078 4.802 1.00 0.00 C ATOM 168 C ALA A 82 -5.669 -11.615 3.630 1.00 0.00 C ATOM 169 O ALA A 82 -4.545 -11.165 3.831 1.00 0.00 O ATOM 170 CB ALA A 82 -6.669 -13.608 4.768 1.00 0.00 C ATOM 0 H ALA A 82 -8.596 -12.078 4.608 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.043 -11.805 5.742 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.683 -14.070 4.821 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.269 -13.935 5.617 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.160 -13.906 3.841 1.00 0.00 H new ATOM 176 N GLU A 83 -6.222 -11.736 2.423 1.00 0.00 N ATOM 177 CA GLU A 83 -5.581 -11.349 1.180 1.00 0.00 C ATOM 178 C GLU A 83 -5.232 -9.864 1.221 1.00 0.00 C ATOM 179 O GLU A 83 -4.092 -9.486 0.961 1.00 0.00 O ATOM 180 CB GLU A 83 -6.544 -11.664 0.026 1.00 0.00 C ATOM 181 CG GLU A 83 -5.971 -11.262 -1.340 1.00 0.00 C ATOM 182 CD GLU A 83 -4.827 -12.166 -1.778 1.00 0.00 C ATOM 183 OE1 GLU A 83 -5.028 -13.405 -1.785 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.717 -11.670 -2.056 1.00 0.00 O ATOM 0 H GLU A 83 -7.158 -12.119 2.286 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.653 -11.903 1.034 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.767 -12.731 0.024 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.486 -11.141 0.190 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.764 -11.295 -2.088 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.619 -10.231 -1.294 1.00 0.00 H new ATOM 191 N PHE A 84 -6.201 -9.025 1.588 1.00 0.00 N ATOM 192 CA PHE A 84 -6.016 -7.587 1.666 1.00 0.00 C ATOM 193 C PHE A 84 -4.819 -7.239 2.560 1.00 0.00 C ATOM 194 O PHE A 84 -3.888 -6.560 2.120 1.00 0.00 O ATOM 195 CB PHE A 84 -7.310 -6.939 2.165 1.00 0.00 C ATOM 196 CG PHE A 84 -7.216 -5.435 2.251 1.00 0.00 C ATOM 197 CD1 PHE A 84 -7.103 -4.685 1.067 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.188 -4.787 3.502 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.961 -3.291 1.133 1.00 0.00 C ATOM 200 CE2 PHE A 84 -7.065 -3.389 3.561 1.00 0.00 C ATOM 201 CZ PHE A 84 -6.952 -2.641 2.377 1.00 0.00 C ATOM 0 H PHE A 84 -7.140 -9.332 1.840 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.793 -7.193 0.675 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -8.128 -7.210 1.497 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.556 -7.340 3.148 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -7.126 -5.181 0.108 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.261 -5.363 4.412 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.858 -2.716 0.224 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.057 -2.888 4.518 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.858 -1.566 2.424 1.00 0.00 H new ATOM 211 N TYR A 85 -4.816 -7.713 3.810 1.00 0.00 N ATOM 212 CA TYR A 85 -3.716 -7.436 4.722 1.00 0.00 C ATOM 213 C TYR A 85 -2.402 -8.085 4.249 1.00 0.00 C ATOM 214 O TYR A 85 -1.345 -7.490 4.468 1.00 0.00 O ATOM 215 CB TYR A 85 -4.099 -7.810 6.156 1.00 0.00 C ATOM 216 CG TYR A 85 -4.998 -6.797 6.855 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.540 -5.482 7.089 1.00 0.00 C ATOM 218 CD2 TYR A 85 -6.276 -7.173 7.313 1.00 0.00 C ATOM 219 CE1 TYR A 85 -5.331 -4.571 7.816 1.00 0.00 C ATOM 220 CE2 TYR A 85 -7.087 -6.258 8.008 1.00 0.00 C ATOM 221 CZ TYR A 85 -6.604 -4.961 8.291 1.00 0.00 C ATOM 222 OH TYR A 85 -7.381 -4.116 9.026 1.00 0.00 O ATOM 0 H TYR A 85 -5.561 -8.286 4.206 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.525 -6.363 4.718 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.603 -8.776 6.144 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.188 -7.933 6.742 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.578 -5.173 6.708 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.637 -8.174 7.129 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -4.965 -3.574 8.011 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -8.078 -6.547 8.325 1.00 0.00 H new ATOM 0 HH TYR A 85 -6.918 -3.259 9.137 1.00 0.00 H new ATOM 232 N ASN A 86 -2.429 -9.244 3.576 1.00 0.00 N ATOM 233 CA ASN A 86 -1.240 -9.919 3.061 1.00 0.00 C ATOM 234 C ASN A 86 -0.596 -8.998 2.017 1.00 0.00 C ATOM 235 O ASN A 86 0.602 -8.715 2.094 1.00 0.00 O ATOM 236 CB ASN A 86 -1.608 -11.279 2.437 1.00 0.00 C ATOM 237 CG ASN A 86 -1.716 -12.452 3.409 1.00 0.00 C ATOM 238 OD1 ASN A 86 -1.158 -12.444 4.510 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.403 -13.515 3.021 1.00 0.00 N ATOM 0 H ASN A 86 -3.295 -9.743 3.373 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.540 -10.118 3.872 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.561 -11.173 1.919 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.860 -11.525 1.683 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.472 -14.329 3.632 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.864 -13.520 2.111 1.00 0.00 H new ATOM 246 N ARG A 87 -1.389 -8.493 1.062 1.00 0.00 N ATOM 247 CA ARG A 87 -0.925 -7.580 0.017 1.00 0.00 C ATOM 248 C ARG A 87 -0.397 -6.302 0.672 1.00 0.00 C ATOM 249 O ARG A 87 0.645 -5.792 0.258 1.00 0.00 O ATOM 250 CB ARG A 87 -2.073 -7.268 -0.961 1.00 0.00 C ATOM 251 CG ARG A 87 -2.494 -8.418 -1.896 1.00 0.00 C ATOM 252 CD ARG A 87 -1.442 -8.844 -2.934 1.00 0.00 C ATOM 253 NE ARG A 87 -0.919 -7.705 -3.711 1.00 0.00 N ATOM 254 CZ ARG A 87 -1.350 -7.220 -4.883 1.00 0.00 C ATOM 255 NH1 ARG A 87 -2.303 -7.833 -5.579 1.00 0.00 N ATOM 256 NH2 ARG A 87 -0.829 -6.100 -5.364 1.00 0.00 N ATOM 0 H ARG A 87 -2.383 -8.712 0.996 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.120 -8.044 -0.552 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.943 -6.960 -0.382 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.780 -6.416 -1.574 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.749 -9.284 -1.286 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.401 -8.121 -2.423 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -0.616 -9.342 -2.426 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -1.883 -9.572 -3.615 1.00 0.00 H new ATOM 0 HE ARG A 87 -0.121 -7.221 -3.300 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -2.722 -8.692 -5.223 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -2.615 -7.444 -6.469 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.102 -5.610 -4.842 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.155 -5.728 -6.256 1.00 0.00 H new ATOM 270 N LEU A 88 -1.077 -5.780 1.702 1.00 0.00 N ATOM 271 CA LEU A 88 -0.631 -4.577 2.405 1.00 0.00 C ATOM 272 C LEU A 88 0.746 -4.785 3.014 1.00 0.00 C ATOM 273 O LEU A 88 1.593 -3.903 2.895 1.00 0.00 O ATOM 274 CB LEU A 88 -1.606 -4.168 3.518 1.00 0.00 C ATOM 275 CG LEU A 88 -2.691 -3.191 3.070 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.805 -3.148 4.115 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.080 -1.788 2.949 1.00 0.00 C ATOM 0 H LEU A 88 -1.943 -6.178 2.066 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.592 -3.780 1.663 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.081 -5.064 3.917 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.041 -3.717 4.334 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.096 -3.514 2.111 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.578 -2.450 3.794 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.237 -4.142 4.227 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.395 -2.821 5.070 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -2.848 -1.083 2.629 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.684 -1.479 3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.274 -1.804 2.215 1.00 0.00 H new ATOM 289 N LYS A 89 0.960 -5.918 3.699 1.00 0.00 N ATOM 290 CA LYS A 89 2.240 -6.251 4.325 1.00 0.00 C ATOM 291 C LYS A 89 3.336 -6.116 3.272 1.00 0.00 C ATOM 292 O LYS A 89 4.325 -5.435 3.538 1.00 0.00 O ATOM 293 CB LYS A 89 2.162 -7.660 4.941 1.00 0.00 C ATOM 294 CG LYS A 89 3.517 -8.222 5.420 1.00 0.00 C ATOM 295 CD LYS A 89 3.653 -9.728 5.173 1.00 0.00 C ATOM 296 CE LYS A 89 3.714 -10.068 3.672 1.00 0.00 C ATOM 297 NZ LYS A 89 3.765 -11.524 3.450 1.00 0.00 N ATOM 0 H LYS A 89 0.243 -6.631 3.833 1.00 0.00 H new ATOM 0 HA LYS A 89 2.476 -5.569 5.142 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.473 -7.637 5.785 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.739 -8.343 4.204 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.324 -7.699 4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.633 -8.021 6.485 1.00 0.00 H new ATOM 0 HD2 LYS A 89 4.554 -10.095 5.664 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.809 -10.247 5.627 1.00 0.00 H new ATOM 0 HE2 LYS A 89 2.842 -9.652 3.168 1.00 0.00 H new ATOM 0 HE3 LYS A 89 4.592 -9.600 3.227 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 3.805 -11.718 2.