USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=14 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 Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.0378 X(o=-0.038,f=-0.38) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= -0.0225 K(o=-0.022,f=-3.4!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot 31:sc= 0.34 USER MOD Single : B 168 LYS NZ :NH3+ 165:sc= 0 (180deg=-0.00774) USER MOD Single : B 170 THR OG1 : rot 82:sc= 1.24 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 177 ASN : amide:sc= 0.0541 K(o=0.054,f=-1.2) USER MOD Single : B 180 GLN : amide:sc= -0.868 K(o=-0.87,f=-4!) USER MOD Single : B 183 THR OG1 : rot 78:sc= 1.2 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 186 MET CE :methyl 172:sc= -0.0114 (180deg=-0.113) USER MOD Single : B 187 GLN :FLIP amide:sc= -0.0685 F(o=-3.5!,f=-0.069) USER MOD Single : B 188 LYS NZ :NH3+ -147:sc= 0 (180deg=-0.68) USER MOD Single : B 190 GLN : amide:sc= -0.0295 X(o=-0.03,f=0) USER MOD Single : B 192 ASN : amide:sc= 1.47 K(o=1.5,f=-5!) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 0 X(o=0,f=-0.0042) USER MOD Single : B 201 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 202 HIS : no HD1:sc= -1.7 K(o=-1.7,f=-3.9!) USER MOD Single : B 203 SER OG : rot 180:sc= 0 USER MOD Single : B 206 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 207 TYR OH : rot 30:sc= 0 USER MOD Single : B 209 THR OG1 : rot 180:sc= 0 USER MOD Single : B 210 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 214 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot -72:sc= 0.435 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.291 -12.161 2.639 1.00 0.00 N ATOM 132 CA GLU A 80 -10.957 -10.971 1.848 1.00 0.00 C ATOM 133 C GLU A 80 -9.955 -10.099 2.612 1.00 0.00 C ATOM 134 O GLU A 80 -9.033 -9.552 2.005 1.00 0.00 O ATOM 135 CB GLU A 80 -12.222 -10.190 1.465 1.00 0.00 C ATOM 136 CG GLU A 80 -13.232 -10.993 0.619 1.00 0.00 C ATOM 137 CD GLU A 80 -12.634 -11.773 -0.553 1.00 0.00 C ATOM 138 OE1 GLU A 80 -11.920 -11.202 -1.400 1.00 0.00 O ATOM 139 OE2 GLU A 80 -12.825 -13.008 -0.625 1.00 0.00 O ATOM 0 HA GLU A 80 -10.487 -11.286 0.916 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -12.716 -9.852 2.376 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -11.930 -9.298 0.911 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -13.751 -11.694 1.273 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -13.982 -10.305 0.230 1.00 0.00 H new ATOM 146 N PHE A 81 -10.100 -10.013 3.942 1.00 0.00 N ATOM 147 CA PHE A 81 -9.207 -9.239 4.794 1.00 0.00 C ATOM 148 C PHE A 81 -7.846 -9.914 4.932 1.00 0.00 C ATOM 149 O PHE A 81 -6.849 -9.218 5.106 1.00 0.00 O ATOM 150 CB PHE A 81 -9.832 -8.998 6.171 1.00 0.00 C ATOM 151 CG PHE A 81 -10.857 -7.886 6.129 1.00 0.00 C ATOM 152 CD1 PHE A 81 -10.426 -6.574 5.859 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.228 -8.152 6.308 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.357 -5.534 5.737 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.161 -7.107 6.196 1.00 0.00 C ATOM 156 CZ PHE A 81 -12.724 -5.802 5.902 1.00 0.00 C ATOM 0 H PHE A 81 -10.847 -10.484 4.453 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.054 -8.272 4.314 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.304 -9.915 6.523 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.050 -8.746 6.887 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -9.372 -6.368 5.745 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.561 -9.155 6.530 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.024 -4.531 5.517 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.213 -7.305 6.336 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.444 -5.003 5.803 1.00 0.00 H new ATOM 166 N ALA A 82 -7.789 -11.250 4.873 1.00 0.00 N ATOM 167 CA ALA A 82 -6.536 -11.984 4.975 1.00 0.00 C ATOM 168 C ALA A 82 -5.642 -11.536 3.824 1.00 0.00 C ATOM 169 O ALA A 82 -4.534 -11.048 4.048 1.00 0.00 O ATOM 170 CB ALA A 82 -6.791 -13.492 4.931 1.00 0.00 C ATOM 0 H ALA A 82 -8.610 -11.844 4.754 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.045 -11.775 5.925 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.843 -14.024 5.009 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.436 -13.776 5.763 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.277 -13.752 3.990 1.00 0.00 H new ATOM 176 N GLU A 83 -6.169 -11.647 2.606 1.00 0.00 N ATOM 177 CA GLU A 83 -5.489 -11.270 1.382 1.00 0.00 C ATOM 178 C GLU A 83 -5.151 -9.778 1.394 1.00 0.00 C ATOM 179 O GLU A 83 -4.019 -9.406 1.090 1.00 0.00 O ATOM 180 CB GLU A 83 -6.378 -11.687 0.202 1.00 0.00 C ATOM 181 CG GLU A 83 -5.705 -11.489 -1.161 1.00 0.00 C ATOM 182 CD GLU A 83 -4.372 -12.227 -1.300 1.00 0.00 C ATOM 183 OE1 GLU A 83 -4.238 -13.356 -0.773 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.444 -11.684 -1.948 1.00 0.00 O ATOM 0 H GLU A 83 -7.108 -12.013 2.446 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.532 -11.783 1.286 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.653 -12.736 0.315 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.303 -11.110 0.231 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -6.382 -11.830 -1.944 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.540 -10.424 -1.324 1.00 0.00 H new ATOM 191 N PHE A 84 -6.093 -8.928 1.815 1.00 0.00 N ATOM 192 CA PHE A 84 -5.896 -7.484 1.878 1.00 0.00 C ATOM 193 C PHE A 84 -4.692 -7.145 2.752 1.00 0.00 C ATOM 194 O PHE A 84 -3.763 -6.474 2.300 1.00 0.00 O ATOM 195 CB PHE A 84 -7.171 -6.821 2.401 1.00 0.00 C ATOM 196 CG PHE A 84 -7.100 -5.312 2.458 1.00 0.00 C ATOM 197 CD1 PHE A 84 -7.166 -4.564 1.268 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.011 -4.652 3.695 1.00 0.00 C ATOM 199 CE1 PHE A 84 -7.146 -3.163 1.316 1.00 0.00 C ATOM 200 CE2 PHE A 84 -6.998 -3.248 3.737 1.00 0.00 C ATOM 201 CZ PHE A 84 -7.070 -2.502 2.549 1.00 0.00 C ATOM 0 H PHE A 84 -7.018 -9.229 2.123 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.690 -7.101 0.879 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -8.007 -7.111 1.764 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.383 -7.203 3.400 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -7.232 -5.070 0.316 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -6.953 -5.222 4.610 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -7.189 -2.592 0.400 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -6.932 -2.740 4.688 1.00 0.00 H new ATOM 0 HZ PHE A 84 -7.067 -1.423 2.586 1.00 0.00 H new ATOM 211 N TYR A 85 -4.675 -7.632 3.994 1.00 0.00 N ATOM 212 CA TYR A 85 -3.568 -7.366 4.897 1.00 0.00 C ATOM 213 C TYR A 85 -2.265 -7.992 4.395 1.00 0.00 C ATOM 214 O TYR A 85 -1.202 -7.442 4.686 1.00 0.00 O ATOM 215 CB TYR A 85 -3.892 -7.841 6.310 1.00 0.00 C ATOM 216 CG TYR A 85 -4.824 -6.945 7.098 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.513 -5.584 7.299 1.00 0.00 C ATOM 218 CD2 TYR A 85 -5.995 -7.486 7.661 1.00 0.00 C ATOM 219 CE1 TYR A 85 -5.351 -4.776 8.087 1.00 0.00 C ATOM 220 CE2 TYR A 85 -6.831 -6.686 8.451 1.00 0.00 C ATOM 221 CZ TYR A 85 -6.479 -5.346 8.714 1.00 0.00 C ATOM 222 OH TYR A 85 -7.296 -4.594 9.502 1.00 0.00 O ATOM 0 H TYR A 85 -5.416 -8.210 4.391 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.421 -6.286 4.925 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.336 -8.834 6.248 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -2.959 -7.943 6.864 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.628 -5.161 6.846 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.250 -8.520 7.484 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -5.133 -3.726 8.212 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.744 -7.095 8.858 1.00 0.00 H new ATOM 0 HH TYR A 85 -8.022 -5.154 9.849 1.00 0.00 H new ATOM 232 N ASN A 86 -2.317 -9.116 3.669 1.00 0.00 N ATOM 233 CA ASN A 86 -1.133 -9.772 3.134 1.00 0.00 C ATOM 234 C ASN A 86 -0.511 -8.853 2.084 1.00 0.00 C ATOM 235 O ASN A 86 0.705 -8.639 2.105 1.00 0.00 O ATOM 236 CB ASN A 86 -1.483 -11.149 2.547 1.00 0.00 C ATOM 237 CG ASN A 86 -1.345 -12.258 3.573 1.00 0.00 C ATOM 238 OD1 ASN A 86 -0.300 -12.376 4.204 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.341 -13.098 3.772 1.00 0.00 N ATOM 0 H ASN A 86 -3.189 -9.592 3.439 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.412 -9.950 3.932 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.505 -11.132 2.167 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.831 -11.357 1.699 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.245 -13.851 4.454 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -3.208 -12.995 3.244 1.00 0.00 H new ATOM 246 N ARG A 87 -1.329 -8.292 1.187 1.00 0.00 N ATOM 247 CA ARG A 87 -0.878 -7.369 0.148 1.00 0.00 C ATOM 248 C ARG A 87 -0.375 -6.089 0.813 1.00 0.00 C ATOM 249 O ARG A 87 0.689 -5.607 0.437 1.00 0.00 O ATOM 250 CB ARG A 87 -2.030 -7.072 -0.825 1.00 0.00 C ATOM 251 CG ARG A 87 -2.383 -8.214 -1.786 1.00 0.00 C ATOM 252 CD ARG A 87 -1.261 -8.556 -2.777 1.00 0.00 C ATOM 253 NE ARG A 87 -0.878 -7.387 -3.586 1.00 0.00 N ATOM 254 CZ ARG A 87 0.342 -7.087 -4.047 1.00 0.00 C ATOM 255 NH1 ARG A 87 1.374 -7.917 -3.913 1.00 0.00 N ATOM 256 NH2 ARG A 87 0.514 -5.915 -4.641 1.00 0.00 N ATOM 0 H ARG A 87 -2.333 -8.470 1.164 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.065 -7.815 -0.425 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -2.918 -6.819 -0.246 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.771 -6.191 -1.412 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.626 -9.104 -1.205 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.279 -7.943 -2.345 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -0.392 -8.922 -2.231 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -1.588 -9.362 -3.434 1.00 0.00 H new ATOM 0 HE ARG A 87 -1.625 -6.734 -3.821 1.00 0.00 H new ATOM 0 HH11 ARG A 87 1.249 -8.815 -3.446 1.00 0.00 H new ATOM 0 HH12 ARG A 87 2.290 -7.655 -4.277 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -0.271 -5.271 -4.736 1.00 0.00 H new ATOM 0 HH22 ARG A 87 1.432 -5.657 -5.003 1.00 0.00 H new ATOM 270 N LEU A 88 -1.094 -5.555 1.814 1.00 0.00 N ATOM 271 CA LEU A 88 -0.678 -4.348 2.530 1.00 0.00 C ATOM 272 C LEU A 88 0.734 -4.538 3.046 1.00 0.00 C ATOM 273 O LEU A 88 1.593 -3.706 2.760 1.00 0.00 O ATOM 274 CB LEU A 88 -1.584 -4.020 3.731 1.00 0.00 C ATOM 275 CG LEU A 88 -2.762 -3.091 3.423 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.751 -3.152 4.588 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.252 -1.649 3.276 1.00 0.00 C ATOM 0 H LEU A 88 -1.975 -5.949 2.145 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.744 -3.522 1.822 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.974 -4.953 4.137 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.975 -3.563 4.511 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.247 -3.403 2.498 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.596 -2.495 4.383 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.108 -4.175 4.709 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.255 -2.830 5.504 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.090 -0.987 3.057 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.775 -1.335 4.205 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.529 -1.600 2.462 1.00 0.00 H new ATOM 289 N LYS A 89 0.947 -5.618 3.809 1.00 0.00 N ATOM 290 CA LYS A 89 2.222 -5.994 4.406 1.00 0.00 C ATOM 291 C LYS A 89 3.314 -5.917 3.347 1.00 0.00 C ATOM 292 O LYS A 89 4.310 -5.242 3.591 1.00 0.00 O ATOM 293 CB LYS A 89 2.088 -7.385 5.047 1.00 0.00 C ATOM 294 CG LYS A 89 3.308 -7.823 5.866 1.00 0.00 C ATOM 295 CD LYS A 89 3.053 -9.234 6.408 1.00 0.00 C ATOM 296 CE LYS A 89 4.249 -9.794 7.185 1.00 0.00 C ATOM 297 NZ LYS A 89 4.081 -11.240 7.460 1.00 0.00 N ATOM 0 H LYS A 89 0.201 -6.277 4.033 1.00 0.00 H new ATOM 0 HA LYS A 89 2.505 -5.305 5.201 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.210 -7.391 5.693 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.910 -8.119 4.261 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.204 -7.813 5.245 1.00 0.00 H new ATOM 0 HG3 LYS A 89 3.481 -7.128 6.688 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.178 -9.216 7.058 1.00 0.00 H new ATOM 0 HD3 LYS A 89 2.820 -9.901 5.578 1.00 0.00 H new ATOM 0 HE2 LYS A 89 5.164 -9.634 6.614 1.00 0.00 H new ATOM 0 HE3 LYS A 89 4.361 -9.253 8.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 4.906 -11.591 7.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 3.220 -11.388 8.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.999 -11.757 6.561 1.00 0.00 H new ATOM 311 N GLN A 90 3.102 -6.539 2.181 1.00 0.00 N ATOM 312 CA GLN A 90 4.028 -6.560 1.064 1.00 0.00 C ATOM 313 C GLN A 90 4.504 -5.145 0.732 1.00 0.00 C ATOM 314 O GLN A 90 5.705 -4.896 0.778 1.00 0.00 O ATOM 315 CB GLN A 90 3.299 -7.236 -0.119 1.00 0.00 C ATOM 316 CG GLN A 90 4.142 -8.215 -0.929 1.00 0.00 C ATOM 317 CD GLN A 90 5.016 -7.558 -2.000 1.00 0.00 C ATOM 318 OE1 GLN A 90 5.546 -6.467 -1.820 1.00 0.00 O ATOM 319 NE2 GLN A 90 5.211 -8.217 -3.130 1.00 0.00 N ATOM 0 H GLN A 90 2.245 -7.059 1.992 1.00 0.00 H new ATOM 0 HA GLN A 90 4.928 -7.126 1.304 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.428 -7.765 0.267 1.00 0.00 H new ATOM 0 HB3 GLN A 90 2.930 -6.459 -0.789 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.782 -8.775 -0.248 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.480 -8.936 -1.409 1.00 0.00 H new ATOM 0 HE21 GLN A 90 4.768 -9.124 -3.274 1.00 0.00 H new ATOM 0 HE22 GLN A 90 5.805 -7.818 -3.857 1.00 0.00 H new ATOM 328 N ILE A 91 3.585 -4.199 0.484 1.00 0.00 N ATOM 329 CA ILE A 91 3.931 -2.811 0.161 1.00 0.00 C ATOM 330 C ILE A 91 4.853 -2.237 1.254 1.00 0.00 C ATOM 331 O ILE A 91 5.806 -1.517 0.949 1.00 0.00 O ATOM 332 CB ILE A 91 2.662 -1.936 -0.017 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.630 -2.499 -1.024 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.057 -0.511 -0.453 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.235 -1.878 -0.847 1.00 0.00 C ATOM 0 H ILE A 91 2.581 -4.378 0.502 1.00 0.00 H new ATOM 0 HA ILE A 91 4.463 -2.799 -0.790 1.00 0.00 H new ATOM 0 HB ILE A 91 2.176 -1.932 0.959 1.00 0.00 H new ATOM 0 HG12 ILE A 91 1.980 -2.314 -2.040 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.561 -3.580 -0.902 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.159 0.094 -0.575 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.697 -0.062 0.307 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.595 -0.556 -1.400 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.450 -2.308 -1.578 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.131 -2.085 0.159 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.295 -0.800 -0.996 1.00 0.00 H new ATOM 347 N LYS A 92 4.589 -2.535 2.533 1.00 0.00 N ATOM 348 CA LYS A 92 5.412 -2.037 3.638 1.00 0.00 C ATOM 349 C LYS A 92 6.817 -2.597 3.478 1.00 0.00 C ATOM 350 O LYS A 92 7.774 -1.827 3.407 1.00 0.00 O ATOM 351 CB LYS A 92 4.797 -2.323 5.025 1.00 0.00 C ATOM 352 CG LYS A 92 3.281 -2.116 5.015 1.00 0.00 C ATOM 353 CD LYS A 92 2.629 -1.796 6.358 1.00 0.00 C ATOM 354 CE LYS A 92 1.238 -1.212 6.042 1.00 0.00 C ATOM 355 NZ LYS A 92 0.399 -0.955 7.226 1.00 0.00 N ATOM 0 H LYS A 92 3.808 -3.121 2.827 1.00 0.00 H new ATOM 0 HA LYS A 92 5.456 -0.949 3.591 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.024 -3.347 5.322 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.251 -1.668 5.768 1.00 0.00 H new ATOM 0 HG2 LYS A 92 3.052 -1.306 4.323 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.816 -3.018 4.616 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.543 -2.693 6.971 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.231 -1.082 6.921 1.00 0.00 H new ATOM 0 HE2 LYS A 92 1.366 -0.279 5.494 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.711 -1.900 5.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.516 -0.564 6.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.243 -1.845 7.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 0.878 -0.274 7.849 1.00 0.00 H new ATOM 1028 N SER B 160 3.622 8.857 -2.634 1.00 0.00 N ATOM 1029 CA SER B 160 4.748 7.949 -2.481 1.00 0.00 C ATOM 1030 C SER B 160 4.383 6.657 -3.220 1.00 0.00 C ATOM 1031 O SER B 160 3.202 6.302 -3.256 1.00 0.00 O ATOM 1032 CB SER B 160 4.940 7.650 -0.988 1.00 0.00 C ATOM 1033 OG SER B 160 4.859 8.835 -0.220 1.00 0.00 O ATOM 0 HA SER B 160 5.667 8.378 -2.880 1.00 0.00 H new ATOM 0 HB2 SER B 160 4.180 6.943 -0.654 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.908 7.175 -0.830 1.00 0.00 H new ATOM 0 HG SER B 160 4.252 9.468 -0.658 1.00 0.00 H new ATOM 1039 N ALA B 161 5.357 5.902 -3.748 1.00 0.00 N ATOM 1040 CA ALA B 161 5.033 4.651 -4.442 1.00 0.00 C ATOM 1041 C ALA B 161 4.343 3.655 -3.488 1.00 0.00 C ATOM 1042 O ALA B 161 3.628 2.756 -3.937 1.00 0.00 O ATOM 1043 CB ALA B 161 6.282 4.055 -5.091 1.00 0.00 C ATOM 0 H ALA B 161 6.351 6.129 -3.709 1.00 0.00 H new ATOM 0 HA ALA B 161 4.325 4.870 -5.241 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.020 3.128 -5.600 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.690 4.763 -5.813 1.00 0.00 H new ATOM 0 HB3 ALA B 161 7.028 3.849 -4.323 1.00 0.00 H new ATOM 1049 N PHE B 162 4.543 3.825 -2.177 1.00 0.00 N ATOM 1050 CA PHE B 162 3.952 3.024 -1.119 1.00 0.00 C ATOM 1051 C PHE B 162 2.461 3.358 -1.101 1.00 0.00 C ATOM 1052 O PHE B 162 1.608 2.513 -1.365 1.00 0.00 O ATOM 1053 CB PHE B 162 4.619 3.398 0.228 1.00 0.00 C ATOM 1054 CG PHE B 162 4.196 2.635 1.482 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.841 2.458 1.847 1.00 0.00 C ATOM 1056 CD2 PHE B 162 5.195 2.184 2.369 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.502 1.789 3.034 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.852 1.560 3.579 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.502 1.342 3.899 1.00 0.00 C ATOM 0 H PHE B 162 5.150 4.561 -1.816 1.00 0.00 H new ATOM 0 HA PHE B 162 4.098 1.956 -1.281 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.696 3.275 0.111 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.437 4.458 0.406 1.00 0.00 H new ATOM 0 HD1 PHE B 162 2.060 2.841 1.207 1.00 0.00 H new ATOM 0 HD2 PHE B 162 6.236 2.320 2.115 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.464 1.620 3.279 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.626 1.248 4.264 1.00 0.00 H new ATOM 0 HZ PHE B 162 3.238 0.830 4.812 1.00 0.00 H new ATOM 1069 N ASP B 163 2.164 4.617 -0.776 1.00 0.00 N ATOM 1070 CA ASP B 163 0.847 5.222 -0.644 1.00 0.00 C ATOM 1071 C ASP B 163 -0.006 4.966 -1.876 1.00 0.00 C ATOM 1072 O ASP B 163 -1.200 4.703 -1.743 1.00 0.00 O ATOM 1073 CB ASP B 163 1.010 6.725 -0.368 1.00 0.00 C ATOM 1074 CG ASP B 163 1.562 7.010 1.027 1.00 0.00 C ATOM 1075 OD1 ASP B 163 2.652 6.503 1.367 1.00 0.00 O ATOM 1076 OD2 ASP B 163 0.916 7.753 1.800 1.00 0.00 O ATOM 0 H ASP B 163 2.904 5.292 -0.583 1.00 0.00 H new ATOM 0 HA ASP B 163 0.324 4.764 0.195 1.00 0.00 H new ATOM 0 HB2 ASP B 163 1.677 7.157 -1.114 1.00 0.00 H new ATOM 0 HB3 ASP B 163 0.044 7.218 -0.480 1.00 0.00 H new ATOM 1081 N LEU B 164 0.610 5.009 -3.057 1.00 0.00 N ATOM 1082 CA LEU B 164 -0.027 4.769 -4.339 1.00 0.00 C ATOM 1083 C LEU B 164 -0.601 3.365 -4.382 1.00 0.00 C ATOM 1084 O LEU B 164 -1.779 3.194 -4.703 1.00 0.00 O ATOM 1085 CB LEU B 164 1.023 4.950 -5.446 1.00 0.00 C ATOM 1086 CG LEU B 164 0.594 4.437 -6.829 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.580 5.262 -7.346 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.782 4.508 -7.786 1.00 0.00 C ATOM 0 H LEU B 164 1.604 5.220 -3.144 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.845 5.475 -4.487 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.267 6.009 -5.526 1.00 0.00 H new ATOM 0 HB3 LEU B 164 1.936 4.434 -5.149 1.00 0.00 H new ATOM 0 HG LEU B 164 0.270 3.399 -6.755 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.880 4.893 -8.327 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.418 