USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 172 GLN : amide:sc= -0.254 X(o=-0.32,f=-0.067) USER MOD Set 1.2: B 215 TYR OH : rot 180:sc= -0.0667 USER MOD Set 2.1: B 168 LYS NZ :NH3+ -111:sc= 0.869 (180deg=0) USER MOD Set 2.2: B 207 TYR OH : rot 80:sc= 0.761 USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.312 K(o=-0.31,f=-2.4!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.0782 X(o=-0.078,f=-0.56) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot 40:sc= 0.0453 USER MOD Single : B 170 THR OG1 : rot 91:sc= 1.25 USER MOD Single : B 177 ASN : amide:sc= 0 X(o=0,f=-0.23) USER MOD Single : B 180 GLN : amide:sc= 0 X(o=0,f=-0.098) USER MOD Single : B 183 THR OG1 : rot 79:sc= 0.259 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : B 186 MET CE :methyl 165:sc= -0.0644 (180deg=-0.506) USER MOD Single : B 187 GLN : amide:sc= 0.87 K(o=0.87,f=-0.098) USER MOD Single : B 188 LYS NZ :NH3+ -150:sc= -0.276 (180deg=-1.44!) USER MOD Single : B 190 GLN : amide:sc= 0.818 K(o=0.82,f=0) USER MOD Single : B 192 ASN : amide:sc= -0.304 X(o=-0.3,f=0) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : B 201 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 202 HIS : no HD1:sc= -0.235 X(o=-0.24,f=-0.71) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= 0 X(o=0,f=-0.017) 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 216 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.410 -12.038 2.245 1.00 0.00 N ATOM 132 CA GLU A 80 -10.934 -10.883 1.504 1.00 0.00 C ATOM 133 C GLU A 80 -9.968 -10.085 2.380 1.00 0.00 C ATOM 134 O GLU A 80 -8.965 -9.585 1.879 1.00 0.00 O ATOM 135 CB GLU A 80 -12.102 -9.987 1.057 1.00 0.00 C ATOM 136 CG GLU A 80 -13.324 -10.711 0.474 1.00 0.00 C ATOM 137 CD GLU A 80 -13.014 -11.707 -0.644 1.00 0.00 C ATOM 138 OE1 GLU A 80 -11.942 -11.607 -1.290 1.00 0.00 O ATOM 139 OE2 GLU A 80 -13.868 -12.612 -0.817 1.00 0.00 O ATOM 0 HA GLU A 80 -10.420 -11.232 0.609 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.429 -9.397 1.913 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.730 -9.286 0.310 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -13.833 -11.240 1.280 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -14.021 -9.965 0.092 1.00 0.00 H new ATOM 146 N PHE A 81 -10.255 -9.961 3.686 1.00 0.00 N ATOM 147 CA PHE A 81 -9.389 -9.226 4.599 1.00 0.00 C ATOM 148 C PHE A 81 -8.042 -9.930 4.752 1.00 0.00 C ATOM 149 O PHE A 81 -7.032 -9.252 4.919 1.00 0.00 O ATOM 150 CB PHE A 81 -10.032 -9.041 5.981 1.00 0.00 C ATOM 151 CG PHE A 81 -11.030 -7.901 6.088 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.596 -6.577 5.885 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.368 -8.144 6.452 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.497 -5.508 6.016 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.265 -7.070 6.602 1.00 0.00 C ATOM 156 CZ PHE A 81 -12.833 -5.752 6.372 1.00 0.00 C ATOM 0 H PHE A 81 -11.083 -10.364 4.126 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.236 -8.239 4.162 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.535 -9.968 6.256 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.240 -8.878 6.712 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.565 -6.383 5.627 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.707 -9.156 6.616 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.162 -4.496 5.843 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.287 -7.259 6.894 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.527 -4.930 6.469 1.00 0.00 H new ATOM 166 N ALA A 82 -8.008 -11.268 4.722 1.00 0.00 N ATOM 167 CA ALA A 82 -6.769 -12.018 4.865 1.00 0.00 C ATOM 168 C ALA A 82 -5.808 -11.620 3.745 1.00 0.00 C ATOM 169 O ALA A 82 -4.700 -11.151 4.023 1.00 0.00 O ATOM 170 CB ALA A 82 -7.048 -13.524 4.883 1.00 0.00 C ATOM 0 H ALA A 82 -8.836 -11.851 4.599 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.298 -11.777 5.818 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.109 -14.067 4.991 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.703 -13.763 5.721 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.531 -13.816 3.950 1.00 0.00 H new ATOM 176 N GLU A 83 -6.252 -11.765 2.496 1.00 0.00 N ATOM 177 CA GLU A 83 -5.464 -11.424 1.322 1.00 0.00 C ATOM 178 C GLU A 83 -5.166 -9.918 1.322 1.00 0.00 C ATOM 179 O GLU A 83 -4.023 -9.528 1.097 1.00 0.00 O ATOM 180 CB GLU A 83 -6.215 -11.896 0.069 1.00 0.00 C ATOM 181 CG GLU A 83 -5.484 -11.564 -1.238 1.00 0.00 C ATOM 182 CD GLU A 83 -4.138 -12.272 -1.403 1.00 0.00 C ATOM 183 OE1 GLU A 83 -4.114 -13.525 -1.465 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.099 -11.591 -1.556 1.00 0.00 O ATOM 0 H GLU A 83 -7.179 -12.127 2.274 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.499 -11.930 1.332 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.366 -12.974 0.129 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.203 -11.436 0.051 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.126 -11.829 -2.078 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.323 -10.487 -1.288 1.00 0.00 H new ATOM 191 N PHE A 84 -6.147 -9.061 1.631 1.00 0.00 N ATOM 192 CA PHE A 84 -5.971 -7.608 1.674 1.00 0.00 C ATOM 193 C PHE A 84 -4.824 -7.237 2.618 1.00 0.00 C ATOM 194 O PHE A 84 -3.924 -6.483 2.242 1.00 0.00 O ATOM 195 CB PHE A 84 -7.285 -6.948 2.109 1.00 0.00 C ATOM 196 CG PHE A 84 -7.196 -5.458 2.358 1.00 0.00 C ATOM 197 CD1 PHE A 84 -7.075 -4.573 1.272 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.225 -4.954 3.674 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.966 -3.191 1.499 1.00 0.00 C ATOM 200 CE2 PHE A 84 -7.142 -3.568 3.897 1.00 0.00 C ATOM 201 CZ PHE A 84 -7.011 -2.686 2.810 1.00 0.00 C ATOM 0 H PHE A 84 -7.094 -9.362 1.860 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.711 -7.243 0.680 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -8.038 -7.129 1.342 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.635 -7.434 3.020 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -7.066 -4.956 0.262 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.311 -5.632 4.510 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.847 -2.515 0.665 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.179 -3.181 4.904 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.945 -1.622 2.982 1.00 0.00 H new ATOM 211 N TYR A 85 -4.835 -7.768 3.843 1.00 0.00 N ATOM 212 CA TYR A 85 -3.790 -7.497 4.814 1.00 0.00 C ATOM 213 C TYR A 85 -2.457 -8.075 4.330 1.00 0.00 C ATOM 214 O TYR A 85 -1.409 -7.518 4.663 1.00 0.00 O ATOM 215 CB TYR A 85 -4.186 -8.005 6.207 1.00 0.00 C ATOM 216 CG TYR A 85 -5.277 -7.202 6.903 1.00 0.00 C ATOM 217 CD1 TYR A 85 -5.178 -5.800 7.001 1.00 0.00 C ATOM 218 CD2 TYR A 85 -6.374 -7.855 7.500 1.00 0.00 C ATOM 219 CE1 TYR A 85 -6.198 -5.054 7.616 1.00 0.00 C ATOM 220 CE2 TYR A 85 -7.388 -7.118 8.137 1.00 0.00 C ATOM 221 CZ TYR A 85 -7.317 -5.709 8.182 1.00 0.00 C ATOM 222 OH TYR A 85 -8.322 -5.001 8.772 1.00 0.00 O ATOM 0 H TYR A 85 -5.567 -8.393 4.181 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.661 -6.419 4.907 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.519 -9.039 6.118 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -3.299 -8.009 6.841 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -4.312 -5.295 6.600 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.436 -8.933 7.468 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -6.127 -3.977 7.657 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -8.222 -7.631 8.592 1.00 0.00 H new ATOM 0 HH TYR A 85 -9.007 -5.619 9.103 1.00 0.00 H new ATOM 232 N ASN A 86 -2.438 -9.184 3.580 1.00 0.00 N ATOM 233 CA ASN A 86 -1.199 -9.744 3.059 1.00 0.00 C ATOM 234 C ASN A 86 -0.633 -8.768 2.034 1.00 0.00 C ATOM 235 O ASN A 86 0.541 -8.422 2.130 1.00 0.00 O ATOM 236 CB ASN A 86 -1.416 -11.149 2.482 1.00 0.00 C ATOM 237 CG ASN A 86 -1.201 -12.239 3.521 1.00 0.00 C ATOM 238 OD1 ASN A 86 -0.690 -12.000 4.617 1.00 0.00 O ATOM 239 ND2 ASN A 86 -1.588 -13.464 3.219 1.00 0.00 N ATOM 0 H ASN A 86 -3.274 -9.708 3.323 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.475 -9.871 3.864 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.428 -11.224 2.084 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.733 -11.306 1.647 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -1.465 -14.219 3.894 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.010 -13.656 2.311 1.00 0.00 H new ATOM 246 N ARG A 87 -1.454 -8.263 1.106 1.00 0.00 N ATOM 247 CA ARG A 87 -1.005 -7.299 0.105 1.00 0.00 C ATOM 248 C ARG A 87 -0.503 -6.052 0.818 1.00 0.00 C ATOM 249 O ARG A 87 0.559 -5.551 0.464 1.00 0.00 O ATOM 250 CB ARG A 87 -2.139 -6.970 -0.878 1.00 0.00 C ATOM 251 CG ARG A 87 -2.585 -8.153 -1.742 1.00 0.00 C ATOM 252 CD ARG A 87 -1.452 -8.615 -2.653 1.00 0.00 C ATOM 253 NE ARG A 87 -1.824 -9.810 -3.409 1.00 0.00 N ATOM 254 CZ ARG A 87 -1.663 -9.997 -4.720 1.00 0.00 C ATOM 255 NH1 ARG A 87 -1.214 -9.029 -5.516 1.00 0.00 N ATOM 256 NH2 ARG A 87 -1.977 -11.176 -5.230 1.00 0.00 N ATOM 0 H ARG A 87 -2.440 -8.511 1.031 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.190 -7.724 -0.481 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.997 -6.602 -0.315 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.815 -6.160 -1.531 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.903 -8.977 -1.103 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.447 -7.865 -2.344 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -1.190 -7.814 -3.344 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -0.565 -8.823 -2.055 1.00 0.00 H new ATOM 0 HE ARG A 87 -2.248 -10.575 -2.883 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -0.983 -8.115 -5.127 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -1.101 -9.201 -6.515 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -2.333 -11.915 -4.624 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -1.864 -11.346 -6.229 1.00 0.00 H new ATOM 270 N LEU A 88 -1.213 -5.562 1.843 1.00 0.00 N ATOM 271 CA LEU A 88 -0.770 -4.392 2.601 1.00 0.00 C ATOM 272 C LEU A 88 0.650 -4.650 3.093 1.00 0.00 C ATOM 273 O LEU A 88 1.544 -3.839 2.855 1.00 0.00 O ATOM 274 CB LEU A 88 -1.688 -4.101 3.805 1.00 0.00 C ATOM 275 CG LEU A 88 -2.847 -3.139 3.506 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.890 -3.217 4.621 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.313 -1.705 3.434 1.00 0.00 C ATOM 0 H LEU A 88 -2.096 -5.960 2.164 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.807 -3.521 1.947 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -2.099 -5.043 4.168 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -1.086 -3.684 4.612 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.303 -3.419 2.556 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.709 -2.532 4.402 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.276 -4.234 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.430 -2.941 5.570 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.135 -1.021 3.222 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.856 -1.439 4.387 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.568 -1.634 2.642 1.00 0.00 H new ATOM 289 N LYS A 89 0.854 -5.776 3.774 1.00 0.00 N ATOM 290 CA LYS A 89 2.137 -6.187 4.321 1.00 0.00 C ATOM 291 C LYS A 89 3.206 -6.363 3.232 1.00 0.00 C ATOM 292 O LYS A 89 4.381 -6.124 3.522 1.00 0.00 O ATOM 293 CB LYS A 89 1.886 -7.449 5.158 1.00 0.00 C ATOM 294 CG LYS A 89 3.140 -7.960 5.868 1.00 0.00 C ATOM 295 CD LYS A 89 2.814 -9.038 6.903 1.00 0.00 C ATOM 296 CE LYS A 89 2.235 -8.420 8.176 1.00 0.00 C ATOM 297 NZ LYS A 89 2.098 -9.414 9.256 1.00 0.00 N ATOM 0 H LYS A 89 0.107 -6.444 3.964 1.00 0.00 H new ATOM 0 HA LYS A 89 2.553 -5.410 4.962 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.117 -7.238 5.901 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.497 -8.235 4.511 1.00 0.00 H new ATOM 0 HG2 LYS A 89 3.835 -8.363 5.131 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.644 -7.127 6.359 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.101 -9.747 6.482 1.00 0.00 H new ATOM 0 HD3 LYS A 89 3.717 -9.599 7.145 1.00 0.00 H new ATOM 0 HE2 LYS A 89 2.879 -7.607 8.510 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.260 -7.985 7.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 1.702 -8.956 10.102 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 1.463 -10.177 8.947 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.032 -9.811 9.483 1.00 0.00 H new ATOM 311 N GLN A 90 2.851 -6.745 2.002 1.00 0.00 N ATOM 312 CA GLN A 90 3.801 -6.927 0.917 1.00 0.00 C ATOM 313 C GLN A 90 4.398 -5.565 0.534 1.00 0.00 C ATOM 314 O GLN A 90 5.618 -5.444 0.402 1.00 0.00 O ATOM 315 CB GLN A 90 3.146 -7.728 -0.237 1.00 0.00 C ATOM 316 CG GLN A 90 2.847 -6.946 -1.518 1.00 0.00 C ATOM 317 CD GLN A 90 2.512 -7.834 -2.714 1.00 0.00 C ATOM 318 OE1 GLN A 90 1.850 -8.865 -2.597 1.00 0.00 O ATOM 319 NE2 GLN A 90 2.964 -7.457 -3.897 1.00 0.00 N ATOM 0 H GLN A 90 1.885 -6.937 1.736 1.00 0.00 H new ATOM 0 HA GLN A 90 4.650 -7.539 1.223 1.00 0.00 H new ATOM 0 HB2 GLN A 90 3.801 -8.562 -0.490 1.00 0.00 H new ATOM 0 HB3 GLN A 90 2.213 -8.155 0.129 1.00 0.00 H new ATOM 0 HG2 GLN A 90 2.013 -6.269 -1.334 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.710 -6.328 -1.766 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.512 -6.601 -3.985 1.00 0.00 H new ATOM 0 HE22 GLN A 90 2.765 -8.022 -4.723 1.00 0.00 H new ATOM 328 N ILE A 91 3.547 -4.539 0.407 1.00 0.00 N ATOM 329 CA ILE A 91 3.933 -3.181 0.033 1.00 0.00 C ATOM 330 C ILE A 91 4.992 -2.639 0.994 1.00 0.00 C ATOM 331 O ILE A 91 6.058 -2.220 0.550 1.00 0.00 O ATOM 332 CB ILE A 91 2.678 -2.267 -0.027 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.733 -2.730 -1.154 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.031 -0.783 -0.240 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.350 -2.073 -1.111 1.00 0.00 C ATOM 0 H ILE A 91 2.544 -4.638 0.567 1.00 0.00 H new ATOM 0 HA ILE A 91 4.379 -3.196 -0.961 1.00 0.00 H new ATOM 0 HB ILE A 91 2.184 -2.354 0.941 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.197 -2.514 -2.116 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.613 -3.812 -1.093 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.115 -0.192 -0.274 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.656 -0.436 0.583 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.571 -0.669 -1.180 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.257 -2.449 -1.935 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.136 -2.310 -0.164 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.458 -0.992 -1.203 1.00 0.00 H new ATOM 347 N LYS A 92 4.724 -2.683 2.305 1.00 0.00 N ATOM 348 CA LYS A 92 5.621 -2.164 3.343 1.00 0.00 C ATOM 349 C LYS A 92 7.087 -2.530 3.112 1.00 0.00 C ATOM 350 O LYS A 92 7.960 -1.664 3.181 1.00 0.00 O ATOM 351 CB LYS A 92 5.173 -2.578 4.764 1.00 0.00 C ATOM 352 CG LYS A 92 3.662 -2.531 5.016 1.00 0.00 C ATOM 353 CD LYS A 92 3.266 -2.691 6.494 1.00 0.00 C ATOM 354 CE LYS A 92 2.074 -1.812 6.910 1.00 0.00 C ATOM 355 NZ LYS A 92 0.805 -2.091 6.207 1.00 0.00 N ATOM 0 H LYS A 92 3.865 -3.086 2.679 1.00 0.00 H new ATOM 0 HA LYS A 92 5.548 -1.079 3.267 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.525 -3.591 4.957 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.665 -1.927 5.486 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.272 -1.582 4.647 1.00 0.00 H new ATOM 0 HG3 LYS A 92 3.183 -3.319 4.435 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.021 -3.736 6.685 1.00 0.00 H new ATOM 0 HD3 LYS A 92 4.124 -2.446 7.120 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.911 -1.934 7.981 1.00 0.00 H new ATOM 0 HE3 LYS A 92 2.339 -0.768 6.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 0.066 -1.449 6.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.935 -1.946 5.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.520 -3.075 6.383 1.00 0.00 H new ATOM 1028 N SER B 160 3.624 9.586 -1.730 1.00 0.00 N ATOM 1029 CA SER B 160 4.691 8.613 -1.585 1.00 0.00 C ATOM 1030 C SER B 160 4.275 7.302 -2.259 1.00 0.00 C ATOM 1031 O SER B 160 3.096 6.935 -2.254 1.00 0.00 O ATOM 1032 CB SER B 160 4.988 8.441 -0.095 1.00 0.00 C ATOM 1033 OG SER B 160 5.557 9.639 0.400 1.00 0.00 O ATOM 0 HA SER B 160 5.606 8.948 -2.074 1.00 0.00 H new ATOM 0 HB2 SER B 160 4.072 8.206 0.447 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.672 7.607 0.059 1.00 0.00 H new ATOM 0 HG SER B 160 5.100 10.408 -0.001 1.00 0.00 H new ATOM 1039 N ALA B 161 5.253 6.559 -2.790 1.00 0.00 N ATOM 1040 CA ALA B 161 5.034 5.287 -3.482 1.00 0.00 C ATOM 1041 C ALA B 161 4.280 4.258 -2.630 1.00 0.00 C ATOM 1042 O ALA B 161 3.519 3.456 -3.168 1.00 0.00 O ATOM 1043 CB ALA B 161 6.386 4.725 -3.921 1.00 0.00 C ATOM 0 H ALA B 161 6.235 6.831 -2.749 1.00 0.00 H new ATOM 0 HA ALA B 161 4.401 5.485 -4.347 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.236 3.777 -4.438 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.873 5.432 -4.593 1.00 0.00 H new ATOM 0 HB3 ALA B 161 7.015 4.565 -3.045 1.00 0.00 H new ATOM 1049 N PHE B 162 4.502 4.282 -1.313 1.00 0.00 N ATOM 1050 CA PHE B 162 3.859 3.388 -0.362 1.00 0.00 C ATOM 1051 C PHE B 162 2.360 3.638 -0.420 1.00 0.00 C ATOM 1052 O PHE B 162 1.583 2.742 -0.748 1.00 0.00 O ATOM 1053 CB PHE B 162 4.467 3.636 1.035 1.00 0.00 C ATOM 1054 CG PHE B 162 4.098 2.676 2.161 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.757 2.334 2.441 1.00 0.00 C ATOM 1056 CD2 PHE B 162 5.117 2.191 3.009 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.449 1.511 3.535 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.804 1.383 4.116 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.467 1.042 4.372 1.00 0.00 C ATOM 0 H PHE B 162 5.148 4.939 -0.875 1.00 0.00 H new ATOM 0 HA PHE B 162 4.027 2.338 -0.600 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.552 3.628 0.932 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.184 4.641 1.348 1.00 0.00 H new ATOM 0 HD1 PHE B 162 1.964 2.708 1.810 1.00 0.00 H new ATOM 0 HD2 PHE B 162 6.147 2.443 2.805 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.423 1.239 3.731 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.589 1.026 4.766 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.223 0.416 5.218 1.00 0.00 H new ATOM 1069 N ASP B 163 1.956 4.870 -0.113 1.00 0.00 N ATOM 1070 CA ASP B 163 0.558 5.271 -0.101 1.00 0.00 C ATOM 1071 C ASP B 163 -0.080 5.037 -1.462 1.00 0.00 C ATOM 1072 O ASP B 163 -1.225 4.605 -1.536 1.00 0.00 O ATOM 1073 CB ASP B 163 0.420 6.748 0.264 1.00 0.00 C ATOM 1074 CG ASP B 163 0.910 7.048 1.668 1.00 0.00 C ATOM 1075 OD1 ASP B 163 0.315 6.536 2.638 1.00 0.00 O ATOM 1076 OD2 ASP B 163 1.893 7.809 1.799 1.00 0.00 O ATOM 0 H ASP B 163 2.599 5.621 0.136 1.00 0.00 H new ATOM 0 HA ASP B 163 0.049 4.665 0.648 1.00 0.00 H new ATOM 0 HB2 ASP B 163 0.983 7.349 -0.450 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -0.625 7.044 0.176 1.00 0.00 H new ATOM 1081 N LEU B 164 0.652 5.303 -2.547 1.00 0.00 N ATOM 1082 CA LEU B 164 0.168 5.115 -3.906 1.00 0.00 C ATOM 1083 C LEU B 164 -0.335 3.686 -4.104 1.00 0.00 C ATOM 1084 O LEU B 164 -1.458 3.499 -4.582 1.00 0.00 O ATOM 1085 CB LEU B 164 1.286 5.453 -4.905 1.00 0.00 C ATOM 1086 CG LEU B 164 0.927 5.146 -6.369 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.210 6.051 -6.861 1.00 0.00 C ATOM 1088 CD2 LEU B 164 2.182 5.304 -7.231 1.00 0.00 C ATOM 0 H LEU B 164 1.607 5.659 -2.500 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.671 5.788 -4.083 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.532 6.511 -4.816 1.00 0.00 H new ATOM 0 HB3 LEU B 164 2.182 4.894 -4.636 1.00 0.00 H new ATOM 0 HG LEU B 164 0.568 4.120 -6.447 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.442 5.812 -7.899 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.095 5.891 -6.245 1.00 0.00 H new ATOM 0 HD13 LEU B 164 0.098 7.094 -6.790 