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 4.611 -11.916 3.911 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 2.915 -11.967 3.853 1.00 0.00 H new ATOM 311 N GLN A 90 3.142 -6.737 2.105 1.00 0.00 N ATOM 312 CA GLN A 90 4.089 -6.690 1.004 1.00 0.00 C ATOM 313 C GLN A 90 4.491 -5.244 0.696 1.00 0.00 C ATOM 314 O GLN A 90 5.682 -4.945 0.707 1.00 0.00 O ATOM 315 CB GLN A 90 3.493 -7.391 -0.232 1.00 0.00 C ATOM 316 CG GLN A 90 4.098 -8.773 -0.493 1.00 0.00 C ATOM 317 CD GLN A 90 3.808 -9.334 -1.889 1.00 0.00 C ATOM 318 OE1 GLN A 90 4.411 -10.332 -2.284 1.00 0.00 O ATOM 319 NE2 GLN A 90 2.938 -8.734 -2.692 1.00 0.00 N ATOM 0 H GLN A 90 2.310 -7.292 1.903 1.00 0.00 H new ATOM 0 HA GLN A 90 4.995 -7.223 1.291 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.416 -7.492 -0.100 1.00 0.00 H new ATOM 0 HB3 GLN A 90 3.649 -6.762 -1.109 1.00 0.00 H new ATOM 0 HG2 GLN A 90 5.178 -8.716 -0.354 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.717 -9.471 0.253 1.00 0.00 H new ATOM 0 HE21 GLN A 90 2.435 -7.907 -2.372 1.00 0.00 H new ATOM 0 HE22 GLN A 90 2.773 -9.100 -3.630 1.00 0.00 H new ATOM 328 N ILE A 91 3.527 -4.332 0.511 1.00 0.00 N ATOM 329 CA ILE A 91 3.797 -2.925 0.198 1.00 0.00 C ATOM 330 C ILE A 91 4.750 -2.310 1.229 1.00 0.00 C ATOM 331 O ILE A 91 5.717 -1.641 0.848 1.00 0.00 O ATOM 332 CB ILE A 91 2.480 -2.117 0.074 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.605 -2.671 -1.073 1.00 0.00 C ATOM 334 CG2 ILE A 91 2.742 -0.613 -0.159 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.182 -2.105 -1.079 1.00 0.00 C ATOM 0 H ILE A 91 2.533 -4.552 0.575 1.00 0.00 H new ATOM 0 HA ILE A 91 4.293 -2.881 -0.772 1.00 0.00 H new ATOM 0 HB ILE A 91 1.952 -2.227 1.021 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.082 -2.444 -2.026 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.556 -3.757 -0.991 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.791 -0.086 -0.240 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.311 -0.209 0.678 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.309 -0.481 -1.080 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.377 -2.536 -1.909 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.313 -2.354 -0.140 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.222 -1.022 -1.192 1.00 0.00 H new ATOM 347 N LYS A 92 4.484 -2.516 2.525 1.00 0.00 N ATOM 348 CA LYS A 92 5.323 -1.958 3.582 1.00 0.00 C ATOM 349 C LYS A 92 6.730 -2.558 3.542 1.00 0.00 C ATOM 350 O LYS A 92 7.719 -1.828 3.573 1.00 0.00 O ATOM 351 CB LYS A 92 4.701 -2.142 4.982 1.00 0.00 C ATOM 352 CG LYS A 92 3.197 -1.840 5.114 1.00 0.00 C ATOM 353 CD LYS A 92 2.809 -1.585 6.583 1.00 0.00 C ATOM 354 CE LYS A 92 1.519 -0.777 6.784 1.00 0.00 C ATOM 355 NZ LYS A 92 0.305 -1.389 6.216 1.00 0.00 N ATOM 0 H LYS A 92 3.694 -3.065 2.862 1.00 0.00 H new ATOM 0 HA LYS A 92 5.393 -0.887 3.393 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.871 -3.172 5.297 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.240 -1.502 5.681 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.944 -0.968 4.511 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.619 -2.677 4.722 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.700 -2.546 7.086 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.629 -1.060 7.073 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.366 -0.626 7.853 1.00 0.00 H new ATOM 0 HE3 LYS A 92 1.653 0.209 6.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.513 -0.774 6.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.424 -1.508 5.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.146 -2.318 6.656 1.00 0.00 H new ATOM 1028 N SER B 160 3.118 9.565 -2.538 1.00 0.00 N ATOM 1029 CA SER B 160 4.283 8.700 -2.483 1.00 0.00 C ATOM 1030 C SER B 160 3.962 7.344 -3.125 1.00 0.00 C ATOM 1031 O SER B 160 2.793 7.005 -3.326 1.00 0.00 O ATOM 1032 CB SER B 160 4.678 8.550 -1.009 1.00 0.00 C ATOM 1033 OG SER B 160 3.545 8.327 -0.186 1.00 0.00 O ATOM 0 HA SER B 160 5.116 9.127 -3.041 1.00 0.00 H new ATOM 0 HB2 SER B 160 5.376 7.720 -0.901 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.198 9.449 -0.678 1.00 0.00 H new ATOM 0 HG SER B 160 2.753 8.722 -0.606 1.00 0.00 H new ATOM 1039 N ALA B 161 4.990 6.541 -3.423 1.00 0.00 N ATOM 1040 CA ALA B 161 4.814 5.220 -4.023 1.00 0.00 C ATOM 1041 C ALA B 161 4.057 4.289 -3.070 1.00 0.00 C ATOM 1042 O ALA B 161 3.245 3.482 -3.520 1.00 0.00 O ATOM 1043 CB ALA B 161 6.176 4.620 -4.379 1.00 0.00 C ATOM 0 H ALA B 161 5.964 6.791 -3.254 1.00 0.00 H new ATOM 0 HA ALA B 161 4.226 5.329 -4.934 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.035 3.636 -4.825 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.686 5.271 -5.089 1.00 0.00 H new ATOM 0 HB3 ALA B 161 6.779 4.526 -3.476 1.00 0.00 H new ATOM 1049 N PHE B 162 4.317 4.416 -1.761 1.00 0.00 N ATOM 1050 CA PHE B 162 3.680 3.624 -0.717 1.00 0.00 C ATOM 1051 C PHE B 162 2.175 3.845 -0.805 1.00 0.00 C ATOM 1052 O PHE B 162 1.419 2.914 -1.078 1.00 0.00 O ATOM 1053 CB PHE B 162 4.251 4.031 0.663 1.00 0.00 C ATOM 1054 CG PHE B 162 3.900 3.152 1.861 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.561 2.842 2.182 1.00 0.00 C ATOM 1056 CD2 PHE B 162 4.928 2.693 2.712 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.269 2.059 3.309 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.628 1.923 3.852 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.290 1.616 4.151 1.00 0.00 C ATOM 0 H PHE B 162 4.992 5.089 -1.398 1.00 0.00 H new ATOM 0 HA PHE B 162 3.883 2.561 -0.848 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.337 4.067 0.580 1.00 0.00 H new ATOM 0 HB3 PHE B 162 3.914 5.045 0.880 1.00 0.00 H new ATOM 0 HD1 PHE B 162 1.759 3.209 1.558 1.00 0.00 H new ATOM 0 HD2 PHE B 162 5.956 2.935 2.486 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.244 1.797 3.527 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.422 1.570 4.493 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.052 1.038 5.032 1.00 0.00 H new ATOM 1069 N ASP B 163 1.752 5.094 -0.608 1.00 0.00 N ATOM 1070 CA ASP B 163 0.350 5.479 -0.628 1.00 0.00 C ATOM 1071 C ASP B 163 -0.286 5.180 -1.979 1.00 0.00 C ATOM 1072 O ASP B 163 -1.438 4.764 -2.024 1.00 0.00 O ATOM 1073 CB ASP B 163 0.185 6.945 -0.202 1.00 0.00 C ATOM 1074 CG ASP B 163 0.389 7.192 1.293 1.00 0.00 C ATOM 1075 OD1 ASP B 163 0.896 6.299 2.009 1.00 0.00 O ATOM 1076 OD2 ASP B 163 -0.004 8.273 1.789 1.00 0.00 O ATOM 0 H ASP B 163 2.385 5.873 -0.428 1.00 0.00 H new ATOM 0 HA ASP B 163 -0.188 4.874 0.102 1.00 0.00 H new ATOM 0 HB2 ASP B 163 0.895 7.555 -0.760 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.813 7.282 -0.481 1.00 0.00 H new ATOM 1081 N LEU B 164 0.438 5.336 -3.089 1.00 0.00 N ATOM 1082 CA LEU B 164 -0.084 5.050 -4.422 1.00 0.00 C ATOM 1083 C LEU B 164 -0.521 3.592 -4.509 1.00 0.00 C ATOM 1084 O LEU B 164 -1.607 3.306 -5.018 1.00 0.00 O ATOM 1085 CB LEU B 164 0.992 5.362 -5.466 1.00 0.00 C ATOM 1086 CG LEU B 164 0.672 4.869 -6.886 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.459 5.703 -7.502 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.954 4.930 -7.710 1.00 0.00 C ATOM 0 H LEU B 164 1.404 5.665 -3.086 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.954 5.676 -4.618 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.147 6.440 -5.497 1.00 0.00 H new ATOM 0 HB3 LEU B 164 1.932 4.914 -5.144 1.00 0.00 H new ATOM 0 HG LEU B 164 0.317 3.839 -6.866 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.673 5.340 -8.507 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.354 5.614 -6.886 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.155 6.749 -7.551 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.752 4.584 -8.724 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.317 5.957 -7.743 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.711 4.292 -7.253 1.00 0.00 H new ATOM 1100 N ASP B 165 0.346 2.679 -4.073 1.00 0.00 N ATOM 1101 CA ASP B 165 0.084 1.247 -4.083 1.00 0.00 C ATOM 1102 C ASP B 165 -1.055 0.918 -3.127 1.00 0.00 C ATOM 1103 O ASP B 165 -1.920 0.129 -3.483 1.00 0.00 O ATOM 1104 CB ASP B 165 1.376 0.497 -3.746 1.00 0.00 C ATOM 1105 CG ASP B 165 1.436 -0.946 -4.261 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.434 -1.697 -4.260 1.00 0.00 O ATOM 1107 OD2 ASP B 165 2.541 -1.323 -4.713 1.00 0.00 O ATOM 0 H ASP B 165 1.263 2.921 -3.698 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.236 0.925 -5.074 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.219 1.051 -4.159 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.502 0.487 -2.663 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.112 1.542 -1.944 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.177 1.299 -0.971 1.00 0.00 C ATOM 1114 C VAL B 166 -3.511 1.718 -1.600 1.00 0.00 C ATOM 1115 O VAL B 166 -4.476 0.957 -1.550 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.838 2.021 0.354 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -2.992 2.083 1.365 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.673 1.301 1.048 1.00 0.00 C ATOM 0 H VAL B 166 -0.422 2.227 -1.638 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.267 0.243 -0.716 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.596 3.044 0.064 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.662 2.607 2.262 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.834 2.615 0.923 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.300 1.071 1.628 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.435 1.811 1.982 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.957 0.270 1.259 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.201 1.311 0.396 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.568 2.893 -2.231 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.762 3.406 -2.887 1.00 0.00 C ATOM 1130 C VAL B 167 -5.186 2.429 -3.990 1.00 0.00 C ATOM 1131 O VAL B 167 -6.362 2.071 -4.046 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.484 4.832 -3.412 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.580 5.369 -4.345 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.341 5.833 -2.257 1.00 0.00 C ATOM 0 H VAL B 167 -2.768 3.522 -2.299 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.594 3.482 -2.187 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.555 