USER MOD reduce.3.24.130724 H: found=0, std=0, add=597, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 598 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= 0.73 K(o=0.73,f=-0.64) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 160 SER OG : rot 28:sc= 0.15 USER MOD Single : B 168 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 170 THR OG1 : rot 94:sc= 1.22 USER MOD Single : B 172 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 177 ASN : amide:sc= -0.253 X(o=-0.25,f=-0.73!) USER MOD Single : B 180 GLN : amide:sc= -0.327 K(o=-0.33,f=-2.3) USER MOD Single : B 183 THR OG1 : rot 180:sc= 0 USER MOD Single : B 184 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 186 MET CE :methyl 170:sc= -0.38 (180deg=-0.558) USER MOD Single : B 187 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.17) USER MOD Single : B 188 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 190 GLN : amide:sc= 1.05 K(o=1.1,f=0) USER MOD Single : B 192 ASN : amide:sc= 1.09 K(o=1.1,f=-7.9!) USER MOD Single : B 193 TYR OH : rot 180:sc= 0 USER MOD Single : B 194 GLN : amide:sc= 1.69 K(o=1.7,f=-0.11) USER MOD Single : B 201 GLN : amide:sc= 0 X(o=0,f=-0.048) USER MOD Single : B 202 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.23) 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 60: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=-0.00271 X(o=-0.0027,f=-0.063) USER MOD Single : B 215 TYR OH : rot 180:sc= 0 USER MOD Single : B 216 THR OG1 : rot 17:sc= 0.882 USER MOD ----------------------------------------------------------------- ATOM 131 N GLU A 80 -11.246 -12.085 1.714 1.00 0.00 N ATOM 132 CA GLU A 80 -10.930 -10.756 1.215 1.00 0.00 C ATOM 133 C GLU A 80 -10.040 -9.992 2.203 1.00 0.00 C ATOM 134 O GLU A 80 -8.980 -9.518 1.809 1.00 0.00 O ATOM 135 CB GLU A 80 -12.236 -10.016 0.867 1.00 0.00 C ATOM 136 CG GLU A 80 -13.175 -9.821 2.072 1.00 0.00 C ATOM 137 CD GLU A 80 -14.650 -9.777 1.678 1.00 0.00 C ATOM 138 OE1 GLU A 80 -15.126 -8.788 1.082 1.00 0.00 O ATOM 139 OE2 GLU A 80 -15.357 -10.748 2.042 1.00 0.00 O ATOM 0 HA GLU A 80 -10.346 -10.834 0.298 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -11.990 -9.041 0.447 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -12.764 -10.573 0.092 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -13.018 -10.633 2.783 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -12.913 -8.895 2.583 1.00 0.00 H new ATOM 146 N PHE A 81 -10.407 -9.913 3.487 1.00 0.00 N ATOM 147 CA PHE A 81 -9.595 -9.193 4.465 1.00 0.00 C ATOM 148 C PHE A 81 -8.244 -9.865 4.697 1.00 0.00 C ATOM 149 O PHE A 81 -7.253 -9.166 4.913 1.00 0.00 O ATOM 150 CB PHE A 81 -10.345 -9.015 5.794 1.00 0.00 C ATOM 151 CG PHE A 81 -11.365 -7.891 5.831 1.00 0.00 C ATOM 152 CD1 PHE A 81 -11.032 -6.612 5.343 1.00 0.00 C ATOM 153 CD2 PHE A 81 -12.623 -8.085 6.432 1.00 0.00 C ATOM 154 CE1 PHE A 81 -11.945 -5.549 5.431 1.00 0.00 C ATOM 155 CE2 PHE A 81 -13.527 -7.012 6.550 1.00 0.00 C ATOM 156 CZ PHE