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.938 5.088 -8.271 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.553 6.326 -7.149 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.949 4.611 -6.887 1.00 0.00 H new ATOM 1100 N ASP B 165 0.497 2.693 -3.774 1.00 0.00 N ATOM 1101 CA ASP B 165 0.102 1.301 -3.935 1.00 0.00 C ATOM 1102 C ASP B 165 -0.996 0.936 -2.931 1.00 0.00 C ATOM 1103 O ASP B 165 -1.900 0.189 -3.280 1.00 0.00 O ATOM 1104 CB ASP B 165 1.312 0.356 -3.893 1.00 0.00 C ATOM 1105 CG ASP B 165 0.997 -1.033 -4.476 1.00 0.00 C ATOM 1106 OD1 ASP B 165 -0.102 -1.271 -5.017 1.00 0.00 O ATOM 1107 OD2 ASP B 165 1.901 -1.901 -4.527 1.00 0.00 O ATOM 0 H ASP B 165 1.436 2.830 -3.399 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.327 1.173 -4.929 1.00 0.00 H new ATOM 0 HB2 ASP B 165 2.136 0.802 -4.450 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.647 0.246 -2.862 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.003 1.486 -1.706 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.056 1.184 -0.725 1.00 0.00 C ATOM 1114 C VAL B 166 -3.415 1.611 -1.298 1.00 0.00 C ATOM 1115 O VAL B 166 -4.390 0.859 -1.200 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.754 1.841 0.639 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -2.954 1.794 1.607 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.571 1.125 1.308 1.00 0.00 C ATOM 0 H VAL B 166 -0.294 2.139 -1.373 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.087 0.110 -0.540 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.523 2.887 0.435 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.681 2.271 2.548 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.799 2.322 1.165 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.231 0.756 1.793 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.361 1.591 2.270 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.820 0.075 1.460 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.309 1.200 0.669 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.496 2.795 -1.908 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.726 3.297 -2.509 1.00 0.00 C ATOM 1130 C VAL B 167 -5.117 2.368 -3.668 1.00 0.00 C ATOM 1131 O VAL B 167 -6.250 1.887 -3.694 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.541 4.771 -2.931 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.808 5.324 -3.577 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.258 5.693 -1.734 1.00 0.00 C ATOM 0 H VAL B 167 -2.705 3.433 -1.998 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.549 3.291 -1.794 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.698 4.762 -3.622 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.647 6.363 -3.863 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -6.051 4.737 -4.463 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.633 5.267 -2.867 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.136 6.718 -2.085 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.092 5.646 -1.034 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.345 5.370 -1.234 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.204 2.082 -4.605 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.463 1.204 -5.755 1.00 0.00 C ATOM 1146 C LYS B 168 -4.940 -0.183 -5.303 1.00 0.00 C ATOM 1147 O LYS B 168 -5.912 -0.705 -5.854 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.199 1.141 -6.627 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.092 2.409 -7.498 1.00 0.00 C ATOM 1150 CD LYS B 168 -1.706 2.618 -8.120 1.00 0.00 C ATOM 1151 CE LYS B 168 -1.718 2.259 -9.609 1.00 0.00 C ATOM 1152 NZ LYS B 168 -2.293 3.314 -10.466 1.00 0.00 N ATOM 0 H LYS B 168 -3.256 2.457 -4.587 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.275 1.614 -6.356 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.316 1.049 -5.995 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.230 0.256 -7.262 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -3.833 2.354 -8.295 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.342 3.278 -6.890 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.399 3.656 -7.994 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -0.972 2.003 -7.599 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -0.698 2.055 -9.933 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -2.287 1.339 -9.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -3.201 2.989 -10.854 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -2.445 4.175 -9.902 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -1.638 3.523 -11.246 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.294 -0.773 -4.297 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.610 -2.070 -3.716 1.00 0.00 C ATOM 1168 C LEU B 169 -6.045 -2.007 -3.209 1.00 0.00 C ATOM 1169 O LEU B 169 -6.885 -2.795 -3.642 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.610 -2.340 -2.565 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.654 -3.690 -1.814 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -3.127 -3.508 -0.387 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -5.008 -4.377 -1.699 1.00 0.00 C ATOM 0 H LEU B 169 -3.494 -0.332 -3.844 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.525 -2.880 -4.440 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.606 -2.227 -2.973 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.744 -1.551 -1.825 1.00 0.00 H new ATOM 0 HG LEU B 169 -3.036 -4.337 -2.437 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -3.160 -4.463 0.138 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -2.098 -3.149 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.747 -2.783 0.140 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.896 -5.312 -1.150 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.703 -3.726 -1.168 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.396 -4.586 -2.696 1.00 0.00 H new ATOM 1185 N THR B 170 -6.325 -1.070 -2.301 1.00 0.00 N ATOM 1186 CA THR B 170 -7.644 -0.899 -1.718 1.00 0.00 C ATOM 1187 C THR B 170 -8.691 -0.757 -2.818 1.00 0.00 C ATOM 1188 O THR B 170 -9.699 -1.461 -2.762 1.00 0.00 O ATOM 1189 CB THR B 170 -7.648 0.282 -0.729 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.588 0.166 0.200 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.953 0.339 0.077 1.00 0.00 C ATOM 0 H THR B 170 -5.633 -0.407 -1.951 1.00 0.00 H new ATOM 0 HA THR B 170 -7.906 -1.787 -1.143 1.00 0.00 H new ATOM 0 HB THR B 170 -7.539 1.185 -1.330 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.799 0.635 -0.143 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.920 1.185 0.764 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.796 0.457 -0.604 1.00 0.00 H new ATOM 0 HG23 THR B 170 -9.071 -0.585 0.644 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.441 0.097 -3.817 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.333 0.360 -4.935 1.00 0.00 C ATOM 1201 C ALA B 171 -9.651 -0.919 -5.713 1.00 0.00 C ATOM 1202 O ALA B 171 -10.793 -1.129 -6.115 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.721 1.424 -5.842 1.00 0.00 C ATOM 0 H ALA B 171 -7.579 0.640 -3.864 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.279 0.735 -4.544 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.392 1.619 -6.679 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.572 2.343 -5.275 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -7.762 1.071 -6.221 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.660 -1.783 -5.929 1.00 0.00 N ATOM 1210 CA GLN B 172 -8.856 -3.038 -6.639 1.00 0.00 C ATOM 1211 C GLN B 172 -9.787 -3.951 -5.837 1.00 0.00 C ATOM 1212 O GLN B 172 -10.753 -4.471 -6.391 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.494 -3.702 -6.903 1.00 0.00 C ATOM 1214 CG GLN B 172 -6.831 -3.070 -8.134 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.415 -3.550 -8.437 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -4.663 -2.847 -9.111 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -5.015 -4.730 -8.004 1.00 0.00 N ATOM 0 H GLN B 172 -7.702 -1.629 -5.616 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.329 -2.848 -7.603 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -6.849 -3.586 -6.032 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.627 -4.772 -7.061 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.457 -3.268 -9.004 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.808 -1.989 -7.998 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -5.643 -5.308 -7.446 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -4.078 -5.064 -8.227 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.548 -4.115 -4.535 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.368 -4.983 -3.696 1.00 0.00 C ATOM 1228 C PHE B 173 -11.801 -4.455 -3.581 1.00 0.00 C ATOM 1229 O PHE B 173 -12.743 -5.237 -3.703 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.700 -5.210 -2.332 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.556 -6.219 -2.358 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.477 -6.074 -3.255 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.578 -7.338 -1.501 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.437 -7.012 -3.283 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.534 -8.282 -1.533 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.458 -8.114 -2.420 1.00 0.00 C ATOM 0 H PHE B 173 -8.787 -3.653 -4.038 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.443 -5.959 -4.175 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.321 -4.257 -1.962 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.454 -5.550 -1.622 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.452 -5.230 -3.928 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.401 -7.472 -0.815 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.616 -6.885 -3.973 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -7.561 -9.137 -0.874 1.00 0.00 H new ATOM 0 HZ PHE B 173 -5.651 -8.831 -2.436 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.008 -3.151 -3.381 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.361 -2.587 -3.276 1.00 0.00 C ATOM 1248 C VAL B 174 -14.109 -2.722 -4.615 1.00 0.00 C ATOM 1249 O VAL B 174 -15.336 -2.777 -4.637 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.314 -1.126 -2.784 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.669 -0.990 -1.393 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.605 -0.196 -3.739 1.00 0.00 C ATOM 0 H VAL B 174 -11.259 -2.465 -3.288 1.00 0.00 H new ATOM 0 HA VAL B 174 -13.918 -3.156 -2.532 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.361 -0.830 -2.726 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.662 0.059 -1.096 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.242 -1.569 -0.668 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.646 -1.364 -1.428 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.608 0.815 -3.332 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.576 -0.529 -3.875 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.118 -0.202 -4.701 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.387 -2.795 -5.734 1.00 0.00 N ATOM 1263 CA ALA B 175 -13.957 -2.942 -7.068 1.00 0.00 C ATOM 1264 C ALA B 175 -14.227 -4.399 -7.445 1.00 0.00 C ATOM 1265 O ALA B 175 -14.965 -4.655 -8.393 1.00 0.00 O ATOM 1266 CB ALA B 175 -12.986 -2.381 -8.096 1.00 0.00 C ATOM 0 H ALA B 175 -12.368 -2.752 -5.735 1.00 0.00 H new ATOM 0 HA ALA B 175 -14.905 -2.404 -7.060 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.410 -2.490 -9.094 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -12.808 -1.325 -7.890 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.043 -2.925 -8.041 1.00 0.00 H new ATOM 1272 N ARG B 176 -13.611 -5.351 -6.747 1.00 0.00 N ATOM 1273 CA ARG B 176 -13.778 -6.778 -6.999 1.00 0.00 C ATOM 1274 C ARG B 176 -14.819 -7.364 -6.061 1.00 0.00 C ATOM 1275 O ARG B 176 -15.611 -8.202 -6.492 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.420 -7.467 -6.832 1.00 0.00 C ATOM 1277 CG ARG B 176 -11.533 -7.187 -8.055 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.061 -7.547 -7.821 1.00 0.00 C ATOM 1279 NE ARG B 176 -9.894 -8.930 -7.359 1.00 0.00 N ATOM 1280 CZ ARG B 176 -9.860 -10.037 -8.109 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -9.987 -9.983 -9.435 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -9.679 -11.210 -7.520 1.00 0.00 N ATOM 0 H ARG B 176 -12.972 -5.148 -5.978 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.135 -6.939 -8.016 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -11.930 -7.108 -5.927 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -12.561 -8.541 -6.713 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -11.909 -7.753 -8.907 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -11.606 -6.131 -8.316 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -9.503 -7.405 -8.746 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -9.635 -6.866 -7.084 1.00 0.00 H new ATOM 0 HE ARG B 176 -9.792 -9.062 -6.353 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -10.113 -9.083 -9.899 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -9.958 -10.841 -9.985 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -9.568 -11.260 -6.507 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -9.651 -12.063 -8.079 1.00 0.00 H new ATOM 1296 N ASN B 177 -14.820 -6.903 -4.808 1.00 0.00 N ATOM 1297 CA ASN B 177 -15.738 -7.346 -3.769 1.00 0.00 C ATOM 1298 C ASN B 177 -16.991 -6.493 -3.726 1.00 0.00 C ATOM 1299 O ASN B 177 -18.072 -7.036 -3.506 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.066 -7.309 -2.389 1.00 0.00 C ATOM 1301 CG ASN B 177 -13.903 -8.281 -2.327 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.060 -9.454 -2.650 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -12.719 -7.818 -1.972 1.00 0.00 N ATOM 0 H ASN B 177 -14.163 -6.193 -4.485 1.00 0.00 H new ATOM 0 HA ASN B 177 -16.016 -8.371 -4.014 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.713 -6.299 -2.179 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -15.795 -7.558 -1.618 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -11.910 -8.440 -1.962 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.613 -6.839 -1.707 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.875 -5.178 -3.905 1.00 0.00 N ATOM 1311 CA GLY B 178 -17.999 -4.254 -3.884 1.00 0.00 C ATOM 1312 C GLY B 178 -17.891 -3.224 -2.760 1.00 0.00 C ATOM 1313 O GLY B 178 -16.963 -3.212 -1.943 1.00 0.00 O ATOM 0 H GLY B 178 -15.979 -4.720 -4.072 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -18.057 -3.737 -4.842 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -18.925 -4.817 -3.769 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.883 -2.337 -2.724 1.00 0.00 N ATOM 1318 CA ARG B 179 -19.027 -1.250 -1.767 1.00 0.00 C ATOM 1319 C ARG B 179 -19.084 -1.756 -0.331 1.00 0.00 C ATOM 1320 O ARG B 179 -18.554 -1.061 0.531 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.291 -0.450 -2.131 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.606 0.745 -1.222 1.00 0.00 C ATOM 1323 CD ARG B 179 -19.472 1.777 -1.186 1.00 0.00 C ATOM 1324 NE ARG B 179 -19.990 3.133 -0.937 1.00 0.00 N ATOM 1325 CZ ARG B 179 -19.548 4.285 -1.460 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -18.601 4.293 -2.391 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -20.062 5.442 -1.055 1.00 0.00 N ATOM 0 H ARG B 179 -19.647 -2.361 -3.399 1.00 0.00 H new ATOM 0 HA ARG B 179 -18.150 -0.604 -1.823 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.188 -0.088 -3.154 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.144 -1.128 -2.118 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -21.520 1.228 -1.567 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.797 0.386 -0.211 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -18.758 1.509 -0.407 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -18.932 1.760 -2.133 1.00 0.00 H new ATOM 0 HE ARG B 179 -20.777 3.204 -0.291 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -18.200 3.414 -2.718 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -18.275 5.178 -2.779 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -20.794 5.454 -0.345 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -19.724 6.318 -1.454 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.679 -2.918 -0.043 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.742 -3.419 1.331 1.00 0.00 C ATOM 1343 C GLN B 180 -18.332 -3.543 1.919 1.00 0.00 C ATOM 1344 O GLN B 180 -18.108 -3.059 3.030 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.541 -4.724 1.398 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.523 -5.409 2.775 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.273 -6.736 2.743 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -22.383 -6.813 2.229 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -20.696 -7.813 3.237 1.00 0.00 N ATOM 0 H GLN B 180 -20.119 -3.523 -0.736 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.278 -2.701 1.952 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.575 -4.517 1.122 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -20.145 -5.417 0.656 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -19.492 -5.579 3.086 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -20.975 -4.751 3.517 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -19.772 -7.746 3.664 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -21.173 -8.713 3.192 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.389 -4.152 1.189 1.00 0.00 N ATOM 1359 CA PHE B 181 -16.001 -4.313 1.628 1.00 0.00 C ATOM 1360 C PHE B 181 -15.417 -2.932 1.975 1.00 0.00 C ATOM 1361 O PHE B 181 -14.716 -2.790 2.978 1.00 0.00 O ATOM 1362 CB PHE B 181 -15.216 -5.051 0.519 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.716 -5.198 0.727 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -12.871 -4.104 0.470 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -13.147 -6.416 1.145 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -11.486 -4.198 0.676 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.762 -6.503 1.384 1.00 0.00 C ATOM 1368 CZ PHE B 181 -10.932 -5.395 1.154 1.00 0.00 C ATOM 0 H PHE B 181 -17.572 -4.550 0.268 1.00 0.00 H new ATOM 0 HA PHE B 181 -15.932 -4.918 2.532 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.643 -6.047 0.405 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -15.379 -4.525 -0.421 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -13.294 -3.178 0.109 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -13.774 -7.285 1.283 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -10.849 -3.352 0.467 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -11.336 -7.427 1.746 1.00 0.00 H new ATOM 0 HZ PHE B 181 -9.871 -5.464 1.344 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.714 -1.910 1.159 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.253 -0.537 1.369 1.00 0.00 C ATOM 1380 C LEU B 182 -15.846 -0.011 2.676 1.00 0.00 C ATOM 1381 O LEU B 182 -15.120 0.467 3.541 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.677 0.364 0.187 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.813 1.624 -0.024 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.416 2.476 -1.141 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.649 2.515 1.203 1.00 0.00 C ATOM 0 H LEU B 182 -16.289 -2.019 0.324 1.00 0.00 H new ATOM 0 HA LEU B 182 -14.165 -0.525 1.428 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.654 -0.229 -0.727 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.711 0.674 0.340 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.822 1.244 -0.271 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.805 3.366 -1.290 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.445 1.898 -2.064 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.428 2.772 -0.866 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -14.025 3.372 0.949 