4.741 -3.975 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.317 6.374 -4.674 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.672 4.715 -5.213 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.530 5.399 -3.811 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.146 6.827 -2.659 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.263 5.851 -1.675 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.513 5.532 -1.615 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.267 1.993 -4.863 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.590 1.062 -5.948 1.00 0.00 C ATOM 1146 C LYS B 168 -5.063 -0.283 -5.410 1.00 0.00 C ATOM 1147 O LYS B 168 -6.075 -0.787 -5.889 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.396 0.885 -6.899 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.264 2.101 -7.824 1.00 0.00 C ATOM 1150 CD LYS B 168 -2.079 1.964 -8.782 1.00 0.00 C ATOM 1151 CE LYS B 168 -2.054 3.203 -9.680 1.00 0.00 C ATOM 1152 NZ LYS B 168 -0.966 3.174 -10.675 1.00 0.00 N ATOM 0 H LYS B 168 -3.287 2.274 -4.836 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.413 1.496 -6.516 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.480 0.757 -6.323 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.527 -0.019 -7.493 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -4.183 2.222 -8.398 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.143 3.002 -7.223 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.146 1.878 -8.225 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -2.176 1.060 -9.382 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -3.009 3.289 -10.198 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -1.947 4.092 -9.059 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -1.001 4.038 -11.253 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -0.050 3.121 -10.186 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -1.079 2.342 -11.289 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.358 -0.862 -4.438 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.690 -2.142 -3.817 1.00 0.00 C ATOM 1168 C LEU B 169 -6.129 -2.055 -3.313 1.00 0.00 C ATOM 1169 O LEU B 169 -6.987 -2.826 -3.743 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.696 -2.414 -2.663 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.622 -3.839 -2.072 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -3.238 -3.760 -0.592 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -4.884 -4.685 -2.183 1.00 0.00 C ATOM 0 H LEU B 169 -3.515 -0.439 -4.050 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.611 -2.967 -4.526 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.699 -2.150 -3.016 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.938 -1.730 -1.849 1.00 0.00 H new ATOM 0 HG LEU B 169 -2.873 -4.341 -2.684 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -3.186 -4.766 -0.175 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -2.266 -3.276 -0.494 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.988 -3.182 -0.052 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.708 -5.662 -1.733 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.702 -4.188 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.146 -4.811 -3.233 1.00 0.00 H new ATOM 1185 N THR B 170 -6.417 -1.085 -2.447 1.00 0.00 N ATOM 1186 CA THR B 170 -7.743 -0.902 -1.896 1.00 0.00 C ATOM 1187 C THR B 170 -8.766 -0.667 -3.009 1.00 0.00 C ATOM 1188 O THR B 170 -9.792 -1.341 -2.990 1.00 0.00 O ATOM 1189 CB THR B 170 -7.700 0.192 -0.820 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.717 -0.179 0.125 1.00 0.00 O ATOM 1191 CG2 THR B 170 -9.027 0.315 -0.072 1.00 0.00 C ATOM 0 H THR B 170 -5.732 -0.408 -2.112 1.00 0.00 H new ATOM 0 HA THR B 170 -8.081 -1.810 -1.396 1.00 0.00 H new ATOM 0 HB THR B 170 -7.486 1.144 -1.306 1.00 0.00 H new ATOM 0 HG1 THR B 170 -7.046 -0.930 0.661 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.950 1.101 0.679 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.820 0.564 -0.777 1.00 0.00 H new ATOM 0 HG23 THR B 170 -9.259 -0.632 0.416 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.503 0.212 -3.985 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.424 0.501 -5.090 1.00 0.00 C ATOM 1201 C ALA B 171 -9.768 -0.767 -5.888 1.00 0.00 C ATOM 1202 O ALA B 171 -10.893 -0.919 -6.361 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.846 1.571 -6.019 1.00 0.00 C ATOM 0 H ALA B 171 -7.636 0.747 -4.029 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.346 0.882 -4.650 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.548 1.767 -6.830 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.677 2.489 -5.456 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -7.901 1.221 -6.434 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.814 -1.683 -6.041 1.00 0.00 N ATOM 1210 CA GLN B 172 -9.023 -2.933 -6.748 1.00 0.00 C ATOM 1211 C GLN B 172 -9.938 -3.829 -5.917 1.00 0.00 C ATOM 1212 O GLN B 172 -10.952 -4.313 -6.418 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.673 -3.615 -7.010 1.00 0.00 C ATOM 1214 CG GLN B 172 -7.000 -3.014 -8.246 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.724 -3.758 -8.594 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -4.616 -3.284 -8.343 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -5.856 -4.946 -9.157 1.00 0.00 N ATOM 0 H GLN B 172 -7.869 -1.573 -5.673 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.497 -2.743 -7.711 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -7.025 -3.497 -6.142 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.821 -4.685 -7.154 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.687 -3.051 -9.091 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.773 -1.963 -8.065 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -6.786 -5.316 -9.355 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -5.028 -5.493 -9.394 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.626 -4.037 -4.637 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.443 -4.892 -3.787 1.00 0.00 C ATOM 1228 C PHE B 173 -11.845 -4.341 -3.539 1.00 0.00 C ATOM 1229 O PHE B 173 -12.773 -5.138 -3.408 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.699 -5.243 -2.507 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.746 -6.397 -2.732 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.505 -6.197 -3.356 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -9.137 -7.698 -2.382 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.624 -7.273 -3.543 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -8.247 -8.771 -2.518 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.984 -8.555 -3.101 1.00 0.00 C ATOM 0 H PHE B 173 -8.817 -3.626 -4.172 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.613 -5.821 -4.331 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.145 -4.373 -2.154 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.414 -5.504 -1.727 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.227 -5.210 -3.694 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -10.133 -7.874 -2.004 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.671 -7.115 -4.026 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -8.528 -9.757 -2.178 1.00 0.00 H new ATOM 0 HZ PHE B 173 -6.292 -9.377 -3.208 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.042 -3.020 -3.478 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.383 -2.465 -3.280 1.00 0.00 C ATOM 1248 C VAL B 174 -14.201 -2.712 -4.548 1.00 0.00 C ATOM 1249 O VAL B 174 -15.415 -2.824 -4.464 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.360 -0.985 -2.876 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.693 -0.790 -1.506 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.702 -0.098 -3.905 1.00 0.00 C ATOM 0 H VAL B 174 -11.301 -2.324 -3.562 1.00 0.00 H new ATOM 0 HA VAL B 174 -13.857 -2.973 -2.440 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.404 -0.680 -2.811 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.693 0.269 -1.249 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.246 -1.347 -0.750 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.666 -1.154 -1.546 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.719 0.935 -3.559 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.669 -0.415 -4.052 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.242 -0.173 -4.849 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.562 -2.803 -5.718 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.257 -3.085 -6.961 1.00 0.00 C ATOM 1264 C ALA B 175 -14.622 -4.578 -6.961 1.00 0.00 C ATOM 1265 O ALA B 175 -15.777 -4.929 -7.184 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.366 -2.706 -8.145 1.00 0.00 C ATOM 0 H ALA B 175 -12.554 -2.683 -5.822 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.171 -2.498 -7.052 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.890 -2.919 -9.077 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.129 -1.643 -8.096 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.444 -3.286 -8.107 1.00 0.00 H new ATOM 1272 N ARG B 176 -13.655 -5.450 -6.639 1.00 0.00 N ATOM 1273 CA ARG B 176 -13.820 -6.905 -6.591 1.00 0.00 C ATOM 1274 C ARG B 176 -14.859 -7.367 -5.571 1.00 0.00 C ATOM 1275 O ARG B 176 -15.582 -8.328 -5.843 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.483 -7.572 -6.230 1.00 0.00 C ATOM 1277 CG ARG B 176 -11.436 -7.534 -7.345 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.125 -8.163 -6.847 1.00 0.00 C