5.176 -6.654 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.282 6.308 -7.427 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.480 4.144 -8.768 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.121 5.541 -7.870 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.594 3.890 -7.404 1.00 0.00 H new ATOM 1100 N ASP B 165 0.235 2.363 -4.100 1.00 0.00 N ATOM 1101 CA ASP B 165 -0.224 0.984 -4.129 1.00 0.00 C ATOM 1102 C ASP B 165 -1.280 0.784 -3.048 1.00 0.00 C ATOM 1103 O ASP B 165 -2.257 0.108 -3.311 1.00 0.00 O ATOM 1104 CB ASP B 165 0.933 -0.014 -4.051 1.00 0.00 C ATOM 1105 CG ASP B 165 0.532 -1.389 -4.607 1.00 0.00 C ATOM 1106 OD1 ASP B 165 -0.324 -2.090 -4.031 1.00 0.00 O ATOM 1107 OD2 ASP B 165 1.068 -1.771 -5.671 1.00 0.00 O ATOM 0 H ASP B 165 1.217 2.483 -3.853 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.692 0.780 -5.092 1.00 0.00 H new ATOM 0 HB2 ASP B 165 1.785 0.371 -4.611 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.254 -0.119 -3.015 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.176 1.419 -1.871 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.186 1.268 -0.817 1.00 0.00 C ATOM 1114 C VAL B 166 -3.556 1.675 -1.379 1.00 0.00 C ATOM 1115 O VAL B 166 -4.547 0.967 -1.165 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.786 2.075 0.439 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -2.904 2.221 1.485 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.584 1.425 1.130 1.00 0.00 C ATOM 0 H VAL B 166 -0.404 2.040 -1.627 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.250 0.227 -0.500 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.551 3.072 0.066 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.537 2.801 2.332 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.756 2.733 1.038 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.213 1.233 1.828 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.314 2.005 2.013 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.842 0.409 1.428 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.261 1.398 0.442 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.626 2.801 -2.093 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.860 3.294 -2.691 1.00 0.00 C ATOM 1130 C VAL B 167 -5.305 2.337 -3.796 1.00 0.00 C ATOM 1131 O VAL B 167 -6.457 1.910 -3.774 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.665 4.741 -3.188 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.915 5.308 -3.866 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.348 5.681 -2.021 1.00 0.00 C ATOM 0 H VAL B 167 -2.819 3.398 -2.271 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.657 3.325 -1.949 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.844 4.690 -3.903 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.719 6.328 -4.195 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -6.173 4.692 -4.727 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.744 5.308 -3.159 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.215 6.695 -2.397 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.171 5.664 -1.306 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.433 5.353 -1.528 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.429 1.975 -4.742 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.767 1.067 -5.844 1.00 0.00 C ATOM 1146 C LYS B 168 -5.251 -0.285 -5.328 1.00 0.00 C ATOM 1147 O LYS B 168 -6.304 -0.735 -5.765 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.597 0.937 -6.831 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.467 2.225 -7.662 1.00 0.00 C ATOM 1150 CD LYS B 168 -2.196 2.311 -8.510 1.00 0.00 C ATOM 1151 CE LYS B 168 -2.207 1.427 -9.760 1.00 0.00 C ATOM 1152 NZ LYS B 168 -1.596 0.104 -9.522 1.00 0.00 N ATOM 0 H LYS B 168 -3.464 2.305 -4.764 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.601 1.502 -6.396 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.671 0.749 -6.288 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.759 0.084 -7.490 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -4.333 2.306 -8.319 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.497 3.081 -6.988 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -2.046 3.347 -8.814 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -1.342 2.034 -7.892 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -3.235 1.294 -10.098 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -1.671 1.932 -10.563 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 -1.849 -0.540 -10.299 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 -0.562 0.202 -9.476 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 -1.947 -0.284 -8.623 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.524 -0.914 -4.405 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.836 -2.196 -3.778 1.00 0.00 C ATOM 1168 C LEU B 169 -6.276 -2.110 -3.272 1.00 0.00 C ATOM 1169 O LEU B 169 -7.131 -2.908 -3.652 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.830 -2.442 -2.632 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.795 -3.828 -1.952 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -2.836 -3.777 -0.752 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -5.140 -4.336 -1.455 1.00 0.00 C ATOM 0 H LEU B 169 -3.651 -0.519 -4.055 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.753 -3.032 -4.473 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.832 -2.241 -3.021 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -4.025 -1.700 -1.858 1.00 0.00 H new ATOM 0 HG LEU B 169 -3.467 -4.521 -2.727 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.807 -4.753 -0.268 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -1.836 -3.513 -1.096 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.184 -3.029 -0.040 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -5.011 -5.315 -0.994 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.543 -3.639 -0.720 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.831 -4.418 -2.294 1.00 0.00 H new ATOM 1185 N THR B 170 -6.562 -1.105 -2.439 1.00 0.00 N ATOM 1186 CA THR B 170 -7.895 -0.925 -1.888 1.00 0.00 C ATOM 1187 C THR B 170 -8.922 -0.717 -3.002 1.00 0.00 C ATOM 1188 O THR B 170 -9.936 -1.405 -2.989 1.00 0.00 O ATOM 1189 CB THR B 170 -7.914 0.220 -0.863 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.807 0.139 0.009 1.00 0.00 O ATOM 1191 CG2 THR B 170 -9.166 0.143 0.013 1.00 0.00 C ATOM 0 H THR B 170 -5.883 -0.407 -2.135 1.00 0.00 H new ATOM 0 HA THR B 170 -8.175 -1.835 -1.358 1.00 0.00 H new ATOM 0 HB THR B 170 -7.890 1.149 -1.433 1.00 0.00 H new ATOM 0 HG1 THR B 170 -6.022 0.536 -0.422 1.00 0.00 H new ATOM 0 HG21 THR B 170 -9.159 0.963 0.731 1.00 0.00 H new ATOM 0 HG22 THR B 170 -10.054 0.218 -0.614 1.00 0.00 H new ATOM 0 HG23 THR B 170 -9.178 -0.807 0.547 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.678 0.192 -3.951 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.576 0.499 -5.062 1.00 0.00 C ATOM 1201 C ALA B 171 -9.894 -0.757 -5.893 1.00 0.00 C ATOM 1202 O ALA B 171 -11.014 -0.914 -6.379 1.00 0.00 O ATOM 1203 CB ALA B 171 -8.974 1.621 -5.913 1.00 0.00 C ATOM 0 H ALA B 171 -7.824 0.750 -3.965 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.529 0.848 -4.663 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.645 1.849 -6.741 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.840 2.511 -5.299 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -8.008 1.302 -6.305 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.934 -1.667 -6.042 1.00 0.00 N ATOM 1210 CA GLN B 172 -9.108 -2.911 -6.768 1.00 0.00 C ATOM 1211 C GLN B 172 -10.026 -3.822 -5.960 1.00 0.00 C ATOM 1212 O GLN B 172 -11.041 -4.290 -6.465 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.752 -3.602 -6.963 1.00 0.00 C ATOM 1214 CG GLN B 172 -6.947 -3.011 -8.116 1.00 0.00 C ATOM 1215 CD GLN B 172 -5.773 -3.925 -8.421 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -4.718 -3.856 -7.786 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -5.926 -4.788 -9.406 1.00 0.00 N ATOM 0 H GLN B 172 -7.998 -1.553 -5.652 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.543 -2.705 -7.746 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -7.173 -3.522 -6.043 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.914 -4.664 -7.146 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -7.578 -2.902 -8.998 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -6.590 -2.015 -7.854 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -6.808 -4.827 -9.917 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -5.163 -5.416 -9.657 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.701 -4.047 -4.687 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.463 -4.912 -3.797 1.00 0.00 C ATOM 1228 C PHE B 173 -11.910 -4.439 -3.642 1.00 0.00 C ATOM 1229 O PHE B 173 -12.818 -5.269 -3.621 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.746 -5.016 -2.444 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.560 -5.970 -2.389 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.603 -6.050 -3.425 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -8.431 -6.826 -1.280 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.537 -6.960 -3.341 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -7.390 -7.766 -1.219 1.00 0.00 C ATOM 1236 CZ PHE B 173 -6.429 -7.819 -2.240 1.00 0.00 C ATOM 0 H PHE B 173 -8.887 -3.625 -4.241 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.516 -5.907 -4.240 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.401 -4.022 -2.161 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.472 -5.327 -1.693 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.692 -5.407 -4.288 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -9.140 -6.759 -0.468 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.798 -6.998 -4.128 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -7.329 -8.449 -0.385 1.00 0.00 H new ATOM 0 HZ PHE B 173 -5.609 -8.519 -2.177 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.158 -3.130 -3.538 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.516 -2.600 -3.407 1.00 0.00 C ATOM 1248 C VAL B 174 -14.286 -2.816 -4.711 1.00 0.00 C ATOM 1249 O VAL B 174 -15.492 -3.008 -4.662 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.518 -1.123 -2.966 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.859 -0.975 -1.588 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.863 -0.189 -3.960 1.00 0.00 C ATOM 0 H VAL B 174 -11.430 -2.415 -3.542 1.00 0.00 H new ATOM 0 HA VAL B 174 -14.027 -3.149 -2.616 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.565 -0.826 -2.911 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.868 0.074 -1.291 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.411 -1.565 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.829 -1.329 -1.637 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.903 0.832 -3.581 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.823 -0.482 -4.104 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.391 -0.243 -4.912 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.619 -2.801 -5.868 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.290 -3.026 -7.137 1.00 0.00 C ATOM 1264 C ALA B 175 -14.525 -4.523 -7.350 1.00 0.00 C ATOM 1265 O ALA B 175 -15.536 -4.905 -7.940 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.431 -2.479 -8.279 1.00 0.00 C ATOM 0 H ALA B 175 -12.616 -2.635 -5.945 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.251 -2.511 -7.124 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.937 -2.650 -9.229 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.276 -1.409 -8.137 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.467 -2.988 -8.285 1.00 0.00 H new ATOM 1272 N ARG B 176 -13.601 -5.375 -6.891 1.00 0.00 N ATOM 1273 CA ARG B 176 -13.687 -6.823 -7.030 1.00 0.00 C ATOM 1274 C ARG B 176 -14.797 -7.356 -6.141 1.00 0.00 C ATOM 1275 O ARG B 176 -15.686 -8.061 -6.628 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.324 -7.487 -6.757 1.00 0.00 C ATOM 1277 CG ARG B 176 -12.392 -8.965 -7.166 1.00 0.00 C ATOM 1278 CD ARG B 176 -11.043 -9.692 -7.105 1.00 0.00 C ATOM 1279 NE ARG B 176 -11.088 -10.981 -7.821 1.00 0.00 N ATOM 1280 CZ ARG B 176 -11.760 -12.088 -7.474 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -12.442 -12.160 -6.338 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -11.765 -13.133 -8.290 1.00 0.00 N ATOM 0 H ARG B 176 -12.759 -5.066 -6.405 1.00 0.00 H new ATOM 0 HA ARG B 176 -13.942 -7.077 -8.059 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -11.539 -6.978 -7.317 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -12.069 -7.401 -5.701 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -13.100 -9.479 -6.516 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -12.784 -9.033 -8.181 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -10.269 -9.060 -7.540 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -10.768 -9.863 -6.064 1.00 0.00 H new ATOM 0 HE ARG B 176 -10.544 -11.037 -8.682 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -12.464 -11.361 -5.705 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -12.945 -13.015 -6.098 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -11.260 -13.091 -9.175 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -12.274 -13.979 -8.033 1.00 0.00 H new ATOM 1296 N ASN B 177 -14.717 -7.047 -4.848 1.00 0.00 N ATOM 1297 CA ASN B 177 -15.689 -7.464 -3.856 1.00 0.00 C ATOM 1298 C ASN B 177 -16.938 -6.614 -4.010 1.00 0.00 C ATOM 1299 O ASN B 177 -17.976 -7.115 -4.436 1.00 0.00 O ATOM 1300 CB ASN B 177 -15.116 -7.361 -2.430 1.00 0.00 C ATOM 1301 CG ASN B 177 -14.164 -8.504 -2.118 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -14.523 -9.667 -2.292 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -12.976 -8.223 -1.613 1.00 0.00 N ATOM 0 H ASN B 177 -13.957 -6.488 -4.459 1.00 0.00 H new ATOM 0 HA ASN B 177 -15.941 -8.512 -4.017 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.593 -6.412 -2.317 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -15.934 -7.362 -1.709 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -12.338 -8.978 -1.360 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -12.697 -7.252 -1.476 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.850 -5.330 -3.683 1.00 0.00 N ATOM 1311 CA GLY B 178 -17.949 -4.385 -3.751 1.00 0.00 C ATOM 1312 C GLY B 178 -17.837 -3.359 -2.625 1.00 0.00 C ATOM 1313 O GLY B 178 -16.884 -3.338 -1.833 1.00 0.00 O ATOM 0 H GLY B 178 -15.982 -4.908 -3.353 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -17.942 -3.878 -4.716 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -18.898 -4.915 -3.676 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.861 -2.516 -2.519 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.954 -1.453 -1.531 1.00 0.00 C ATOM 1319 C ARG B 179 -18.952 -1.952 -0.094 1.00 0.00 C ATOM 1320 O ARG B 179 -18.526 -1.188 0.775 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.229 -0.640 -1.801 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.371 0.646 -0.975 1.00 0.00 C ATOM 1323 CD ARG B 179 -19.131 1.558 -1.012 1.00 0.00 C ATOM 1324 NE ARG B 179 -19.472 2.986 -1.020 1.00 0.00 N ATOM 1325 CZ ARG B 179 -20.034 3.651 -2.033 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -20.242 3.064 -3.208 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -20.400 4.911 -1.834 1.00 0.00 N ATOM 0 H ARG B 179 -19.671 -2.558 -3.138 1.00 0.00 H new ATOM 0 HA ARG B 179 -18.062 -0.835 -1.635 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.257 -0.378 -2.859 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.094 -1.275 -1.607 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -21.232 1.206 -1.340 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.581 0.378 0.061 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -18.503 1.344 -0.147 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -18.542 1.325 -1.899 1.00 0.00 H new ATOM 0 HE ARG B 179 -19.261 3.518 -0.176 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -19.971 2.090 -3.347 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -20.672 3.587 -3.970 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -20.250 5.348 -0.925 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -20.831 5.442 -2.590 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.423 -3.169 0.200 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.422 -3.629 1.582 1.00 0.00 C ATOM 1343 C GLN B 180 -17.991 -3.700 2.103 1.00 0.00 C ATOM 1344 O GLN B 180 -17.751 -3.225 3.209 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.198 -4.941 1.785 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.597 -5.166 3.257 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.763 -4.279 3.711 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -21.747 -3.064 3.551 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -22.840 -4.842 4.232 1.00 0.00 N ATOM 0 H GLN B 180 -19.797 -3.831 -0.480 1.00 0.00 H new ATOM 0 HA GLN B 180 -19.966 -2.896 2.178 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -21.095 -4.929 1.166 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -19.587 -5.777 1.445 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -20.869 -6.212 3.397 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -19.734 -4.974 3.894 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -22.870 -5.852 4.372 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -23.640 -4.266 4.494 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.042 -4.203 1.309 1.00 0.00 N ATOM 1359 CA PHE B 181 -15.642 -4.286 1.717 1.00 0.00 C ATOM 1360 C PHE B 181 -15.127 -2.891 2.081 1.00 0.00 C ATOM 1361 O PHE B 181 -14.479 -2.705 3.113 1.00 0.00 O ATOM 1362 CB PHE B 181 -14.811 -4.903 0.586 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.354 -5.072 0.958 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -12.985 -6.014 1.937 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -12.379 -4.225 0.395 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -11.647 -6.113 2.349 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.042 -4.315 0.817 1.00 0.00 C ATOM 1368 CZ PHE B 181 -10.683 -5.256 1.796 1.00 0.00 C ATOM 0 H PHE B 181 -17.223 -4.561 0.371 1.00 0.00 H new ATOM 0 HA PHE B 181 -15.552 -4.924 2.596 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.229 -5.874 0.321 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -14.885 -4.272 -0.300 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -13.732 -6.661 2.372 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -12.659 -3.507 -0.361 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -11.360 -6.846 3.089 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -10.294 -3.664 0.391 1.00 0.00 H new ATOM 0 HZ PHE B 181 -9.657 -5.321 2.126 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.444 -1.903 1.235 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.050 -0.514 1.443 1.00 0.00 C ATOM 1380 C LEU B 182 -15.652 -0.021 2.758 1.00 0.00 C ATOM 1381 O LEU B 182 -14.963 0.556 3.594 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.568 0.344 0.270 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.823 1.673 0.033 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.468 2.412 -1.138 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.787 2.619 1.226 1.00 0.00 C ATOM 0 H LEU B 182 -15.985 -2.051 0.383 1.00 0.00 H new ATOM 0 HA LEU B 182 -13.964 -0.434 1.489 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.513 -0.250 -0.642 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.621 0.565 0.443 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.790 1.388 -0.167 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.944 3.352 -1.308 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.408 1.795 -2.035 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.514 2.616 -0.908 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -14.241 3.523 0.957 