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.628 2.863 1.533 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.177 1.947 2.004 1.00 0.00 H new ATOM 1397 N THR B 183 -17.164 -0.107 2.842 1.00 0.00 N ATOM 1398 CA THR B 183 -17.851 0.364 4.030 1.00 0.00 C ATOM 1399 C THR B 183 -17.259 -0.278 5.285 1.00 0.00 C ATOM 1400 O THR B 183 -17.033 0.446 6.252 1.00 0.00 O ATOM 1401 CB THR B 183 -19.353 0.092 3.891 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.856 0.669 2.697 1.00 0.00 O ATOM 1403 CG2 THR B 183 -20.145 0.690 5.054 1.00 0.00 C ATOM 0 H THR B 183 -17.785 -0.519 2.146 1.00 0.00 H new ATOM 0 HA THR B 183 -17.712 1.440 4.133 1.00 0.00 H new ATOM 0 HB THR B 183 -19.472 -0.991 3.880 1.00 0.00 H new ATOM 0 HG1 THR B 183 -19.629 0.095 1.936 1.00 0.00 H new ATOM 0 HG21 THR B 183 -21.205 0.476 4.920 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.802 0.252 5.991 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.993 1.769 5.081 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.987 -1.591 5.289 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.408 -2.263 6.452 1.00 0.00 C ATOM 1413 C GLN B 184 -15.105 -1.567 6.846 1.00 0.00 C ATOM 1414 O GLN B 184 -14.889 -1.238 8.017 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.123 -3.742 6.160 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.371 -4.585 5.879 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.229 -5.996 6.444 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -17.061 -6.183 7.642 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.272 -7.024 5.618 1.00 0.00 N ATOM 0 H GLN B 184 -17.161 -2.207 4.495 1.00 0.00 H new ATOM 0 HA GLN B 184 -17.128 -2.208 7.268 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.455 -3.808 5.302 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.593 -4.172 7.010 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.244 -4.102 6.317 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.542 -4.637 4.804 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -17.412 -6.870 4.619 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.165 -7.972 5.978 1.00 0.00 H new ATOM 1428 N LEU B 185 -14.238 -1.341 5.856 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.958 -0.677 6.027 1.00 0.00 C ATOM 1430 C LEU B 185 -13.150 0.726 6.609 1.00 0.00 C ATOM 1431 O LEU B 185 -12.416 1.097 7.529 1.00 0.00 O ATOM 1432 CB LEU B 185 -12.211 -0.637 4.676 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.291 -1.835 4.400 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.706 -1.697 2.990 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -10.127 -1.921 5.399 1.00 0.00 C ATOM 0 H LEU B 185 -14.418 -1.624 4.893 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.351 -1.239 6.737 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.947 -0.573 3.874 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.615 0.275 4.636 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.891 -2.739 4.500 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -10.051 -2.543 2.784 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.516 -1.679 2.260 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -10.135 -0.771 2.922 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.506 -2.785 5.161 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.526 -1.014 5.336 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.522 -2.026 6.410 1.00 0.00 H new ATOM 1447 N MET B 186 -14.135 1.494 6.126 1.00 0.00 N ATOM 1448 CA MET B 186 -14.378 2.846 6.625 1.00 0.00 C ATOM 1449 C MET B 186 -14.885 2.864 8.063 1.00 0.00 C ATOM 1450 O MET B 186 -14.776 3.910 8.706 1.00 0.00 O ATOM 1451 CB MET B 186 -15.382 3.610 5.752 1.00 0.00 C ATOM 1452 CG MET B 186 -14.882 3.769 4.320 1.00 0.00 C ATOM 1453 SD MET B 186 -15.596 5.151 3.392 1.00 0.00 S ATOM 1454 CE MET B 186 -14.682 6.515 4.153 1.00 0.00 C ATOM 0 H MET B 186 -14.775 1.198 5.389 1.00 0.00 H new ATOM 0 HA MET B 186 -13.406 3.338 6.586 1.00 0.00 H new ATOM 0 HB2 MET B 186 -16.335 3.082 5.747 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.565 4.594 6.184 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.799 3.891 4.344 1.00 0.00 H new ATOM 0 HG3 MET B 186 -15.087 2.846 3.778 1.00 0.00 H new ATOM 0 HE1 MET B 186 -14.786 7.410 3.539 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.081 6.710 5.148 1.00 0.00 H new ATOM 0 HE3 MET B 186 -13.628 6.248 4.230 1.00 0.00 H new ATOM 1464 N GLN B 187 -15.458 1.766 8.569 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.953 1.716 9.937 1.00 0.00 C ATOM 1466 C GLN B 187 -14.804 1.418 10.888 1.00 0.00 C ATOM 1467 O GLN B 187 -14.528 2.219 11.779 1.00 0.00 O ATOM 1468 CB GLN B 187 -17.064 0.674 10.132 1.00 0.00 C ATOM 1469 CG GLN B 187 -18.326 0.831 9.271 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.621 2.257 8.804 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -18.959 3.144 9.583 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.460 2.513 7.520 1.00 0.00 N ATOM 0 H GLN B 187 -15.588 0.901 8.045 1.00 0.00 H new ATOM 0 HA GLN B 187 -16.385 2.693 10.155 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.642 -0.312 9.937 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -17.364 0.691 11.180 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -18.230 0.191 8.394 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -19.182 0.467 9.839 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.179 1.768 6.883 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.617 3.456 7.164 1.00 0.00 H new ATOM 1481 N LYS B 188 -14.122 0.284 10.697 1.00 0.00 N ATOM 1482 CA LYS B 188 -13.020 -0.095 11.574 1.00 0.00 C ATOM 1483 C LYS B 188 -11.898 0.937 11.574 1.00 0.00 C ATOM 1484 O LYS B 188 -11.363 1.261 12.631 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.553 -1.530 11.289 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.893 -1.725 9.918 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.299 -3.120 9.692 1.00 0.00 C ATOM 1488 CE LYS B 188 -12.302 -4.210 9.290 1.00 0.00 C ATOM 1489 NZ LYS B 188 -13.290 -4.529 10.340 1.00 0.00 N ATOM 0 H LYS B 188 -14.315 -0.380 9.947 1.00 0.00 H new ATOM 0 HA LYS B 188 -13.391 -0.098 12.599 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.847 -1.829 12.064 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.410 -2.199 11.364 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.632 -1.528 9.142 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -11.103 -0.984 9.800 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -10.536 -3.049 8.917 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.796 -3.434 10.607 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -12.831 -3.890 8.392 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -11.755 -5.117 9.032 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -13.577 -5.525 10.256 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -12.866 -4.369 11.276 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -14.124 -3.918 10.229 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.589 1.535 10.425 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.519 2.520 10.326 1.00 0.00 C ATOM 1505 C GLU B 189 -11.035 3.957 10.444 1.00 0.00 C ATOM 1506 O GLU B 189 -10.299 4.877 10.080 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.749 2.328 9.011 1.00 0.00 C ATOM 1508 CG GLU B 189 -9.182 0.922 8.767 1.00 0.00 C ATOM 1509 CD GLU B 189 -8.280 0.434 9.902 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.055 0.672 9.817 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -8.755 -0.246 10.838 1.00 0.00 O ATOM 0 H GLU B 189 -12.070 1.351 9.544 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.845 2.357 11.167 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -10.412 2.580 8.184 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.925 3.041 8.987 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -10.007 0.221 8.639 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -8.616 0.921 7.835 1.00 0.00 H new ATOM 1518 N GLN B 190 -12.254 4.198 10.951 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.816 5.549 11.071 1.00 0.00 C ATOM 1520 C GLN B 190 -11.914 6.567 11.779 1.00 0.00 C ATOM 1521 O GLN B 190 -12.064 7.759 11.515 1.00 0.00 O ATOM 1522 CB GLN B 190 -14.241 5.521 11.649 1.00 0.00 C ATOM 1523 CG GLN B 190 -14.306 5.186 13.140 1.00 0.00 C ATOM 1524 CD GLN B 190 -15.734 4.938 13.622 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -16.405 5.844 14.111 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -16.253 3.733 13.475 1.00 0.00 N ATOM 0 H GLN B 190 -12.875 3.463 11.288 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.876 5.921 10.048 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -14.706 6.493 11.486 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.831 4.789 11.097 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -13.701 4.301 13.337 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.870 6.005 13.712 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.694 2.983 13.069 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -17.213 3.552 13.768 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.967 6.139 12.625 1.00 0.00 N ATOM 1536 CA ARG B 191 -10.035 7.019 13.339 1.00 0.00 C ATOM 1537 C ARG B 191 -8.575 6.739 12.952 1.00 0.00 C ATOM 1538 O ARG B 191 -7.670 7.308 13.564 1.00 0.00 O ATOM 1539 CB ARG B 191 -10.255 6.929 14.862 1.00 0.00 C ATOM 1540 CG ARG B 191 -11.725 7.117 15.276 1.00 0.00 C ATOM 1541 CD ARG B 191 -11.841 7.500 16.750 1.00 0.00 C ATOM 1542 NE ARG B 191 -13.242 7.696 17.166 1.00 0.00 N ATOM 1543 CZ ARG B 191 -13.643 8.373 18.251 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -12.781 9.088 18.966 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -14.908 8.317 18.635 1.00 0.00 N ATOM 0 H ARG B 191 -10.826 5.151 12.836 1.00 0.00 H new ATOM 0 HA ARG B 191 -10.245 8.044 13.035 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.906 5.959 15.216 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -9.646 