ATOM 1279 NE ARG B 176 -9.130 -8.305 -7.922 1.00 0.00 N ATOM 1280 CZ ARG B 176 -9.077 -9.301 -8.817 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -10.007 -10.246 -8.847 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -8.096 -9.357 -9.705 1.00 0.00 N ATOM 0 H ARG B 176 -12.710 -5.151 -6.398 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.165 -7.198 -7.583 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -12.073 -7.082 -5.347 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -12.671 -8.611 -5.960 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -11.801 -8.075 -8.218 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -11.261 -6.505 -7.658 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -9.709 -7.547 -6.049 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -10.335 -9.143 -6.417 1.00 0.00 H new ATOM 0 HE ARG B 176 -8.416 -7.580 -7.992 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -10.780 -10.223 -8.181 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -9.950 -10.996 -9.536 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -7.372 -8.638 -9.712 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -8.064 -10.119 -10.382 1.00 0.00 H new ATOM 1296 N ASN B 177 -14.899 -6.754 -4.388 1.00 0.00 N ATOM 1297 CA ASN B 177 -15.832 -7.119 -3.315 1.00 0.00 C ATOM 1298 C ASN B 177 -17.052 -6.213 -3.228 1.00 0.00 C ATOM 1299 O ASN B 177 -18.047 -6.598 -2.615 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.132 -7.093 -1.951 1.00 0.00 C ATOM 1301 CG ASN B 177 -14.182 -8.254 -1.764 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.577 -9.402 -1.932 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -12.929 -8.000 -1.442 1.00 0.00 N ATOM 0 H ASN B 177 -14.279 -5.982 -4.142 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.171 -8.124 -3.567 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.582 -6.158 -1.847 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -15.883 -7.111 -1.161 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -12.266 -8.767 -1.328 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.622 -7.037 -1.307 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.995 -5.039 -3.841 1.00 0.00 N ATOM 1311 CA GLY B 178 -18.062 -4.061 -3.843 1.00 0.00 C ATOM 1312 C GLY B 178 -17.899 -3.079 -2.683 1.00 0.00 C ATOM 1313 O GLY B 178 -17.081 -3.253 -1.773 1.00 0.00 O ATOM 0 H GLY B 178 -16.175 -4.736 -4.367 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -18.062 -3.518 -4.788 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -19.025 -4.566 -3.766 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.713 -2.025 -2.703 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.756 -0.955 -1.713 1.00 0.00 C ATOM 1319 C ARG B 179 -18.864 -1.462 -0.286 1.00 0.00 C ATOM 1320 O ARG B 179 -18.369 -0.778 0.608 1.00 0.00 O ATOM 1321 CB ARG B 179 -19.957 -0.062 -2.021 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.124 1.105 -1.034 1.00 0.00 C ATOM 1323 CD ARG B 179 -21.125 0.843 0.094 1.00 0.00 C ATOM 1324 NE ARG B 179 -22.477 0.734 -0.475 1.00 0.00 N ATOM 1325 CZ ARG B 179 -23.649 0.614 0.146 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -23.752 0.621 1.467 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -24.739 0.453 -0.592 1.00 0.00 N ATOM 0 H ARG B 179 -19.395 -1.889 -3.449 1.00 0.00 H new ATOM 0 HA ARG B 179 -17.816 -0.406 -1.781 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -19.853 0.338 -3.030 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -20.863 -0.669 -2.010 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -19.153 1.335 -0.595 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.442 1.989 -1.587 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -20.865 -0.074 0.622 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -21.089 1.652 0.824 1.00 0.00 H new ATOM 0 HE ARG B 179 -22.524 0.753 -1.494 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -22.916 0.721 2.043 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -24.667 0.527 1.908 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -24.667 0.424 -1.609 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -25.650 0.358 -0.143 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.497 -2.612 -0.044 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.628 -3.146 1.303 1.00 0.00 C ATOM 1343 C GLN B 180 -18.233 -3.220 1.923 1.00 0.00 C ATOM 1344 O GLN B 180 -18.012 -2.703 3.016 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.322 -4.523 1.271 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.320 -5.256 2.631 1.00 0.00 C ATOM 1347 CD GLN B 180 -20.986 -6.631 2.562 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -22.008 -6.825 1.901 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -20.413 -7.634 3.205 1.00 0.00 N ATOM 0 H GLN B 180 -19.926 -3.188 -0.768 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.254 -2.496 1.915 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.353 -4.392 0.941 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -19.828 -5.151 0.530 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -19.292 -5.372 2.975 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -20.837 -4.643 3.370 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -19.567 -7.473 3.752 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -20.817 -8.569 3.154 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.293 -3.844 1.209 1.00 0.00 N ATOM 1359 CA PHE B 181 -15.910 -4.002 1.630 1.00 0.00 C ATOM 1360 C PHE B 181 -15.281 -2.630 1.919 1.00 0.00 C ATOM 1361 O PHE B 181 -14.470 -2.511 2.841 1.00 0.00 O ATOM 1362 CB PHE B 181 -15.189 -4.806 0.543 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.699 -4.982 0.707 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -12.827 -4.009 0.194 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -13.176 -6.124 1.335 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -11.441 -4.130 0.374 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.791 -6.241 1.531 1.00 0.00 C ATOM 1368 CZ PHE B 181 -10.924 -5.243 1.057 1.00 0.00 C ATOM 0 H PHE B 181 -17.484 -4.262 0.299 1.00 0.00 H new ATOM 0 HA PHE B 181 -15.828 -4.553 2.567 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.645 -5.795 0.492 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -15.371 -4.321 -0.416 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -13.226 -3.161 -0.343 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -13.838 -6.910 1.666 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -10.775 -3.371 -0.010 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -11.391 -7.101 2.048 1.00 0.00 H new ATOM 0 HZ PHE B 181 -9.860 -5.331 1.218 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.649 -1.595 1.160 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.145 -0.242 1.359 1.00 0.00 C ATOM 1380 C LEU B 182 -15.571 0.217 2.754 1.00 0.00 C ATOM 1381 O LEU B 182 -14.733 0.573 3.580 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.694 0.724 0.283 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.757 1.913 -0.010 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.374 2.794 -1.096 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.469 2.766 1.224 1.00 0.00 C ATOM 0 H LEU B 182 -16.309 -1.677 0.387 1.00 0.00 H new ATOM 0 HA LEU B 182 -14.059 -0.238 1.270 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.864 0.169 -0.640 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.662 1.106 0.608 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.807 1.493 -0.342 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.711 3.634 -1.303 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.512 2.208 -2.005 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.339 3.168 -0.756 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -13.804 3.586 0.952 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.404 3.170 1.613 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -13.993 2.151 1.988 1.00 0.00 H new ATOM 1397 N THR B 183 -16.872 0.179 3.041 1.00 0.00 N ATOM 1398 CA THR B 183 -17.382 0.614 4.327 1.00 0.00 C ATOM 1399 C THR B 183 -16.791 -0.189 5.483 1.00 0.00 C ATOM 1400 O THR B 183 -16.381 0.423 6.467 1.00 0.00 O ATOM 1401 CB THR B 183 -18.912 0.538 4.324 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.446 1.195 3.190 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.517 1.170 5.581 1.00 0.00 C ATOM 0 H THR B 183 -17.588 -0.151 2.394 1.00 0.00 H new ATOM 0 HA THR B 183 -17.075 1.648 4.482 1.00 0.00 H new ATOM 0 HB THR B 183 -19.171 -0.521 4.300 1.00 0.00 H new ATOM 0 HG1 THR B 183 -20.424 1.133 3.206 1.00 0.00 H new ATOM 0 HG21 THR B 183 -20.604 1.095 5.539 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.151 0.646 6.464 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.228 2.219 5.636 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.709 -1.524 5.400 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.163 -2.318 6.499 1.00 0.00 C ATOM 1413 C GLN B 184 -14.744 -1.859 6.836 1.00 0.00 C ATOM 1414 O GLN B 184 -14.389 -1.821 8.014 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.320 -3.824 6.236 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.817 -4.134 6.037 1.00 0.00 C ATOM 1417 CD GLN B 184 -18.255 -5.570 6.282 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -19.340 -5.787 6.818 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.525 -6.570 5.826 1.00 0.00 N ATOM 0 H GLN B 184 -17.011 -2.068 4.592 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.745 -2.142 7.404 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.752 -4.115 5.352 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.923 -4.398 7.073 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.390 -3.486 6.700 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -18.088 -3.865 5.016 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -16.626 -6.384 5.382 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.860 -7.529 5.917 1.00 0.00 H new ATOM 1428 N LEU B 185 -13.956 -1.468 5.826 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.602 -0.969 6.032 1.00 0.00 C ATOM 1430 C LEU B 185 -12.678 0.373 6.748 1.00 0.00 C ATOM 1431 O LEU B 185 -11.984 0.561 7.740 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.847 -0.784 4.706 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.114 -2.035 4.213 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.628 -1.758 2.788 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -9.925 -2.400 5.111 1.00 0.00 C ATOM 0 H LEU B 185 -14.244 -1.491 4.848 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.059 -1.703 6.627 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.555 -0.468 3.940 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.124 0.023 4.824 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.799 -2.883 4.239 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -10.100 -2.632 2.407 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.483 -1.543 2.147 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -9.954 -0.901 2.794 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.436 -3.293 4.722 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.214 -1.574 5.126 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.279 -2.592 6.124 1.00 0.00 H new ATOM 1447 N MET B 186 -13.504 1.304 6.262 1.00 0.00 N ATOM 1448 CA MET B 186 -13.643 2.627 6.870 1.00 0.00 C ATOM 1449 C MET B 186 -14.029 2.539 8.343 1.00 0.00 C ATOM 1450 O MET B 186 -13.545 3.340 9.142 1.00 0.00 O ATOM 1451 CB MET B 186 -14.682 3.472 6.125 1.00 0.00 C ATOM 1452 CG MET B 186 -14.240 3.766 4.693 1.00 0.00 C ATOM 1453 SD MET B 186 -15.352 4.854 3.778 1.00 0.00 S ATOM 1454 CE MET B 186 -14.899 6.455 4.475 1.00 0.00 C ATOM 0 H MET B 186 -14.091 1.162 5.440 1.00 0.00 H new ATOM 0 HA MET B 186 -12.667 3.107 6.795 1.00 0.00 H new ATOM 0 HB2 MET B 186 -15.637 2.948 6.112 1.00 0.00 H new ATOM 0 HB3 MET B 186 -14.840 4.410 6.658 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.248 4.217 4.717 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.148 2.823 4.153 1.00 0.00 H new ATOM 0 HE1 MET B 186 -15.380 7.249 3.904 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.226 6.505 5.514 1.00 0.00 H new ATOM 0 HE3 MET B 186 -13.817 6.579 4.429 1.00 0.00 H new ATOM 1464 N GLN B 187 -14.903 1.601 8.710 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.341 1.433 10.084 1.00 0.00 C ATOM 1466 C GLN B 187 -14.222 0.832 10.945 1.00 0.00 C ATOM 1467 O GLN B 187 -13.808 1.459 11.917 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.622 0.585 10.134 1.00 0.00 C ATOM 1469 CG GLN B 187 -17.836 1.173 9.381 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.279 2.552 9.862 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -18.539 2.771 11.041 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.349 3.550 8.997 1.00 0.00 N ATOM 0 H GLN B 187 -15.324 0.939 8.058 1.00 0.00 H new ATOM 0 HA GLN B 187 -15.575 2.412 10.501 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.402 -0.400 9.721 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -16.900 0.438 11.178 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -17.593 1.234 8.320 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -18.675 0.483 9.477 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.137 3.388 8.013 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.615 4.482 9.314 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.686 -0.345 10.594 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.631 -0.986 11.391 1.00 0.00 C ATOM 1483 C LYS B 188 -11.357 -0.139 11.506 1.00 0.00 C ATOM 1484 O LYS B 188 -10.719 -0.134 12.566 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.365 -2.407 10.863 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.606 -2.410 9.525 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.643 -3.737 8.761 1.00 0.00 C ATOM 1488 CE LYS B 188 -10.420 -4.615 9.016 1.00 0.00 C ATOM 1489 NZ LYS B 188 -10.297 -4.999 10.433 1.00 0.00 N ATOM 0 H LYS B 188 -13.965 -0.871 9.766 1.00 0.00 H new ATOM 0 HA LYS B 188 -12.992 -1.068 12.416 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.790 -2.964 11.603 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.314 -2.928 10.739 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.021 -1.630 8.887 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -10.565 -2.146 9.715 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -12.541 -4.286 9.044 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -11.718 -3.532 7.693 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -10.485 -5.513 8.402 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -9.521 -4.082 8.706 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -9.536 -5.701 10.538 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -10.073 -4.158 11.002 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -11.195 -5.410 10.760 1.00 0.00 H new ATOM 1503 N GLU B 189 -10.992 0.588 10.448 1.00 0.00 N ATOM 1504 CA GLU B 189 -9.815 1.455 10.381 1.00 0.00 C ATOM 1505 C GLU B 189 -10.177 2.905 10.753 1.00 0.00 C ATOM 1506 O GLU B 189 -9.392 3.810 10.462 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.155 1.396 8.983 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.625 0.019 8.550 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.433 -0.466 9.381 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -6.339 0.133 9.307 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -7.552 -1.488 10.101 1.00 0.00 O ATOM 0 H GLU B 189 -11.529 0.589 9.581 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.091 1.088 11.109 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -9.882 1.733 8.244 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.328 2.105 8.962 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.431 -0.711 8.624 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -8.332 0.065 7.501 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.324 3.167 11.401 1.00 0.00 N ATOM 1519 CA GLN B 190 -11.746 4.521 11.778 1.00 0.00 C ATOM 1520 C GLN B 190 -10.735 5.285 12.647 1.00 0.00 C ATOM 1521 O GLN B 190 -10.814 6.511 12.723 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.143 4.508 12.427 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.191 3.885 13.837 1.00 0.00 C ATOM 1524 CD GLN B 190 -14.601 3.553 14.312 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -14.830 2.580 15.018 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -15.594 4.369 14.010 1.00 0.00 N ATOM 0 H GLN B 190 -11.985 2.441 11.678 1.00 0.00 H new ATOM 0 HA GLN B 190 -11.796 5.077 10.842 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -13.512 5.532 12.484 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -13.825 3.959 11.778 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -12.591 2.975 13.843 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -12.731 4.574 14.545 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.423 5.185 13.423 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -16.532 4.183 14.364 1.00 0.00 H new ATOM 1535 N ARG B 191 -9.783 4.612 13.299 1.00 0.00 N ATOM 1536 CA ARG B 191 -8.752 5.221 14.143 1.00 0.00 C ATOM 1537 C ARG B 191 -7.380 5.108 13.481 1.00 0.00 C ATOM 1538 O ARG B 191 -6.380 5.478 14.099 1.00 0.00 O ATOM 1539 CB ARG B 191 -8.683 4.511 15.508 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.014 4.396 16.257 1.00 0.00 C ATOM 1541 CD ARG B 191 -9.937 3.356 17.381 1.00 0.00 C ATOM 1542 NE ARG B 191 -9.010 3.734 18.462 1.00 0.00 N ATOM 1543 CZ ARG B 191 -9.316 4.489 19.524 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -10.491 5.110 19.599 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -8.438 4.624 20.509 1.00 0.00 N ATOM 0 H ARG B 191 -9.706 3.596 13.252 1.00 0.00 H new ATOM 0 HA ARG B 191 -9.016 6.270 14.279 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -8.283 3.508 15.357 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -7.974 5.045 16.141 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -10.283 5.366 16.675 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -10.804 4.120 15.558 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -10.933 3.210 17.800 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -9.624 2.400 16.961 1.00 0.00 H new ATOM 0 HE ARG B 191 -8.052 3.391 18.395 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -11.168 5.013 18.843 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -10.714 5.683 20.413 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -7.535 4.154 20.455 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -8.666 5.198 21.321 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.274 4.558 12.272 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.001 4.394 11.591 1.00 0.00 C ATOM 1561 C ASN B 192 -5.796 5.502 10.567 1.00 0.00 C ATOM 1562 O ASN B 192 -6.427 5.491 9.511 1.00 0.00 O ATOM 1563 CB ASN B 192 -5.901 2.998 10.970 1.00 0.00 C ATOM 1564 CG ASN B 192 -4.452 2.700 10.633 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -3.545 3.197 11.294 