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.805 2.882 1.513 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.289 2.130 2.063 1.00 0.00 H new ATOM 1397 N THR B 183 -16.946 -0.262 2.956 1.00 0.00 N ATOM 1398 CA THR B 183 -17.674 0.162 4.135 1.00 0.00 C ATOM 1399 C THR B 183 -17.051 -0.450 5.384 1.00 0.00 C ATOM 1400 O THR B 183 -16.820 0.273 6.347 1.00 0.00 O ATOM 1401 CB THR B 183 -19.167 -0.160 3.969 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.653 0.337 2.735 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.970 0.503 5.083 1.00 0.00 C ATOM 0 H THR B 183 -17.523 -0.768 2.284 1.00 0.00 H new ATOM 0 HA THR B 183 -17.602 1.243 4.257 1.00 0.00 H new ATOM 0 HB THR B 183 -19.278 -1.244 4.005 1.00 0.00 H new ATOM 0 HG1 THR B 183 -19.374 -0.260 2.009 1.00 0.00 H new ATOM 0 HG21 THR B 183 -21.027 0.270 4.958 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.628 0.131 6.049 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.829 1.583 5.040 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.744 -1.748 5.380 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.134 -2.406 6.518 1.00 0.00 C ATOM 1413 C GLN B 184 -14.826 -1.702 6.867 1.00 0.00 C ATOM 1414 O GLN B 184 -14.617 -1.427 8.050 1.00 0.00 O ATOM 1415 CB GLN B 184 -15.926 -3.898 6.245 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.247 -4.677 6.180 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.130 -6.019 6.908 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -17.212 -6.088 8.134 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -16.864 -7.102 6.204 1.00 0.00 N ATOM 0 H GLN B 184 -16.914 -2.365 4.586 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.802 -2.337 7.376 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.390 -4.020 5.304 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.297 -4.322 7.027 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.045 -4.085 6.628 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.522 -4.847 5.139 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -16.796 -7.046 5.188 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -16.726 -7.996 6.676 1.00 0.00 H new ATOM 1428 N LEU B 185 -13.975 -1.390 5.879 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.709 -0.694 6.102 1.00 0.00 C ATOM 1430 C LEU B 185 -12.967 0.661 6.749 1.00 0.00 C ATOM 1431 O LEU B 185 -12.265 1.022 7.691 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.940 -0.464 4.791 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.065 -1.640 4.348 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.592 -1.397 2.914 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -9.824 -1.779 5.239 1.00 0.00 C ATOM 0 H LEU B 185 -14.151 -1.616 4.900 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.108 -1.327 6.755 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.656 -0.243 3.999 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.309 0.418 4.905 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.660 -2.550 4.421 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -9.968 -2.230 2.591 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.456 -1.314 2.255 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -10.014 -0.474 2.873 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.224 -2.623 4.898 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.231 -0.866 5.182 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.134 -1.947 6.270 1.00 0.00 H new ATOM 1447 N MET B 186 -13.984 1.396 6.285 1.00 0.00 N ATOM 1448 CA MET B 186 -14.328 2.709 6.815 1.00 0.00 C ATOM 1449 C MET B 186 -14.701 2.643 8.290 1.00 0.00 C ATOM 1450 O MET B 186 -14.705 3.681 8.940 1.00 0.00 O ATOM 1451 CB MET B 186 -15.487 3.345 6.035 1.00 0.00 C ATOM 1452 CG MET B 186 -15.097 3.738 4.612 1.00 0.00 C ATOM 1453 SD MET B 186 -16.386 4.661 3.738 1.00 0.00 S ATOM 1454 CE MET B 186 -15.922 6.326 4.279 1.00 0.00 C ATOM 0 H MET B 186 -14.592 1.089 5.526 1.00 0.00 H new ATOM 0 HA MET B 186 -13.437 3.327 6.702 1.00 0.00 H new ATOM 0 HB2 MET B 186 -16.322 2.645 5.998 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.836 4.229 6.569 1.00 0.00 H new ATOM 0 HG2 MET B 186 -14.189 4.341 4.646 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.860 2.837 4.047 1.00 0.00 H new ATOM 0 HE1 MET B 186 -16.512 7.063 3.734 1.00 0.00 H new ATOM 0 HE2 MET B 186 -16.111 6.427 5.348 1.00 0.00 H new ATOM 0 HE3 MET B 186 -14.863 6.491 4.081 1.00 0.00 H new ATOM 1464 N GLN B 187 -15.089 1.484 8.826 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.448 1.338 10.232 1.00 0.00 C ATOM 1466 C GLN B 187 -14.223 0.878 11.028 1.00 0.00 C ATOM 1467 O GLN B 187 -13.793 1.599 11.932 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.662 0.411 10.398 1.00 0.00 C ATOM 1469 CG GLN B 187 -17.906 0.663 9.523 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.495 2.079 9.400 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -17.717 3.144 9.304 1.00 0.00 O flip ATOM 1472 NE2 GLN B 187 -19.709 2.223 9.265 1.00 0.00 N flip ATOM 0 H GLN B 187 -15.162 0.618 8.292 1.00 0.00 H new ATOM 0 HA GLN B 187 -15.755 2.303 10.636 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.327 -0.610 10.212 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -16.975 0.459 11.441 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -17.665 0.325 8.515 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -18.699 0.015 9.896 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -20.329 1.416 9.335 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -20.096 3.149 9.083 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.614 -0.265 10.678 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.441 -0.789 11.390 1.00 0.00 C ATOM 1483 C LYS B 188 -11.255 0.174 11.438 1.00 0.00 C ATOM 1484 O LYS B 188 -10.497 0.127 12.402 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.017 -2.169 10.879 1.00 0.00 C ATOM 1486 CG LYS B 188 -11.569 -2.191 9.412 1.00 0.00 C ATOM 1487 CD LYS B 188 -10.822 -3.464 9.018 1.00 0.00 C ATOM 1488 CE LYS B 188 -11.723 -4.696 8.895 1.00 0.00 C ATOM 1489 NZ LYS B 188 -11.988 -5.362 10.182 1.00 0.00 N ATOM 0 H LYS B 188 -13.919 -0.848 9.899 1.00 0.00 H new ATOM 0 HA LYS B 188 -12.774 -0.901 12.422 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.202 -2.539 11.501 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -12.850 -2.861 11.002 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.445 -2.081 8.772 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -10.927 -1.330 9.224 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -10.317 -3.298 8.066 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.048 -3.664 9.759 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -12.671 -4.399 8.447 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -11.258 -5.410 8.215 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -12.083 -6.386 10.030 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -11.199 -5.181 10.835 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -12.869 -4.990 10.591 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.113 1.068 10.460 1.00 0.00 N ATOM 1504 CA GLU B 189 -10.023 2.030 10.419 1.00 0.00 C ATOM 1505 C GLU B 189 -10.536 3.468 10.509 1.00 0.00 C ATOM 1506 O GLU B 189 -9.858 4.391 10.070 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.103 1.769 9.220 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.317 0.457 9.298 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.184 0.496 10.330 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.456 0.379 11.549 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -5.998 0.554 9.934 1.00 0.00 O ATOM 0 H GLU B 189 -11.756 1.142 9.672 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.404 1.891 11.306 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -9.704 1.764 8.311 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.398 2.596 9.132 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.000 -0.355 9.548 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -7.899 0.232 8.317 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.714 3.698 11.102 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.273 5.047 11.238 1.00 0.00 C ATOM 1520 C GLN B 190 -11.427 5.976 12.120 1.00 0.00 C ATOM 1521 O GLN B 190 -11.733 7.169 12.216 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.725 4.985 11.737 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.897 4.730 13.246 1.00 0.00 C ATOM 1524 CD GLN B 190 -15.201 4.012 13.555 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -15.241 3.060 14.338 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -16.298 4.411 12.941 1.00 0.00 N ATOM 0 H GLN B 190 -12.300 2.963 11.497 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.257 5.486 10.240 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -14.217 5.925 11.487 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.245 4.197 11.192 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -13.060 4.135 13.611 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -13.870 5.680 13.780 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -16.262 5.199 12.294 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -17.182 3.932 13.113 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.412 5.444 12.803 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.504 6.174 13.679 1.00 0.00 C ATOM 1537 C ARG B 191 -8.147 6.307 12.994 1.00 0.00 C ATOM 1538 O ARG B 191 -7.547 7.383 13.023 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.393 5.443 15.029 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.757 5.360 15.735 1.00 0.00 C ATOM 1541 CD ARG B 191 -10.734 4.545 17.023 1.00 0.00 C ATOM 1542 NE ARG B 191 -9.847 5.139 18.026 1.00 0.00 N ATOM 1543 CZ ARG B 191 -9.668 4.694 19.268 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -10.251 3.586 19.712 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -8.929 5.417 20.091 1.00 0.00 N ATOM 0 H ARG B 191 -10.194 4.449 12.756 1.00 0.00 H new ATOM 0 HA ARG B 191 -9.886 7.176 13.874 