A 81 -13.188 -5.743 6.048 1.00 0.00 C ATOM 0 H PHE A 81 -11.254 -10.336 3.867 1.00 0.00 H new ATOM 0 HA PHE A 81 -9.403 -8.206 4.045 1.00 0.00 H new ATOM 0 HB2 PHE A 81 -10.853 -9.950 6.031 1.00 0.00 H new ATOM 0 HB3 PHE A 81 -9.613 -8.842 6.583 1.00 0.00 H new ATOM 0 HD1 PHE A 81 -10.063 -6.447 4.896 1.00 0.00 H new ATOM 0 HD2 PHE A 81 -12.896 -9.061 6.804 1.00 0.00 H new ATOM 0 HE1 PHE A 81 -11.689 -4.582 5.023 1.00 0.00 H new ATOM 0 HE2 PHE A 81 -14.484 -7.164 7.028 1.00 0.00 H new ATOM 0 HZ PHE A 81 -13.883 -4.921 6.138 1.00 0.00 H new ATOM 166 N ALA A 82 -8.184 -11.198 4.667 1.00 0.00 N ATOM 167 CA ALA A 82 -6.940 -11.918 4.882 1.00 0.00 C ATOM 168 C ALA A 82 -5.939 -11.565 3.789 1.00 0.00 C ATOM 169 O ALA A 82 -4.819 -11.137 4.087 1.00 0.00 O ATOM 170 CB ALA A 82 -7.182 -13.431 4.908 1.00 0.00 C ATOM 0 H ALA A 82 -8.991 -11.798 4.494 1.00 0.00 H new ATOM 0 HA ALA A 82 -6.533 -11.621 5.849 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -6.236 -13.948 5.070 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -7.872 -13.675 5.716 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -7.610 -13.747 3.957 1.00 0.00 H new ATOM 176 N GLU A 83 -6.358 -11.734 2.535 1.00 0.00 N ATOM 177 CA GLU A 83 -5.514 -11.456 1.392 1.00 0.00 C ATOM 178 C GLU A 83 -5.215 -9.961 1.258 1.00 0.00 C ATOM 179 O GLU A 83 -4.111 -9.605 0.850 1.00 0.00 O ATOM 180 CB GLU A 83 -6.140 -12.093 0.147 1.00 0.00 C ATOM 181 CG GLU A 83 -5.258 -11.998 -1.106 1.00 0.00 C ATOM 182 CD GLU A 83 -3.846 -12.611 -1.015 1.00 0.00 C ATOM 183 OE1 GLU A 83 -3.430 -13.187 0.026 1.00 0.00 O ATOM 184 OE2 GLU A 83 -3.114 -12.494 -2.021 1.00 0.00 O ATOM 0 H GLU A 83 -7.291 -12.067 2.292 1.00 0.00 H new ATOM 0 HA GLU A 83 -4.533 -11.911 1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -6.350 -13.142 0.354 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -7.096 -11.610 -0.055 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -5.785 -12.481 -1.929 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -5.154 -10.945 -1.368 1.00 0.00 H new ATOM 191 N PHE A 84 -6.142 -9.079 1.645 1.00 0.00 N ATOM 192 CA PHE A 84 -5.926 -7.641 1.584 1.00 0.00 C ATOM 193 C PHE A 84 -4.717 -7.286 2.453 1.00 0.00 C ATOM 194 O PHE A 84 -3.810 -6.598 1.988 1.00 0.00 O ATOM 195 CB PHE A 84 -7.186 -6.913 2.053 1.00 0.00 C ATOM 196 CG PHE A 84 -7.035 -5.412 2.147 1.00 0.00 C ATOM 197 CD1 PHE A 84 -6.773 -4.664 0.987 1.00 0.00 C ATOM 198 CD2 PHE A 84 -7.178 -4.756 3.386 1.00 0.00 C ATOM 199 CE1 PHE A 84 -6.640 -3.268 1.065 1.00 0.00 C ATOM 200 CE2 PHE A 84 -7.081 -3.354 3.458 1.00 0.00 C ATOM 201 CZ PHE A 84 -6.813 -2.610 2.295 1.00 0.00 C ATOM 0 H PHE A 84 -7.057 -9.346 2.007 1.00 0.00 H new ATOM 0 HA PHE A 84 -5.722 -7.328 0.560 1.00 0.00 H new ATOM 0 HB2 PHE A 84 -8.001 -7.143 1.367 1.00 0.00 H new ATOM 0 HB3 PHE A 84 -7.473 -7.300 3.031 1.00 0.00 H new ATOM 0 HD1 PHE A 84 -6.674 -5.163 0.034 1.00 0.00 H new ATOM 0 HD2 PHE A 84 -7.362 -5.330 4.282 1.00 0.00 H new ATOM 0 HE1 