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.196 1.905 9.619 1.00 0.00 N ATOM 0 H ASN B 192 -8.074 4.214 11.740 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.194 4.479 12.319 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.286 2.251 11.664 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -6.514 2.943 10.070 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.230 1.691 9.369 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -4.963 1.501 9.081 1.00 0.00 H new ATOM 1573 N TYR B 193 -4.905 6.448 10.875 1.00 0.00 N ATOM 1574 CA TYR B 193 -4.601 7.591 10.022 1.00 0.00 C ATOM 1575 C TYR B 193 -4.249 7.236 8.578 1.00 0.00 C ATOM 1576 O TYR B 193 -4.701 7.955 7.698 1.00 0.00 O ATOM 1577 CB TYR B 193 -3.547 8.499 10.663 1.00 0.00 C ATOM 1578 CG TYR B 193 -2.283 7.797 11.117 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -1.217 7.593 10.219 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.159 7.385 12.457 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.041 6.953 10.654 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -0.983 6.757 12.896 1.00 0.00 C ATOM 1583 CZ TYR B 193 0.083 6.529 12.001 1.00 0.00 C ATOM 1584 OH TYR B 193 1.177 5.860 12.453 1.00 0.00 O ATOM 0 H TYR B 193 -4.367 6.437 11.741 1.00 0.00 H new ATOM 0 HA TYR B 193 -5.535 8.148 9.945 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -3.276 9.276 9.948 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -3.995 8.999 11.522 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -1.302 7.928 9.196 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -2.971 7.552 13.149 1.00 0.00 H new ATOM 0 HE1 TYR B 193 0.769 6.785 9.960 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -0.894 6.446 13.926 1.00 0.00 H new ATOM 0 HH TYR B 193 1.067 5.660 13.406 1.00 0.00 H new ATOM 1594 N GLN B 194 -3.537 6.136 8.294 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.202 5.790 6.913 1.00 0.00 C ATOM 1596 C GLN B 194 -4.451 5.553 6.041 1.00 0.00 C ATOM 1597 O GLN B 194 -4.350 5.567 4.817 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.291 4.550 6.867 1.00 0.00 C ATOM 1599 CG GLN B 194 -0.790 4.882 6.944 1.00 0.00 C ATOM 1600 CD GLN B 194 0.001 3.995 5.992 1.00 0.00 C ATOM 1601 OE1 GLN B 194 0.116 2.785 6.185 1.00 0.00 O ATOM 1602 NE2 GLN B 194 0.493 4.554 4.908 1.00 0.00 N ATOM 0 H GLN B 194 -3.188 5.481 8.994 1.00 0.00 H new ATOM 0 HA GLN B 194 -2.671 6.647 6.499 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.551 3.888 7.693 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -2.486 4.001 5.946 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -0.630 5.930 6.692 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.432 4.741 7.964 1.00 0.00 H new ATOM 0 HE21 GLN B 194 0.391 5.558 4.761 1.00 0.00 H new ATOM 0 HE22 GLN B 194 0.977 3.983 4.215 1.00 0.00 H new ATOM 1611 N PHE B 195 -5.624 5.317 6.632 1.00 0.00 N ATOM 1612 CA PHE B 195 -6.869 5.081 5.909 1.00 0.00 C ATOM 1613 C PHE B 195 -7.718 6.360 5.828 1.00 0.00 C ATOM 1614 O PHE B 195 -8.907 6.283 5.511 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.581 3.875 6.553 1.00 0.00 C ATOM 1616 CG PHE B 195 -6.928 2.542 6.202 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -5.633 2.224 6.659 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -7.603 1.621 5.379 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -4.999 1.036 6.256 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -6.983 0.420 4.993 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.676 0.134 5.420 1.00 0.00 C ATOM 0 H PHE B 195 -5.734 5.285 7.646 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.674 4.825 4.867 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -7.585 3.998 7.636 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.622 3.860 6.230 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -5.122 2.901 7.327 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -8.605 1.839 5.041 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -3.995 0.818 6.588 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -7.512 -0.284 4.367 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.192 -0.779 5.106 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.158 7.532 6.151 1.00 0.00 N ATOM 1632 CA ASP B 196 -7.861 8.817 6.096 1.00 0.00 C ATOM 1633 C ASP B 196 -8.272 9.196 4.674 1.00 0.00 C ATOM 1634 O ASP B 196 -9.321 9.827 4.507 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.048 9.954 6.744 1.00 0.00 C ATOM 1636 CG ASP B 196 -5.876 10.528 5.945 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -5.353 9.847 5.043 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -5.503 11.681 6.266 1.00 0.00 O ATOM 0 H ASP B 196 -6.190 7.614 6.462 1.00 0.00 H new ATOM 0 HA ASP B 196 -8.772 8.682 6.679 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -7.733 10.771 6.970 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -6.660 9.590 7.696 1.00 0.00 H new ATOM 1643 N PHE B 197 -7.544 8.738 3.652 1.00 0.00 N ATOM 1644 CA PHE B 197 -7.840 9.034 2.258 1.00 0.00 C ATOM 1645 C PHE B 197 -9.177 8.438 1.819 1.00 0.00 C ATOM 1646 O PHE B 197 -9.726 8.860 0.802 1.00 0.00 O ATOM 1647 CB PHE B 197 -6.707 8.579 1.328 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.646 7.082 1.093 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.386 6.496 0.047 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -5.872 6.271 1.939 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.347 5.105 -0.151 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -5.830 4.881 1.742 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.568 4.300 0.695 1.00 0.00 C ATOM 0 H PHE B 197 -6.724 8.145 3.777 1.00 0.00 H new ATOM 0 HA PHE B 197 -7.921 10.118 2.179 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -6.820 9.080 0.367 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -5.756 8.907 1.748 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -7.984 7.117 -0.604 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.307 6.718 2.744 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -7.915 4.656 -0.952 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -5.233 4.260 2.393 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.535 3.231 0.542 1.00 0.00 H new ATOM 1663 N LEU B 198 -9.699 7.441 2.543 1.00 0.00 N ATOM 1664 CA LEU B 198 -10.972 6.819 2.205 1.00 0.00 C ATOM 1665 C LEU B 198 -12.129 7.780 2.456 1.00 0.00 C ATOM 1666 O LEU B 198 -13.220 7.547 1.930 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.172 5.516 2.985 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.219 4.384 2.563 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.452 3.173 3.472 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.434 3.958 1.104 1.00 0.00 C ATOM 0 H LEU B 198 -9.251 7.050 3.372 1.00 0.00 H new ATOM 0 HA LEU B 198 -10.954 6.577 1.142 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.035 5.716 4.048 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.200 5.180 2.854 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.199 4.756 2.656 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -9.781 2.365 3.181 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.256 3.452 4.507 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.485 2.839 3.376 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -9.739 3.157 0.853 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.457 3.604 0.975 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.259 4.810 0.447 1.00 0.00 H new ATOM 1682 N ARG B 199 -11.954 8.797 3.307 1.00 0.00 N ATOM 1683 CA ARG B 199 -12.993 9.775 3.586 1.00 0.00 C ATOM 1684 C ARG B 199 -12.918 10.821 2.476 1.00 0.00 C ATOM 1685 O ARG B 199 -11.839 11.078 1.942 1.00 0.00 O ATOM 1686 CB ARG B 199 -12.784 10.410 4.977 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.022 9.395 6.107 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.161 10.058 7.486 1.00 0.00 C ATOM 1689 NE ARG B 199 -13.804 9.138 8.442 1.00 0.00 N ATOM 1690 CZ ARG B 199 -14.889 9.375 9.194 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -15.409 10.588 9.338 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -15.475 8.356 9.802 1.00 0.00 N ATOM 0 H ARG B 199 -11.086 8.959 3.818 1.00 0.00 H new ATOM 0 HA ARG B 199 -13.979 9.310 3.605 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -11.770 10.803 5.049 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.463 11.254 5.097 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -13.925 8.824 5.891 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.195 8.686 6.132 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -12.178 10.348 7.857 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -13.750 10.971 7.399 1.00 0.00 H new ATOM 0 HE ARG B 199 -13.376 8.218 8.543 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -14.982 11.385 8.867 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -16.236 10.723 9.920 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -15.100 7.414 9.694 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -16.301 8.513 10.379 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.032 11.488 2.153 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.058 12.511 1.112 1.00 0.00 C ATOM 1708 C PRO B 200 -13.198 13.721 1.484 1.00 0.00 C ATOM 1709 O PRO B 200 -12.830 14.498 0.607 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.531 12.872 0.934 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.141 12.519 2.288 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.354 11.287 2.711 1.00 