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.002 4.438 14.869 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -8.681 5.964 15.669 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -11.101 6.369 15.961 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.484 4.921 15.051 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -11.744 4.475 17.427 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -10.407 3.529 16.804 1.00 0.00 H new ATOM 0 HE ARG B 191 -9.320 5.967 17.748 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -10.858 3.047 19.095 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -10.091 3.274 20.670 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -8.513 6.291 19.769 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -8.774 5.101 21.048 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.678 5.243 12.338 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.403 5.233 11.644 1.00 0.00 C ATOM 1561 C ASN B 192 -6.392 6.235 10.489 1.00 0.00 C ATOM 1562 O ASN B 192 -6.999 5.999 9.444 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.073 3.841 11.094 1.00 0.00 C ATOM 1564 CG ASN B 192 -4.684 3.822 10.472 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -3.883 4.739 10.647 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.364 2.788 9.726 1.00 0.00 N ATOM 0 H ASN B 192 -8.183 4.359 12.277 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.648 5.516 12.377 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.127 3.105 11.897 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -6.814 3.554 10.348 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.445 2.741 9.286 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -5.035 2.032 9.587 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.659 7.337 10.646 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.535 8.369 9.622 1.00 0.00 C ATOM 1575 C TYR B 193 -4.959 7.794 8.316 1.00 0.00 C ATOM 1576 O TYR B 193 -5.175 8.378 7.251 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.683 9.533 10.143 1.00 0.00 C ATOM 1578 CG TYR B 193 -3.314 9.111 10.639 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -2.245 8.960 9.733 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -3.128 8.795 11.998 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.998 8.490 10.178 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -1.880 8.341 12.453 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.804 8.204 11.549 1.00 0.00 C ATOM 1584 OH TYR B 193 0.386 7.735 12.012 1.00 0.00 O ATOM 0 H TYR B 193 -5.131 7.538 11.495 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.531 8.749 9.395 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.561 10.267 9.347 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -5.217 10.028 10.954 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.385 9.207 8.691 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -3.948 8.902 12.693 1.00 0.00 H new ATOM 0 HE1 TYR B 193 -0.190 8.348 9.475 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -1.743 8.096 13.496 1.00 0.00 H new ATOM 0 HH TYR B 193 0.329 7.598 12.981 1.00 0.00 H new ATOM 1594 N GLN B 194 -4.269 6.642 8.359 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.712 6.022 7.161 1.00 0.00 C ATOM 1596 C GLN B 194 -4.814 5.490 6.218 1.00 0.00 C ATOM 1597 O GLN B 194 -4.493 5.060 5.112 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.652 4.949 7.501 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.390 5.216 6.664 1.00 0.00 C ATOM 1600 CD GLN B 194 -0.499 4.013 6.368 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -0.327 3.117 7.194 1.00 0.00 O ATOM 1602 NE2 GLN B 194 0.102 3.974 5.191 1.00 0.00 N ATOM 0 H GLN B 194 -4.087 6.125 9.219 1.00 0.00 H new ATOM 0 HA GLN B 194 -3.189 6.805 6.612 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.413 4.978 8.564 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -3.042 3.953 7.289 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -1.697 5.654 5.714 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.790 5.965 7.181 1.00 0.00 H new ATOM 0 HE21 GLN B 194 -0.050 4.723 4.516 1.00 0.00 H new ATOM 0 HE22 GLN B 194 0.717 3.194 4.958 1.00 0.00 H new ATOM 1611 N PHE B 195 -6.088 5.504 6.637 1.00 0.00 N ATOM 1612 CA PHE B 195 -7.265 5.092 5.872 1.00 0.00 C ATOM 1613 C PHE B 195 -8.236 6.267 5.705 1.00 0.00 C ATOM 1614 O PHE B 195 -9.340 6.092 5.187 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.927 3.862 6.486 1.00 0.00 C ATOM 1616 CG PHE B 195 -7.183 2.602 6.107 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -7.372 2.032 4.836 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -6.225 2.068 6.980 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.603 0.925 4.445 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.460 0.956 6.597 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.657 0.380 5.330 1.00 0.00 C ATOM 0 H PHE B 195 -6.334 5.823 7.574 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.944 4.796 4.873 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -7.952 3.961 7.571 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.961 3.794 6.148 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -8.108 2.445 4.162 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -6.075 2.515 7.952 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -6.738 0.492 3.465 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -4.724 0.545 7.272 1.00 0.00 H new ATOM 0 HZ PHE B 195 -5.080 -0.484 5.036 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.831 7.481 6.105 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.645 8.694 5.988 1.00 0.00 C ATOM 1633 C ASP B 196 -8.979 8.979 4.517 1.00 0.00 C ATOM 1634 O ASP B 196 -9.934 9.700 4.221 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.906 9.875 6.630 1.00 0.00 C ATOM 1636 CG ASP B 196 -8.819 11.075 6.845 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -9.800 10.948 7.615 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -8.545 12.163 6.291 1.00 0.00 O ATOM 0 H ASP B 196 -6.916 7.647 6.524 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.587 8.547 6.516 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -7.487 9.563 7.587 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.069 10.166 5.995 1.00 0.00 H new ATOM 1643 N PHE B 197 -8.217 8.366 3.596 1.00 0.00 N ATOM 1644 CA PHE B 197 -8.370 8.471 2.158 1.00 0.00 C ATOM 1645 C PHE B 197 -9.738 7.951 1.694 1.00 0.00 C ATOM 1646 O PHE B 197 -10.234 8.382 0.654 1.00 0.00 O ATOM 1647 CB PHE B 197 -7.185 7.779 1.437 1.00 0.00 C ATOM 1648 CG PHE B 197 -7.140 6.265 1.474 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.910 5.519 0.558 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -6.268 5.605 2.357 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.834 4.116 0.553 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -6.199 4.201 2.357 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.991 3.459 1.464 1.00 0.00 C ATOM 0 H PHE B 197 -7.443 7.757 3.860 1.00 0.00 H new ATOM 0 HA PHE B 197 -8.344 9.525 1.882 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -7.196 8.091 0.393 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -6.259 8.155 1.872 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.559 6.027 -0.140 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.651 6.176 3.035 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.422 3.544 -0.150 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -5.538 3.693 3.043 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.951 2.380 1.478 1.00 0.00 H new ATOM 1663 N LEU B 198 -10.368 7.051 2.451 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.677 6.498 2.109 1.00 0.00 C ATOM 1665 C LEU B 198 -12.802 7.524 2.280 1.00 0.00 C ATOM 1666 O LEU B 198 -13.921 7.275 1.818 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.953 5.273 2.993 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.932 4.133 2.819 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -11.156 3.084 3.910 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -11.039 3.489 1.430 1.00 0.00 C ATOM 0 H LEU B 198 -9.982 6.685 3.321 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.656 6.212 1.057 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.959 5.585 4.037 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.949 4.892 2.768 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.929 4.550 2.909 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.435 2.275 3.790 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -11.026 3.544 4.889 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -12.167 2.684 3.828 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -10.304 2.689 1.342 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -12.040 3.079 1.295 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.849 4.241 0.665 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.553 8.648 2.963 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.550 9.687 3.201 1.00 0.00 C ATOM 1684 C ARG B 199 -13.372 10.839 2.211 1.00 0.00 C ATOM 1685 O ARG B 199 -12.245 11.139 1.823 1.00 0.00 O ATOM 1686 CB ARG B 199 -13.438 10.186 4.644 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.725 9.081 5.667 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.770 9.661 7.078 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.965 10.491 7.300 1.00 0.00 N ATOM 1690 CZ ARG B 199 -15.076 11.389 8.282 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -14.015 11.790 8.967 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -16.262 11.893 8.582 1.00 0.00 N ATOM 0 H ARG B 199 -11.641 8.860 3.369 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.545 9.268 3.050 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -12.437 10.582 4.812 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -14.136 11.009 4.796 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.675 8.599 5.435 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.955 8.312 5.607 