7.686 15.356 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -12.183 7.891 14.660 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -12.278 6.195 15.093 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -11.387 6.721 17.363 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -11.278 8.416 16.931 1.00 0.00 H new ATOM 0 HE ARG B 191 -13.966 7.282 16.579 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -11.799 9.127 18.691 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -13.101 9.598 19.789 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -15.578 7.759 18.105 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -15.214 8.832 19.461 1.00 0.00 H new ATOM 1559 N ASN B 192 -8.304 5.821 12.018 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.945 5.500 11.576 1.00 0.00 C ATOM 1561 C ASN B 192 -6.565 6.529 10.518 1.00 0.00 C ATOM 1562 O ASN B 192 -7.139 6.510 9.424 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.851 4.065 11.040 1.00 0.00 C ATOM 1564 CG ASN B 192 -5.393 3.644 10.935 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -4.898 2.909 11.780 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.659 4.121 9.944 1.00 0.00 N ATOM 0 H ASN B 192 -9.026 5.277 11.546 1.00 0.00 H new ATOM 0 HA ASN B 192 -6.248 5.546 12.413 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -7.388 3.385 11.701 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -7.328 4.001 10.062 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.671 3.877 9.878 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -5.081 4.733 9.245 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.611 7.410 10.822 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.175 8.471 9.914 1.00 0.00 C ATOM 1575 C TYR B 193 -4.859 7.991 8.496 1.00 0.00 C ATOM 1576 O TYR B 193 -5.331 8.586 7.539 1.00 0.00 O ATOM 1577 CB TYR B 193 -3.992 9.263 10.507 1.00 0.00 C ATOM 1578 CG TYR B 193 -2.684 8.511 10.700 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -1.805 8.324 9.613 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.318 8.035 11.974 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.612 7.599 9.776 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.112 7.336 12.147 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.264 7.093 11.047 1.00 0.00 C ATOM 1584 OH TYR B 193 0.848 6.328 11.193 1.00 0.00 O ATOM 0 H TYR B 193 -5.115 7.407 11.713 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.032 9.137 9.815 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -3.799 10.118 9.859 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -4.301 9.659 11.474 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.051 8.741 8.648 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -2.966 8.208 12.820 1.00 0.00 H new ATOM 0 HE1 TYR B 193 0.038 7.429 8.930 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -0.833 6.983 13.129 1.00 0.00 H new ATOM 0 HH TYR B 193 0.942 6.063 12.132 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.163 6.863 8.350 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.747 6.304 7.066 1.00 0.00 C ATOM 1596 C GLN B 194 -4.891 5.887 6.129 1.00 0.00 C ATOM 1597 O GLN B 194 -4.627 5.462 5.005 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.766 5.148 7.329 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.670 5.094 6.259 1.00 0.00 C ATOM 1600 CD GLN B 194 -0.760 3.874 6.399 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -0.588 3.336 7.492 1.00 0.00 O ATOM 1602 NE2 GLN B 194 -0.198 3.368 5.313 1.00 0.00 N ATOM 0 H GLN B 194 -3.865 6.298 9.145 1.00 0.00 H new ATOM 0 HA GLN B 194 -3.256 7.106 6.515 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.312 5.270 8.312 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.309 4.203 7.344 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -2.133 5.084 5.272 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -1.066 6.000 6.319 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -0.342 3.816 4.408 1.00 0.00 H new ATOM 0 HE22 GLN B 194 0.379 2.530 5.381 1.00 0.00 H new ATOM 1611 N PHE B 195 -6.146 5.939 6.576 1.00 0.00 N ATOM 1612 CA PHE B 195 -7.314 5.584 5.783 1.00 0.00 C ATOM 1613 C PHE B 195 -8.200 6.808 5.535 1.00 0.00 C ATOM 1614 O PHE B 195 -9.325 6.666 5.052 1.00 0.00 O ATOM 1615 CB PHE B 195 -8.016 4.382 6.417 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.276 3.089 6.117 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -7.417 2.485 4.852 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -6.412 2.512 7.064 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.730 1.298 4.547 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.706 1.339 6.750 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.876 0.718 5.500 1.00 0.00 C ATOM 0 H PHE B 195 -6.380 6.237 7.523 1.00 0.00 H new ATOM 0 HA PHE B 195 -7.019 5.262 4.784 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -8.082 4.524 7.496 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -9.037 4.315 6.041 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -8.058 2.938 4.111 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -6.291 2.971 8.034 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -6.858 0.832 3.581 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -5.028 0.911 7.474 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.353 -0.200 5.274 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.723 8.011 5.870 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.472 9.249 5.641 1.00 0.00 C ATOM 1633 C ASP B 196 -8.646 9.519 4.139 1.00 0.00 C ATOM 1634 O ASP B 196 -9.577 10.228 3.760 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.844 10.456 6.355 1.00 0.00 C ATOM 1636 CG ASP B 196 -6.498 10.927 5.813 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -5.871 10.214 5.002 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -6.088 12.042 6.212 1.00 0.00 O ATOM 0 H ASP B 196 -6.812 8.153 6.305 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.460 9.107 6.078 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -8.545 11.289 6.304 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.722 10.206 7.409 1.00 0.00 H new ATOM 1643 N PHE B 197 -7.839 8.902 3.267 1.00 0.00 N ATOM 1644 CA PHE B 197 -7.924 9.056 1.814 1.00 0.00 C ATOM 1645 C PHE B 197 -9.260 8.526 1.273 1.00 0.00 C ATOM 1646 O PHE B 197 -9.691 8.909 0.187 1.00 0.00 O ATOM 1647 CB PHE B 197 -6.758 8.326 1.129 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.857 6.807 1.138 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -6.342 6.072 2.219 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -7.465 6.124 0.065 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -6.403 4.665 2.217 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -7.517 4.718 0.060 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.982 3.985 1.132 1.00 0.00 C ATOM 0 H PHE B 197 -7.094 8.270 3.560 1.00 0.00 H new ATOM 0 HA PHE B 197 -7.863 10.121 1.590 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -6.694 8.665 0.095 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -5.829 8.618 1.618 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -5.897 6.589 3.056 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -7.892 6.682 -0.755 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -6.004 4.107 3.051 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -7.970 4.200 -0.772 1.00 0.00 H new ATOM 0 HZ PHE B 197 -7.015 2.906 1.123 1.00 0.00 H new ATOM 1663 N LEU B 198 -9.909 7.622 2.018 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.188 7.031 1.650 1.00 0.00 C ATOM 1665 C LEU B 198 -12.333 8.027 1.841 1.00 0.00 C ATOM 1666 O LEU B 198 -13.456 7.727 1.422 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.465 5.784 2.507 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.508 4.607 2.266 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.787 3.528 3.312 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.699 4.006 0.871 1.00 0.00 C ATOM 0 H LEU B 198 -9.548 7.279 2.908 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.131 6.754 0.597 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.414 6.065 3.559 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.485 5.449 2.316 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.484 4.973 2.343 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.114 2.685 3.153 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.626 3.938 4.309 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.819 3.191 3.220 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -10.006 3.176 0.735 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.722 3.645 0.767 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.505 4.768 0.117 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.102 9.169 2.499 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.117 10.190 2.731 1.00 0.00 C ATOM 1684 C ARG B 199 -12.965 11.293 1.686 1.00 0.00 C ATOM 1685 O ARG B 199 -11.840 11.635 1.327 1.00 0.00 O ATOM 1686 CB ARG B 199 -12.960 10.787 4.138 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.347 9.778 5.216 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.231 10.377 6.622 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.007 9.557 7.560 1.00 0.00 N ATOM 1690 CZ ARG B 199 -15.335 9.595 7.709 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -16.058 10.603 7.230 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -15.929 8.570 8.303 1.00 0.00 N ATOM 0 H ARG B 199 -11.190 9.408 2.889 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.106 9.738 2.651 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -11.928 11.104 4.288 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.583 11.677 4.229 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.370 9.440 5.048 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.705 8.900 5.140 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -12.186 10.413 6.930 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -13.600 