0.00 C ATOM 0 HA PRO B 200 -13.630 12.148 0.178 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.661 13.928 0.696 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.990 12.304 0.125 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.031 13.333 3.004 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.207 12.308 2.207 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.316 11.194 3.796 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.811 10.374 2.329 1.00 0.00 H new ATOM 1720 N GLN B 201 -12.845 13.834 2.764 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.035 14.852 3.403 1.00 0.00 C ATOM 1722 C GLN B 201 -10.577 14.878 2.906 1.00 0.00 C ATOM 1723 O GLN B 201 -9.778 15.661 3.424 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.147 14.575 4.912 1.00 0.00 C ATOM 1725 CG GLN B 201 -11.687 15.733 5.800 1.00 0.00 C ATOM 1726 CD GLN B 201 -12.393 15.754 7.149 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -13.623 15.726 7.205 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -11.653 15.842 8.243 1.00 0.00 N ATOM 0 H GLN B 201 -13.155 13.139 3.443 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.398 15.849 3.153 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -13.184 14.339 5.150 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -11.556 13.691 5.152 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -10.611 15.659 5.958 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -11.869 16.676 5.284 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -10.636 15.863 8.170 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -12.100 15.888 9.159 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.206 14.027 1.947 1.00 0.00 N ATOM 1738 CA HIS B 202 -8.878 13.944 1.371 1.00 0.00 C ATOM 1739 C HIS B 202 -9.010 14.117 -0.139 1.00 0.00 C ATOM 1740 O HIS B 202 -9.799 13.409 -0.768 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.272 12.576 1.704 1.00 0.00 C ATOM 1742 CG HIS B 202 -6.785 12.632 1.935 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -5.807 12.743 0.972 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.164 12.586 3.157 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -4.621 12.782 1.597 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -4.788 12.718 2.927 1.00 0.00 N ATOM 0 H HIS B 202 -10.855 13.353 1.540 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.226 14.719 1.774 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -8.758 12.177 2.594 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.482 11.884 0.889 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -6.645 12.470 4.117 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -3.665 12.855 1.099 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.054 12.758 3.635 1.00 0.00 H new ATOM 1754 N SER B 203 -8.179 14.973 -0.741 1.00 0.00 N ATOM 1755 CA SER B 203 -8.189 15.234 -2.184 1.00 0.00 C ATOM 1756 C SER B 203 -8.021 13.927 -2.978 1.00 0.00 C ATOM 1757 O SER B 203 -8.631 13.743 -4.033 1.00 0.00 O ATOM 1758 CB SER B 203 -7.101 16.280 -2.475 1.00 0.00 C ATOM 1759 OG SER B 203 -7.106 16.758 -3.805 1.00 0.00 O ATOM 0 H SER B 203 -7.474 15.509 -0.236 1.00 0.00 H new ATOM 0 HA SER B 203 -9.148 15.638 -2.508 1.00 0.00 H new ATOM 0 HB2 SER B 203 -7.231 17.123 -1.796 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.125 15.844 -2.260 1.00 0.00 H new ATOM 0 HG SER B 203 -6.391 17.419 -3.918 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.253 12.974 -2.440 1.00 0.00 N ATOM 1766 CA LEU B 204 -6.987 11.666 -3.039 1.00 0.00 C ATOM 1767 C LEU B 204 -8.260 10.880 -3.348 1.00 0.00 C ATOM 1768 O LEU B 204 -8.253 10.064 -4.272 1.00 0.00 O ATOM 1769 CB LEU B 204 -6.083 10.832 -2.115 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.612 11.271 -2.109 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.838 10.386 -1.130 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.997 11.185 -3.511 1.00 0.00 C ATOM 0 H LEU B 204 -6.784 13.099 -1.543 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.485 11.857 -3.988 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.471 10.888 -1.098 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.137 9.787 -2.419 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.554 12.313 -1.794 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.791 10.688 -1.116 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.260 10.494 -0.131 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.911 9.345 -1.444 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.955 11.503 -3.471 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -4.049 10.157 -3.869 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.549 11.834 -4.191 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.354 11.126 -2.624 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.627 10.451 -2.837 1.00 0.00 C ATOM 1786 C PHE B 205 -11.091 10.639 -4.281 1.00 0.00 C ATOM 1787 O PHE B 205 -11.661 9.727 -4.880 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.640 11.022 -1.835 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.061 10.489 -1.919 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.930 10.910 -2.948 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.547 9.630 -0.915 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -15.256 10.448 -2.990 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -14.883 9.195 -0.943 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.734 9.589 -1.989 1.00 0.00 C ATOM 0 H PHE B 205 -9.377 11.808 -1.866 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.527 9.378 -2.674 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.266 10.834 -0.829 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.674 12.104 -1.966 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -13.574 11.591 -3.707 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -12.891 9.304 -0.121 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.909 10.755 -3.794 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.257 8.555 -0.157 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.753 9.232 -2.022 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.840 11.821 -4.858 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.232 12.138 -6.229 1.00 0.00 C ATOM 1806 C ASN B 206 -10.525 11.238 -7.254 1.00 0.00 C ATOM 1807 O ASN B 206 -10.987 11.147 -8.390 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.937 13.612 -6.539 1.00 0.00 C ATOM 1809 CG ASN B 206 -11.938 14.638 -6.014 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.117 15.677 -6.633 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.572 14.443 -4.870 1.00 0.00 N ATOM 0 H ASN B 206 -10.358 12.584 -4.382 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.303 11.955 -6.310 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -9.956 13.855 -6.132 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.870 13.725 -7.621 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.205 15.157 -4.510 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -12.428 13.579 -4.348 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.388 10.623 -6.914 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.652 9.720 -7.798 1.00 0.00 C ATOM 1820 C TYR B 207 -9.105 8.296 -7.480 1.00 0.00 C ATOM 1821 O TYR B 207 -9.476 7.549 -8.382 1.00 0.00 O ATOM 1822 CB TYR B 207 -7.138 9.888 -7.591 1.00 0.00 C ATOM 1823 CG TYR B 207 -6.284 8.818 -8.256 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -6.233 8.726 -9.660 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -5.531 7.919 -7.473 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -5.439 7.744 -10.281 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.722 6.945 -8.089 1.00 0.00 C ATOM 1828 CZ TYR B 207 -4.682 6.846 -9.498 1.00 0.00 C ATOM 1829 OH TYR B 207 -3.910 5.891 -10.084 1.00 0.00 O ATOM 0 H TYR B 207 -8.948 10.742 -6.002 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.856 9.947 -8.844 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.838 10.863 -7.974 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.929 9.888 -6.521 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -6.807 9.413 -10.264 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.575 7.978 -6.395 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -5.409 7.677 -11.359 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -4.131 6.273 -7.484 1.00 0.00 H new ATOM 0 HH TYR B 207 -3.008 5.920 -9.703 1.00 0.00 H new ATOM 1839 N PHE B 208 -9.122 7.940 -6.193 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.526 6.629 -5.712 1.00 0.00 C ATOM 1841 C PHE B 208 -10.906 6.235 -6.241 1.00 0.00 C ATOM 1842 O PHE B 208 -11.034 5.157 -6.815 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.490 6.619 -4.180 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.169 5.415 -3.554 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -11.550 5.462 -3.285 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -9.444 4.246 -3.254 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -12.199 4.358 -2.717 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -10.088 3.151 -2.656 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.466 3.207 -2.383 1.00 0.00 C ATOM 0 H PHE B 208 -8.848 8.575 -5.444 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.825 5.885 -6.089 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.451 6.649 -3.851 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.968 7.526 -3.810 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -12.112 