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -13.754 8.848 7.804 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -12.876 10.260 7.251 1.00 0.00 H new ATOM 0 HE ARG B 199 -15.755 10.373 6.666 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -13.093 11.412 8.748 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -14.120 12.477 9.714 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -17.089 11.595 8.064 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -16.350 12.579 9.332 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.461 11.549 1.864 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.426 12.659 0.914 1.00 0.00 C ATOM 1708 C PRO B 200 -13.643 13.889 1.362 1.00 0.00 C ATOM 1709 O PRO B 200 -13.363 14.753 0.536 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.884 13.007 0.640 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.625 12.513 1.878 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.831 11.280 2.278 1.00 0.00 C ATOM 0 HA PRO B 200 -13.882 12.339 0.025 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -16.018 14.079 0.497 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -16.247 12.517 -0.264 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.634 13.262 2.670 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.664 12.270 1.657 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.890 11.107 3.353 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -16.220 10.387 1.790 1.00 0.00 H new ATOM 1720 N GLN B 201 -13.299 13.997 2.639 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.542 15.134 3.160 1.00 0.00 C ATOM 1722 C GLN B 201 -11.039 15.039 2.820 1.00 0.00 C ATOM 1723 O GLN B 201 -10.280 15.920 3.225 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.821 15.279 4.670 1.00 0.00 C ATOM 1725 CG GLN B 201 -14.296 15.639 4.926 1.00 0.00 C ATOM 1726 CD GLN B 201 -14.651 15.661 6.410 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -14.084 16.417 7.199 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -15.617 14.856 6.831 1.00 0.00 N ATOM 0 H GLN B 201 -13.536 13.300 3.345 1.00 0.00 H new ATOM 0 HA GLN B 201 -12.878 16.046 2.667 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -12.577 14.347 5.180 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -12.176 16.051 5.090 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -14.507 16.616 4.492 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -14.935 14.919 4.415 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -16.084 14.232 6.173 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -15.894 14.861 7.813 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.607 14.003 2.091 1.00 0.00 N ATOM 1738 CA HIS B 202 -9.229 13.758 1.682 1.00 0.00 C ATOM 1739 C HIS B 202 -9.063 14.132 0.207 1.00 0.00 C ATOM 1740 O HIS B 202 -9.902 13.777 -0.620 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.959 12.262 1.876 1.00 0.00 C ATOM 1742 CG HIS B 202 -7.508 11.911 2.063 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -6.721 11.290 1.128 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.809 11.932 3.239 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -5.556 10.971 1.711 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -5.557 11.351 3.001 1.00 0.00 N ATOM 0 H HIS B 202 -11.245 13.280 1.757 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.531 14.354 2.270 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -9.519 11.914 2.744 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -9.342 11.721 1.011 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -7.160 12.326 4.182 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -4.733 10.478 1.214 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.797 11.239 3.672 1.00 0.00 H new ATOM 1754 N SER B 203 -7.955 14.770 -0.168 1.00 0.00 N ATOM 1755 CA SER B 203 -7.698 15.175 -1.549 1.00 0.00 C ATOM 1756 C SER B 203 -7.657 13.982 -2.509 1.00 0.00 C ATOM 1757 O SER B 203 -8.241 14.030 -3.596 1.00 0.00 O ATOM 1758 CB SER B 203 -6.375 15.930 -1.612 1.00 0.00 C ATOM 1759 OG SER B 203 -6.446 17.091 -0.817 1.00 0.00 O ATOM 0 H SER B 203 -7.208 15.021 0.480 1.00 0.00 H new ATOM 0 HA SER B 203 -8.520 15.816 -1.866 1.00 0.00 H new ATOM 0 HB2 SER B 203 -5.564 15.290 -1.264 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.149 16.199 -2.644 1.00 0.00 H new ATOM 0 HG SER B 203 -5.592 17.570 -0.861 1.00 0.00 H new ATOM 1765 N LEU B 204 -6.991 12.890 -2.118 1.00 0.00 N ATOM 1766 CA LEU B 204 -6.870 11.680 -2.935 1.00 0.00 C ATOM 1767 C LEU B 204 -8.222 10.992 -3.163 1.00 0.00 C ATOM 1768 O LEU B 204 -8.274 10.008 -3.901 1.00 0.00 O ATOM 1769 CB LEU B 204 -5.877 10.688 -2.277 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.392 11.057 -2.400 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -3.538 10.047 -1.631 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.943 11.070 -3.866 1.00 0.00 C ATOM 0 H LEU B 204 -6.517 12.822 -1.217 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.492 11.987 -3.910 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.125 10.601 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.026 9.704 -2.721 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.262 12.055 -1.982 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -2.486 10.316 -1.723 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -3.824 10.055 -0.579 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -3.695 9.050 -2.042 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.887 11.335 -3.921 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -4.092 10.082 -4.301 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.530 11.803 -4.420 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.324 11.470 -2.571 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.635 10.854 -2.720 1.00 0.00 C ATOM 1786 C PHE B 205 -11.034 10.848 -4.186 1.00 0.00 C ATOM 1787 O PHE B 205 -11.565 9.859 -4.683 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.660 11.598 -1.858 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.036 10.979 -1.893 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.371 9.954 -0.987 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.983 11.420 -2.837 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -14.650 9.370 -1.029 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -15.249 10.819 -2.890 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.582 9.793 -1.992 1.00 0.00 C ATOM 0 H PHE B 205 -9.324 12.298 -1.975 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.599 9.820 -2.377 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.307 11.622 -0.827 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.726 12.632 -2.197 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -12.646 9.617 -0.261 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -13.735 12.220 -3.519 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -14.915 8.598 -0.322 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.970 11.147 -3.624 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.556 9.328 -2.041 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.729 11.936 -4.892 1.00 0.00 N ATOM 1805 CA ASN B 206 -11.055 12.065 -6.307 1.00 0.00 C ATOM 1806 C ASN B 206 -10.256 11.082 -7.176 1.00 0.00 C ATOM 1807 O ASN B 206 -10.684 10.789 -8.292 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.808 13.512 -6.758 1.00 0.00 C ATOM 1809 CG ASN B 206 -11.995 14.423 -6.485 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -12.601 14.955 -7.409 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.376 14.631 -5.239 1.00 0.00 N ATOM 0 H ASN B 206 -10.252 12.747 -4.500 1.00 0.00 H new ATOM 0 HA ASN B 206 -12.108 11.816 -6.437 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -9.930 13.903 -6.245 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.585 13.523 -7.825 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -13.175 15.234 -5.044 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -11.872 14.188 -4.471 1.00 0.00 H new ATOM 1818 N TYR B 207 -9.102 10.600 -6.700 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.254 9.642 -7.405 1.00 0.00 C ATOM 1820 C TYR B 207 -8.796 8.234 -7.146 1.00 0.00 C ATOM 1821 O TYR B 207 -8.993 7.474 -8.091 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.792 9.786 -6.941 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.819 8.779 -7.536 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.133 9.076 -8.726 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -5.556 7.560 -6.880 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.235 8.149 -9.283 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.635 6.638 -7.414 1.00 0.00 C ATOM 1828 CZ TYR B 207 -4.003 6.915 -8.643 1.00 0.00 C ATOM 1829 OH TYR B 207 -3.145 6.016 -9.190 1.00 0.00 O ATOM 0 H TYR B 207 -8.726 10.874 -5.792 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.270 9.834 -8.478 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.447 10.790 -7.188 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.762 9.697 -5.855 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -5.297 10.024 -9.217 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -6.067 7.330 -5.957 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -3.721 8.383 -10.204 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -4.414 5.723 -6.884 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.450 6.491 -9.692 1.00 0.00 H new ATOM 1839 N PHE B 208 -9.055 7.901 -5.871 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.568 6.599 -5.463 1.00 0.00 C ATOM 1841 C PHE B 208 -10.877 6.268 -6.185 1.00 0.00 C ATOM 1842 O PHE B 208 -10.942 5.219 -6.819 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.715 6.534 -3.930 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.416 5.293 -3.397 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -11.820 5.250 -3.396 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -9.703 4.195 -2.876 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -12.516 4.167 -2.857 