11.403 6.625 1.00 0.00 H new ATOM 0 HE ARG B 199 -13.490 8.903 8.148 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -15.600 11.369 6.736 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -17.070 10.610 7.356 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -15.374 7.780 8.633 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -16.941 8.571 8.431 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.070 11.924 1.256 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.060 12.998 0.257 1.00 0.00 C ATOM 1708 C PRO B 200 -13.288 14.248 0.686 1.00 0.00 C ATOM 1709 O PRO B 200 -13.073 15.159 -0.119 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.526 13.318 -0.014 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.244 12.819 1.237 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.434 11.598 1.633 1.00 0.00 C ATOM 0 HA PRO B 200 -13.532 12.663 -0.636 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.681 14.386 -0.165 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.887 12.814 -0.910 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.251 13.572 2.025 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.283 12.564 1.031 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.513 11.400 2.702 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.785 10.705 1.116 1.00 0.00 H new ATOM 1720 N GLN B 201 -12.920 14.328 1.960 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.156 15.416 2.542 1.00 0.00 C ATOM 1722 C GLN B 201 -10.699 15.389 2.030 1.00 0.00 C ATOM 1723 O GLN B 201 -9.970 16.357 2.243 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.315 15.318 4.069 1.00 0.00 C ATOM 1725 CG GLN B 201 -11.466 16.309 4.870 1.00 0.00 C ATOM 1726 CD GLN B 201 -11.800 16.222 6.352 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -11.310 15.334 7.048 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -12.637 17.106 6.867 1.00 0.00 N ATOM 0 H GLN B 201 -13.157 13.605 2.640 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.525 16.395 2.236 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -13.364 15.474 4.321 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -12.059 14.306 4.382 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -10.408 16.097 4.717 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -11.643 17.323 4.510 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -13.035 17.836 6.276 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -12.885 17.058 7.855 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.265 14.345 1.315 1.00 0.00 N ATOM 1738 CA HIS B 202 -8.920 14.207 0.770 1.00 0.00 C ATOM 1739 C HIS B 202 -8.992 14.249 -0.753 1.00 0.00 C ATOM 1740 O HIS B 202 -9.855 13.602 -1.338 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.361 12.851 1.234 1.00 0.00 C ATOM 1742 CG HIS B 202 -6.865 12.800 1.406 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -5.902 13.253 0.532 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.223 12.291 2.501 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -4.703 13.019 1.089 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -4.847 12.417 2.279 1.00 0.00 N ATOM 0 H HIS B 202 -10.864 13.549 1.095 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.274 15.015 1.114 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -8.829 12.588 2.183 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.654 12.089 0.512 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -6.692 11.869 3.377 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -3.755 13.279 0.641 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.099 12.111 2.901 1.00 0.00 H new ATOM 1754 N SER B 203 -8.066 14.945 -1.416 1.00 0.00 N ATOM 1755 CA SER B 203 -8.013 15.033 -2.879 1.00 0.00 C ATOM 1756 C SER B 203 -7.858 13.631 -3.478 1.00 0.00 C ATOM 1757 O SER B 203 -8.482 13.300 -4.490 1.00 0.00 O ATOM 1758 CB SER B 203 -6.834 15.917 -3.293 1.00 0.00 C ATOM 1759 OG SER B 203 -6.938 17.188 -2.681 1.00 0.00 O ATOM 0 H SER B 203 -7.325 15.468 -0.950 1.00 0.00 H new ATOM 0 HA SER B 203 -8.938 15.473 -3.251 1.00 0.00 H new ATOM 0 HB2 SER B 203 -5.896 15.443 -3.006 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.816 16.028 -4.377 1.00 0.00 H new ATOM 0 HG SER B 203 -6.178 17.744 -2.951 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.095 12.780 -2.773 1.00 0.00 N ATOM 1766 CA LEU B 204 -6.821 11.398 -3.130 1.00 0.00 C ATOM 1767 C LEU B 204 -8.117 10.632 -3.339 1.00 0.00 C ATOM 1768 O LEU B 204 -8.120 9.703 -4.139 1.00 0.00 O ATOM 1769 CB LEU B 204 -5.979 10.708 -2.043 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.523 11.191 -1.933 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.806 10.364 -0.858 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.761 11.085 -3.258 1.00 0.00 C ATOM 0 H LEU B 204 -6.638 13.058 -1.904 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.256 11.400 -4.062 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.467 10.856 -1.080 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -5.975 9.635 -2.236 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.544 12.247 -1.663 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.772 10.698 -0.771 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.311 10.495 0.099 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.825 9.310 -1.137 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.740 11.440 -3.120 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -3.743 10.045 -3.585 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.258 11.694 -4.013 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.211 11.020 -2.675 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.510 10.380 -2.816 1.00 0.00 C ATOM 1786 C PHE B 205 -10.889 10.330 -4.289 1.00 0.00 C ATOM 1787 O PHE B 205 -11.295 9.282 -4.782 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.570 11.176 -2.061 1.00 0.00 C ATOM 1789 CG PHE B 205 -12.969 10.601 -2.145 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.400 9.692 -1.168 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.864 11.026 -3.147 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -14.731 9.242 -1.156 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -15.181 10.536 -3.165 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.615 9.652 -2.164 1.00 0.00 C ATOM 0 H PHE B 205 -9.212 11.799 -2.017 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.455 9.371 -2.407 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.280 11.239 -1.012 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.586 12.194 -2.449 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -12.706 9.336 -0.421 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -13.538 11.728 -3.901 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.072 8.582 -0.372 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.859 10.839 -3.949 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.632 9.287 -2.171 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.729 11.442 -5.015 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.064 11.504 -6.425 1.00 0.00 C ATOM 1806 C ASN B 206 -10.222 10.558 -7.278 1.00 0.00 C ATOM 1807 O ASN B 206 -10.675 10.114 -8.327 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.973 12.947 -6.933 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.323 13.316 -7.503 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.798 12.691 -8.451 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.988 14.263 -6.878 1.00 0.00 N ATOM 0 H ASN B 206 -10.365 12.316 -4.635 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.094 11.162 -6.525 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -10.702 13.622 -6.121 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.198 13.037 -7.694 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.934 14.503 -7.175 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -12.558 14.757 -6.096 1.00 0.00 H new ATOM 1818 N TYR B 207 -8.967 10.300 -6.905 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.098 9.385 -7.643 1.00 0.00 C ATOM 1820 C TYR B 207 -8.392 7.940 -7.192 1.00 0.00 C ATOM 1821 O TYR B 207 -8.220 7.003 -7.967 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.630 9.788 -7.402 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.594 8.791 -7.893 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.292 8.686 -9.265 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -4.948 7.945 -6.973 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.372 7.721 -9.716 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.043 6.965 -7.420 1.00 0.00 C ATOM 1828 CZ TYR B 207 -3.753 6.848 -8.796 1.00 0.00 C ATOM 1829 OH TYR B 207 -2.911 5.875 -9.232 1.00 0.00 O ATOM 0 H TYR B 207 -8.527 10.718 -6.086 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.286 9.441 -8.715 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.449 10.746 -7.890 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.484 9.942 -6.333 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -5.768 9.348 -9.973 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.148 8.049 -5.917 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -4.139 7.648 -10.768 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.570 6.302 -6.710 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.030 6.263 -9.416 1.00 0.00 H new ATOM 1839 N PHE B 208 -8.855 7.739 -5.960 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.201 6.440 -5.409 1.00 0.00 C ATOM 1841 C PHE B 208 -10.501 5.974 -6.051 1.00 0.00 C ATOM 1842 O PHE B 208 -10.521 4.940 -6.711 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.293 6.528 -3.887 1.00 0.00 C ATOM 1844 CG PHE B 208 -9.990 5.331 -3.266 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -9.319 4.101 -3.133 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -11.346 5.429 -2.893 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -9.985 2.994 -2.585 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -12.013 4.307 -2.373 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.331 3.094 -2.204 1.00 0.00 C ATOM 0 H PHE B 208 -9.003 8.503 -5.301 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.430 5.703 -5.632 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.289 6.613 -3.472 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.829 7.437 -3.613 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -8.292 4.009 -3.453 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -11.872 6.366 -3.007 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -9.458 2.060 -2.456 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -13.056 4.379 -2.102 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.840 2.240 -1.782 1.00 0.00 H new ATOM 1859 N THR B 209 -11.571 6.755 -5.901 1.00 0.00 N ATOM 1860 CA THR B 209 -12.883 6.456 -6.439 1.00 0.00 C ATOM 1861 C THR B 209 -12.779 6.186 -7.942 1.00 0.00 C ATOM 1862 O THR B 209 -13.278 5.162 -8.394 1.00 0.00 O ATOM 1863 CB THR B 209 -13.875 7.563 -6.022 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.200 7.095 -6.082 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.791 8.847 -6.845 1.00 0.00 C ATOM 0 H THR B 209 -11.540 7.635 -5.387 1.00 0.00 H new ATOM 0 HA THR B 209 -13.290 5.536 -6.020 1.00 0.00 H new ATOM 0 HB THR B 209 -13.582 7.813 -5.002 1.00 0.00 H new ATOM 0 HG1 THR B 209 -15.812 7.811 -5.812 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.526 9.564 -6.477 1.00 0.00 H new ATOM 0 HG22 THR B 209 -12.792 9.273 -6.754 1.00 0.00 H new ATOM 0 HG23 THR B 209 -13.996 8.622 -7.892 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.034 7.003 -8.705 1.00 0.00 N ATOM 1874 CA LYS B 210 -11.902 6.793 -10.145 1.00 0.00 C ATOM 1875 C LYS B 210 -11.347 5.418 -10.496 1.00 0.00 C ATOM 1876 O LYS B 210 -11.594 4.944 -11.602 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.139 7.948 -10.806 1.00 0.00 C ATOM 1878 CG LYS B 210 -9.612 7.873 -10.769 1.00 0.00 C ATOM 1879 CD LYS B 210 -8.957 8.895 -11.707 1.00 0.00 C ATOM 1880 CE LYS B 210 -9.446 10.302 -11.370 1.00 0.00 C ATOM 1881 NZ LYS B 210 -9.033 11.311 -12.357 1.00 0.00 N ATOM 0 H LYS B 210 -11.520 7.808 -8.346 1.00 0.00 H new ATOM 0 HA LYS B 210 -12.907 6.800 -10.567 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -11.451 8.010 -11.848 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.446 8.877 -10.326 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -9.266 8.045 -9.750 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -9.293 6.869 -11.049 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -7.872 8.846 -11.612 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -9.197 8.656 -12.743 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -10.534 10.295 -11.301 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -9.066 10.586 -10.389 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -9.395 12.243 -12.073 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -7.995 11.343 -12.407 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -9.417 11.061 -13.291 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.539 4.800 -9.631 1.00 0.00 N ATOM 1896 CA LEU B 211 -10.016 3.473 -9.910 1.00 0.00 C ATOM 1897 C LEU B 211 -11.115 2.448 -9.639 1.00 0.00 C ATOM 1898 O LEU B 211 -11.161 1.444 -10.336 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.835 3.103 -9.003 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.470 3.734 -9.291 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.447 3.060 -8.377 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.959 3.557 -10.718 1.00 0.00 C ATOM 0 H LEU B 211 -10.239 5.198 -8.741 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.681 3.472 -10.947 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.110 3.359 -7.980 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.715 2.020 -9.040 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.594 4.804 -9.126 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.461 3.488 -8.557 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.728 3.221 -7.336 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.422 1.990 -8.585 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -5.987 4.039 -10.819 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.862 2.494 -10.941 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.663 4.011 -11.415 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.974 2.656 -8.636 1.00 0.00 N ATOM 1915 CA VAL B 212 -13.023 1.704 -8.304 1.00 0.00 C ATOM 1916 C VAL B 212 -14.011 1.598 -9.446 1.00 0.00 C ATOM 1917 O VAL B 212 -14.176 0.518 -9.996 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.760 2.066 -7.000 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.705 0.920 -6.594 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.788 2.391 -5.858 1.00 0.00 C ATOM 0 H VAL B 212 -11.957 3.483 -8.040 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.541 0.740 -8.144 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.344 2.966 -7.190 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.222 1.184 -5.671 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.436 0.754 -7.385 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.127 0.009 -6.438 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.353 2.640 -4.960 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.156 1.525 -5.661 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -12.164 3.239 -6.141 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.628 2.719 -9.818 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.630 2.786 -10.874 1.00 0.00 C ATOM 1932 C GLU B 213 -15.053 2.271 -12.209 1.00 0.00 C ATOM 1933 O GLU B 213 -15.800 1.805 -13.070 1.00 0.00 O ATOM 1934 CB GLU B 213 -16.192 4.220 -10.973 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.412 4.978 -9.639 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.544 4.493 -8.729 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.672 5.023 -8.831 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -17.291 3.732 -7.760 1.00 0.00 O ATOM 0 H GLU B 213 -14.440 3.622 -9.383 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.464 2.129 -10.629 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -15.514 4.809 -11.590 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -17.145 4.176 -11.500 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.483 4.936 -9.071 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.595 6.026 -9.874 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.728 2.359 -12.392 1.00 0.00 N ATOM 1946 CA GLN B 214 -13.011 1.899 -13.568 1.00 0.00 C ATOM 1947 C GLN B 214 -12.809 0.378 -13.499 1.00 0.00 C ATOM 1948 O GLN B 214 -12.960 -0.309 -14.506 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.657 2.634 -13.633 1.00 0.00 C ATOM 1950 CG GLN B 214 -10.734 2.130 -14.743 1.00 0.00 C ATOM 1951 CD GLN B 214 -9.448 2.942 -14.845 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -9.342 3.851 -15.664 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.445 2.630 -14.033 1.00 0.00 N ATOM 0 H GLN B 214 -13.111 2.770 -11.692 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.583 2.117 -14.470 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.839 3.699 -13.780 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -11.149 2.527 -12.674 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -10.486 1.085 -14.559 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -11.262 2.169 -15.696 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -8.551 1.872 -13.359 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -7.568 3.149 -14.083 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.397 -0.151 -12.346 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.154 -1.572 -12.149 1.00 0.00 C ATOM 1964 C TYR B 215 -13.459 -2.368 -12.012 1.00 0.00 C ATOM 1965 O TYR B 215 -13.442 -3.570 -12.305 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.233 -1.768 -10.937 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.817 -1.204 -11.015 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -9.132 -1.054 -12.239 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.172 -0.838 -9.818 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.819 -0.548 -12.259 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.850 -0.357 -9.830 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.161 -0.230 -11.053 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.871 0.217 -11.076 1.00 0.00 O ATOM 0 H TYR B 215 -12.221 0.409 -11.512 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.657 -1.966 -13.035 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.722 -1.323 -10.070 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.156 -2.838 -10.746 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.617 -1.328 -13.164 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.699 -0.928 -8.879 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -7.313 -0.403 -13.202 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.364 -0.086 -8.904 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.569 0.391 -10.160 1.00 0.00 H new ATOM 1983 N THR B 216 -14.567 -1.765 -11.571 1.00 0.00 N ATOM 1984 CA THR B 216 -15.829 -2.491 -11.468 1.00 0.00 C ATOM 1985 C THR B 216 -16.377 -2.734 -12.874 1.00 0.00 C ATOM 1986 O THR B 216 -16.076 -1.993 -13.821 1.00 0.00 O ATOM 1987 CB THR B 216 -16.884 -1.703 -10.666 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.972 -0.348 -11.049 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.626 -1.756 -9.170 1.00 0.00 C ATOM 0 H THR B 216 -14.613 -0.787 -11.283 1.00 0.00 H new ATOM 0 HA THR B 216 -15.632 -3.429 -10.949 1.00 0.00 H new ATOM 0 HB THR B 216 -17.828 -2.197 -10.896 1.00 0.00 H new ATOM 0 HG1 THR B 216 -17.656 0.101 -10.509 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.395 -1.187 -8.648 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.650 -2.792 -8.833 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.648 -1.327 -8.954 1.00 0.00 H new