6.354 -3.518 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -8.390 4.191 -3.484 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -13.263 4.392 -2.536 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -9.524 2.265 -2.405 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.960 2.367 -1.918 1.00 0.00 H new ATOM 1859 N THR B 209 -11.928 7.090 -6.112 1.00 0.00 N ATOM 1860 CA THR B 209 -13.277 6.771 -6.576 1.00 0.00 C ATOM 1861 C THR B 209 -13.263 6.364 -8.059 1.00 0.00 C ATOM 1862 O THR B 209 -13.819 5.332 -8.427 1.00 0.00 O ATOM 1863 CB THR B 209 -14.222 7.935 -6.211 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.575 7.549 -6.310 1.00 0.00 O ATOM 1865 CG2 THR B 209 -14.031 9.187 -7.071 1.00 0.00 C ATOM 0 H THR B 209 -11.841 8.013 -5.687 1.00 0.00 H new ATOM 0 HA THR B 209 -13.673 5.893 -6.067 1.00 0.00 H new ATOM 0 HB THR B 209 -13.959 8.184 -5.183 1.00 0.00 H new ATOM 0 HG1 THR B 209 -16.150 8.306 -6.071 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.732 9.958 -6.752 1.00 0.00 H new ATOM 0 HG22 THR B 209 -13.011 9.554 -6.958 1.00 0.00 H new ATOM 0 HG23 THR B 209 -14.214 8.941 -8.117 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.570 7.134 -8.904 1.00 0.00 N ATOM 1874 CA LYS B 210 -12.439 6.893 -10.336 1.00 0.00 C ATOM 1875 C LYS B 210 -11.731 5.573 -10.612 1.00 0.00 C ATOM 1876 O LYS B 210 -12.013 4.923 -11.621 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.680 8.059 -10.969 1.00 0.00 C ATOM 1878 CG LYS B 210 -12.527 9.336 -10.979 1.00 0.00 C ATOM 1879 CD LYS B 210 -11.756 10.439 -11.699 1.00 0.00 C ATOM 1880 CE LYS B 210 -12.738 11.542 -12.107 1.00 0.00 C ATOM 1881 NZ LYS B 210 -12.192 12.464 -13.126 1.00 0.00 N ATOM 0 H LYS B 210 -12.070 7.968 -8.595 1.00 0.00 H new ATOM 0 HA LYS B 210 -13.433 6.823 -10.777 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -10.757 8.237 -10.417 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.397 7.800 -11.989 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -13.478 9.153 -11.480 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -12.758 9.643 -9.959 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -10.982 10.845 -11.048 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -11.254 10.036 -12.579 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -13.649 11.084 -12.493 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -13.019 12.114 -11.223 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -12.904 13.186 -13.358 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -11.339 12.927 -12.753 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -11.949 11.929 -13.984 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.776 5.189 -9.768 1.00 0.00 N ATOM 1896 CA LEU B 211 -10.074 3.920 -9.932 1.00 0.00 C ATOM 1897 C LEU B 211 -11.048 2.766 -9.692 1.00 0.00 C ATOM 1898 O LEU B 211 -10.943 1.770 -10.401 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.891 3.739 -8.964 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.549 4.371 -9.358 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.560 4.060 -8.225 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.993 3.799 -10.671 1.00 0.00 C ATOM 0 H LEU B 211 -10.471 5.738 -8.964 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.679 3.923 -10.948 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.183 4.146 -7.996 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.731 2.670 -8.825 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.692 5.441 -9.510 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.588 4.492 -8.462 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.929 4.487 -7.293 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.461 2.980 -8.115 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -6.043 4.280 -10.904 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.840 2.725 -10.564 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.701 3.986 -11.478 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.968 2.860 -8.722 1.00 0.00 N ATOM 1915 CA VAL B 212 -12.915 1.776 -8.448 1.00 0.00 C ATOM 1916 C VAL B 212 -13.731 1.511 -9.701 1.00 0.00 C ATOM 1917 O VAL B 212 -13.756 0.388 -10.189 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.846 2.105 -7.261 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.798 0.942 -6.946 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -13.034 2.453 -6.008 1.00 0.00 C ATOM 0 H VAL B 212 -12.075 3.674 -8.117 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.350 0.886 -8.170 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.442 2.969 -7.556 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.437 1.212 -6.105 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.417 0.732 -7.818 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.217 0.056 -6.691 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.713 2.681 -5.186 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.405 1.606 -5.735 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -12.406 3.320 -6.211 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.316 2.567 -10.260 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.156 2.523 -11.449 1.00 0.00 C ATOM 1932 C GLU B 213 -14.394 1.915 -12.635 1.00 0.00 C ATOM 1933 O GLU B 213 -14.967 1.195 -13.453 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.703 3.936 -11.707 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.450 4.479 -10.469 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.701 3.668 -10.119 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.795 3.954 -10.650 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -17.590 2.769 -9.252 1.00 0.00 O ATOM 0 H GLU B 213 -14.213 3.509 -9.883 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.011 1.863 -11.301 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -14.882 4.606 -11.963 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.377 3.917 -12.563 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.773 4.479 -9.615 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.735 5.515 -10.650 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.084 2.163 -12.708 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.209 1.642 -13.747 1.00 0.00 C ATOM 1947 C GLN B 214 -12.021 0.130 -13.558 1.00 0.00 C ATOM 1948 O GLN B 214 -12.046 -0.623 -14.533 1.00 0.00 O ATOM 1949 CB GLN B 214 -10.886 2.409 -13.669 1.00 0.00 C ATOM 1950 CG GLN B 214 -9.863 2.118 -14.767 1.00 0.00 C ATOM 1951 CD GLN B 214 -9.100 0.800 -14.644 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -8.763 0.184 -15.648 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.750 0.368 -13.444 1.00 0.00 N ATOM 0 H GLN B 214 -12.596 2.746 -12.028 1.00 0.00 H new ATOM 0 HA GLN B 214 -12.639 1.782 -14.739 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.109 3.476 -13.684 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.423 2.194 -12.706 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -10.379 2.127 -15.727 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -9.139 2.933 -14.786 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -9.034 0.886 -12.613 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -8.196 -0.483 -13.350 1.00 0.00 H new ATOM 1962 N TYR B 215 -11.805 -0.315 -12.320 1.00 0.00 N ATOM 1963 CA TYR B 215 -11.618 -1.725 -12.000 1.00 0.00 C ATOM 1964 C TYR B 215 -12.935 -2.517 -12.005 1.00 0.00 C ATOM 1965 O TYR B 215 -12.878 -3.722 -12.272 1.00 0.00 O ATOM 1966 CB TYR B 215 -10.878 -1.889 -10.664 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.419 -1.457 -10.691 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -8.500 -2.105 -11.542 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -8.970 -0.424 -9.847 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.151 -1.703 -11.572 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.625 -0.014 -9.872 1.00 0.00 C ATOM 1972 CZ TYR B 215 -6.709 -0.647 -10.740 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.409 -0.240 -10.754 1.00 0.00 O ATOM 0 H TYR B 215 -11.755 0.299 -11.507 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.001 -2.148 -12.793 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.400 -1.312 -9.901 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -10.928 -2.935 -10.362 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -8.833 -2.915 -12.175 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.664 0.058 -9.175 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -6.454 -2.200 -12.230 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.293 0.786 -9.227 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.290 0.497 -10.119 1.00 0.00 H new ATOM 1983 N THR B 216 -14.095 -1.910 -11.727 1.00 0.00 N ATOM 1984 CA THR B 216 -15.373 -2.624 -11.734 1.00 0.00 C ATOM 1985 C THR B 216 -15.761 -3.022 -13.154 1.00 0.00 C ATOM 1986 O THR B 216 -15.508 -2.272 -14.104 1.00 0.00 O ATOM 1987 CB THR B 216 -16.513 -1.762 -11.166 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.490 -0.449 -11.686 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.459 -1.677 -9.645 1.00 0.00 C ATOM 0 H THR B 216 -14.172 -0.920 -11.493 1.00 0.00 H new ATOM 0 HA THR B 216 -15.235 -3.507 -11.109 1.00 0.00 H new ATOM 0 HB THR B 216 -17.436 -2.257 -11.469 1.00 0.00 H new ATOM 0 HG1 THR B 216 -16.052 -0.452 -12.563 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.282 -1.059 -9.286 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.545 -2.678 -9.221 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.512 -1.234 -9.339 1.00 0.00 H new