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -10.398 3.097 -2.334 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.803 3.091 -2.306 1.00 0.00 C ATOM 0 H PHE B 208 -8.910 8.542 -5.091 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.848 5.835 -5.756 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.722 6.591 -3.483 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -10.265 7.414 -3.596 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -12.373 6.074 -3.822 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -8.623 4.196 -2.892 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -13.596 4.157 -2.864 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -9.849 2.256 -1.938 1.00 0.00 H new ATOM 0 HZ PHE B 208 -12.332 2.261 -1.862 1.00 0.00 H new ATOM 1859 N THR B 209 -11.887 7.149 -6.138 1.00 0.00 N ATOM 1860 CA THR B 209 -13.177 6.897 -6.783 1.00 0.00 C ATOM 1861 C THR B 209 -12.986 6.534 -8.251 1.00 0.00 C ATOM 1862 O THR B 209 -13.396 5.451 -8.654 1.00 0.00 O ATOM 1863 CB THR B 209 -14.174 8.050 -6.537 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.450 7.773 -7.086 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.758 9.412 -7.102 1.00 0.00 C ATOM 0 H THR B 209 -11.831 8.046 -5.656 1.00 0.00 H new ATOM 0 HA THR B 209 -13.639 6.026 -6.318 1.00 0.00 H new ATOM 0 HB THR B 209 -14.193 8.113 -5.449 1.00 0.00 H new ATOM 0 HG1 THR B 209 -16.053 8.525 -6.908 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.527 10.150 -6.875 1.00 0.00 H new ATOM 0 HG22 THR B 209 -12.814 9.720 -6.652 1.00 0.00 H new ATOM 0 HG23 THR B 209 -13.636 9.336 -8.183 1.00 0.00 H new ATOM 1873 N LYS B 210 -12.285 7.373 -9.021 1.00 0.00 N ATOM 1874 CA LYS B 210 -12.020 7.181 -10.438 1.00 0.00 C ATOM 1875 C LYS B 210 -11.518 5.772 -10.762 1.00 0.00 C ATOM 1876 O LYS B 210 -11.852 5.215 -11.810 1.00 0.00 O ATOM 1877 CB LYS B 210 -11.006 8.250 -10.854 1.00 0.00 C ATOM 1878 CG LYS B 210 -11.075 8.441 -12.360 1.00 0.00 C ATOM 1879 CD LYS B 210 -9.925 9.310 -12.857 1.00 0.00 C ATOM 1880 CE LYS B 210 -10.122 9.533 -14.358 1.00 0.00 C ATOM 1881 NZ LYS B 210 -8.923 10.094 -15.010 1.00 0.00 N ATOM 0 H LYS B 210 -11.875 8.232 -8.655 1.00 0.00 H new ATOM 0 HA LYS B 210 -12.947 7.285 -11.001 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -11.220 9.190 -10.345 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -10.001 7.950 -10.559 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -11.041 7.470 -12.855 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -12.026 8.902 -12.628 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -9.910 10.263 -12.328 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -8.968 8.824 -12.665 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -10.379 8.586 -14.832 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -10.965 10.206 -14.514 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -9.109 10.226 -16.025 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -8.691 11.011 -14.579 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -8.123 9.441 -14.887 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.663 5.223 -9.901 1.00 0.00 N ATOM 1896 CA LEU B 211 -10.125 3.882 -10.075 1.00 0.00 C ATOM 1897 C LEU B 211 -11.189 2.811 -9.828 1.00 0.00 C ATOM 1898 O LEU B 211 -11.149 1.801 -10.524 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.956 3.622 -9.111 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.633 4.320 -9.456 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.650 4.067 -8.310 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -7.021 3.794 -10.761 1.00 0.00 C ATOM 0 H LEU B 211 -10.326 5.698 -9.064 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.779 3.823 -11.107 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -9.259 3.934 -8.111 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.777 2.548 -9.069 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.831 5.383 -9.592 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.700 4.554 -8.531 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -7.058 4.472 -7.384 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -6.491 2.995 -8.197 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -6.087 4.318 -10.962 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.824 2.726 -10.666 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.716 3.963 -11.583 1.00 0.00 H new ATOM 1914 N VAL B 212 -12.096 2.961 -8.856 1.00 0.00 N ATOM 1915 CA VAL B 212 -13.111 1.942 -8.596 1.00 0.00 C ATOM 1916 C VAL B 212 -14.005 1.833 -9.823 1.00 0.00 C ATOM 1917 O VAL B 212 -14.181 0.730 -10.327 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.935 2.239 -7.326 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.894 1.084 -7.008 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -13.044 2.458 -6.091 1.00 0.00 C ATOM 0 H VAL B 212 -12.146 3.774 -8.242 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.614 0.990 -8.409 1.00 0.00 H new ATOM 0 HB VAL B 212 -14.491 3.152 -7.538 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.462 1.320 -6.108 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.580 0.940 -7.843 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.322 0.170 -6.847 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.670 2.664 -5.223 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.451 1.562 -5.907 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -12.379 3.303 -6.267 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.492 2.963 -10.345 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.373 3.019 -11.511 1.00 0.00 C ATOM 1932 C GLU B 213 -14.711 2.460 -12.773 1.00 0.00 C ATOM 1933 O GLU B 213 -15.405 2.168 -13.746 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.836 4.465 -11.765 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.212 5.279 -10.520 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.338 4.681 -9.680 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -17.051 3.797 -8.850 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -18.518 5.112 -9.790 1.00 0.00 O ATOM 0 H GLU B 213 -14.279 3.883 -9.959 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.234 2.390 -11.286 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -15.042 4.992 -12.293 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.698 4.438 -12.431 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.327 5.386 -9.892 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -16.504 6.281 -10.833 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.382 2.355 -12.778 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.597 1.824 -13.873 1.00 0.00 C ATOM 1947 C GLN B 214 -12.463 0.314 -13.702 1.00 0.00 C ATOM 1948 O GLN B 214 -12.600 -0.438 -14.666 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.213 2.485 -13.852 1.00 0.00 C ATOM 1950 CG GLN B 214 -10.357 2.066 -15.046 1.00 0.00 C ATOM 1951 CD GLN B 214 -9.065 2.863 -15.159 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -8.869 3.619 -16.105 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.137 2.701 -14.227 1.00 0.00 N ATOM 0 H GLN B 214 -12.810 2.650 -11.987 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.082 2.032 -14.827 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.329 3.569 -13.853 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.699 2.220 -12.928 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -10.118 1.006 -14.960 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -10.935 2.189 -15.962 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -8.306 2.071 -13.443 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -7.254 3.206 -14.294 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.133 -0.130 -12.489 1.00 0.00 N ATOM 1963 CA TYR B 215 -11.957 -1.533 -12.168 1.00 0.00 C ATOM 1964 C TYR B 215 -13.279 -2.304 -12.200 1.00 0.00 C ATOM 1965 O TYR B 215 -13.240 -3.478 -12.580 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.277 -1.665 -10.797 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.847 -1.148 -10.684 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -8.895 -1.406 -11.690 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.442 -0.468 -9.519 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.561 -0.995 -11.534 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -8.109 -0.057 -9.349 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.161 -0.328 -10.356 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.864 0.037 -10.175 1.00 0.00 O ATOM 0 H TYR B 215 -11.980 0.491 -11.694 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.319 -1.977 -12.932 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.887 -1.138 -10.063 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.280 -2.718 -10.517 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.194 -1.924 -12.589 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -10.166 -0.259 -8.745 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -6.841 -1.189 -12.315 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.812 0.464 -8.451 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.768 0.486 -9.309 1.00 0.00 H new ATOM 1983 N THR B 216 -14.417 -1.695 -11.841 1.00 0.00 N ATOM 1984 CA THR B 216 -15.696 -2.396 -11.858 1.00 0.00 C ATOM 1985 C THR B 216 -16.057 -2.926 -13.254 1.00 0.00 C ATOM 1986 O THR B 216 -15.575 -2.440 -14.286 1.00 0.00 O ATOM 1987 CB THR B 216 -16.810 -1.528 -11.237 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.685 -0.152 -11.531 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.813 -1.705 -9.717 1.00 0.00 C ATOM 0 H THR B 216 -14.472 -0.723 -11.537 1.00 0.00 H new ATOM 0 HA THR B 216 -15.594 -3.282 -11.231 1.00 0.00 H new ATOM 0 HB THR B 216 -17.745 -1.870 -11.680 1.00 0.00 H new ATOM 0 HG1 THR B 216 -15.933 0.223 -11.026 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.601 -1.091 -9.281 1.00 0.00 H new ATOM 0 HG22 THR B 216 -16.992 -2.752 -9.473 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.848 -1.398 -9.313 1.00 0.00 H new