PHE A 84 -6.404 -2.699 0.178 1.00 0.00 H new ATOM 0 HE2 PHE A 84 -7.212 -2.850 4.404 1.00 0.00 H new ATOM 0 HZ PHE A 84 -6.740 -1.534 2.347 1.00 0.00 H new ATOM 211 N TYR A 85 -4.683 -7.777 3.696 1.00 0.00 N ATOM 212 CA TYR A 85 -3.565 -7.508 4.584 1.00 0.00 C ATOM 213 C TYR A 85 -2.289 -8.158 4.065 1.00 0.00 C ATOM 214 O TYR A 85 -1.220 -7.566 4.195 1.00 0.00 O ATOM 215 CB TYR A 85 -3.889 -7.945 6.006 1.00 0.00 C ATOM 216 CG TYR A 85 -4.794 -6.985 6.745 1.00 0.00 C ATOM 217 CD1 TYR A 85 -4.427 -5.632 6.888 1.00 0.00 C ATOM 218 CD2 TYR A 85 -6.003 -7.442 7.296 1.00 0.00 C ATOM 219 CE1 TYR A 85 -5.251 -4.746 7.601 1.00 0.00 C ATOM 220 CE2 TYR A 85 -6.827 -6.569 8.021 1.00 0.00 C ATOM 221 CZ TYR A 85 -6.445 -5.219 8.191 1.00 0.00 C ATOM 222 OH TYR A 85 -7.261 -4.369 8.871 1.00 0.00 O ATOM 0 H TYR A 85 -5.416 -8.359 4.101 1.00 0.00 H new ATOM 0 HA TYR A 85 -3.392 -6.432 4.605 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -4.362 -8.927 5.976 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -2.959 -8.056 6.563 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -3.508 -5.275 6.447 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.299 -8.472 7.160 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -4.973 -3.707 7.698 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -7.752 -6.928 8.449 1.00 0.00 H new ATOM 0 HH TYR A 85 -8.037 -4.862 9.210 1.00 0.00 H new ATOM 232 N ASN A 86 -2.370 -9.350 3.465 1.00 0.00 N ATOM 233 CA ASN A 86 -1.208 -10.022 2.919 1.00 0.00 C ATOM 234 C ASN A 86 -0.584 -9.128 1.839 1.00 0.00 C ATOM 235 O ASN A 86 0.631 -8.917 1.826 1.00 0.00 O ATOM 236 CB ASN A 86 -1.623 -11.368 2.319 1.00 0.00 C ATOM 237 CG ASN A 86 -1.978 -12.474 3.301 1.00 0.00 C ATOM 238 OD1 ASN A 86 -1.612 -12.426 4.474 1.00 0.00 O ATOM 239 ND2 ASN A 86 -2.679 -13.500 2.843 1.00 0.00 N ATOM 0 H ASN A 86 -3.242 -9.866 3.349 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.478 -10.205 3.707 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.483 -11.201 1.670 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -0.810 -11.723 1.686 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -2.925 -14.269 3.467 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -2.973 -13.521 1.867 1.00 0.00 H new ATOM 246 N ARG A 87 -1.416 -8.582 0.944 1.00 0.00 N ATOM 247 CA ARG A 87 -1.001 -7.686 -0.132 1.00 0.00 C ATOM 248 C ARG A 87 -0.409 -6.415 0.473 1.00 0.00 C ATOM 249 O ARG A 87 0.670 -6.011 0.054 1.00 0.00 O ATOM 250 CB ARG A 87 -2.206 -7.341 -1.016 1.00 0.00 C ATOM 251 CG ARG A 87 -2.732 -8.494 -1.887 1.00 0.00 C ATOM 252 CD ARG A 87 -2.269 -8.388 -3.343 1.00 0.00 C ATOM 253 NE ARG A 87 -0.916 -8.900 -3.581 1.00 0.00 N ATOM 254 CZ ARG A 87 -0.304 -8.875 -4.768 1.00 0.00 C ATOM 255 NH1 ARG A 87 -0.823 -8.226 -5.804 1.00 0.00 N ATOM 256 NH2 ARG A 87 0.824 -9.536 -4.953 1.00 0.00 N ATOM 0 H ARG A 87 -2.421 -8.758 0.952 1.00 0.00 H new ATOM 0 HA ARG A 87 -0.247 -8.177 -0.747 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -3.017 -6.991 -0.377 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -1.932 -6.511 -1.667 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -2.395 -9.443 -1.470 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -3.822 -8.501 -1.855 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -2.969 -8.934 -3.976 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -2.310 -7.343 -3.650 1.00 0.00 H new ATOM 0 HE ARG A 87 -0.410 -9.300 -2.791 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -1.709 -7.731 -5.704 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -0.335 -8.222 -6.700 1.00 0.00 H new ATOM 0 HH21 ARG A 87 1.234 -10.070 -4.187 1.00 0.00 H new ATOM 0 HH22 ARG A 87 1.286 -9.512 -5.862 1.00 0.00 H new ATOM 270 N LEU A 88 -1.078 -5.809 1.465 1.00 0.00 N ATOM 271 CA LEU A 88 -0.612 -4.597 2.136 1.00 0.00 C ATOM 272 C LEU A 88 0.817 -4.811 2.615 1.00 0.00 C ATOM 273 O LEU A 88 1.696 -4.025 2.258 1.00 0.00 O ATOM 274 CB LEU A 88 -1.509 -4.215 3.331 1.00 0.00 C ATOM 275 CG LEU A 88 -2.746 -3.371 2.980 1.00 0.00 C ATOM 276 CD1 LEU A 88 -3.697 -3.327 4.182 1.00 0.00 C ATOM 277 CD2 LEU A 88 -2.356 -1.931 2.630 1.00 0.00 C ATOM 0 H LEU A 88 -1.968 -6.155 1.824 1.00 0.00 H new ATOM 0 HA LEU A 88 -0.656 -3.777 1.420 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -1.841 -5.130 3.822 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -0.907 -3.665 4.055 1.00 0.00 H new ATOM 0 HG LEU A 88 -3.228 -3.832 2.118 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -4.573 -2.729 3.931 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.010 -4.340 4.436 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -3.185 -2.881 5.035 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.252 -1.360 2.387 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -1.854 -1.473 3.482 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -1.684 -1.934 1.772 1.00 0.00 H new ATOM 289 N LYS A 89 1.044 -5.866 3.408 1.00 0.00 N ATOM 290 CA LYS A 89 2.351 -6.227 3.957 1.00 0.00 C ATOM 291 C LYS A 89 3.415 -6.254 2.866 1.00 0.00 C ATOM 292 O LYS A 89 4.503 -5.726 3.089 1.00 0.00 O ATOM 293 CB LYS A 89 2.240 -7.585 4.672 1.00 0.00 C ATOM 294 CG LYS A 89 3.608 -8.175 5.069 1.00 0.00 C ATOM 295 CD LYS A 89 3.470 -9.545 5.732 1.00 0.00 C ATOM 296 CE LYS A 89 2.841 -9.451 7.126 1.00 0.00 C ATOM 297 NZ LYS A 89 2.613 -10.792 7.687 1.00 0.00 N ATOM 0 H LYS A 89 0.302 -6.507 3.691 1.00 0.00 H new ATOM 0 HA LYS A 89 2.660 -5.472 4.680 1.00 0.00 H new ATOM 0 HB2 LYS A 89 1.628 -7.469 5.567 1.00 0.00 H new ATOM 0 HB3 LYS A 89 1.722 -8.290 4.021 1.00 0.00 H new ATOM 0 HG2 LYS A 89 4.236 -8.263 4.182 1.00 0.00 H new ATOM 0 HG3 LYS A 89 4.113 -7.491 5.751 1.00 0.00 H new ATOM 0 HD2 LYS A 89 2.859 -10.192 5.102 1.00 0.00 H new ATOM 0 HD3 LYS A 89 4.453 -10.010 5.809 1.00 0.00 H new ATOM 0 HE2 LYS A 89 3.494 -8.881 7.787 1.00 0.00 H new ATOM 0 HE3 LYS A 89 1.896 -8.910 7.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 2.186 -10.705 8.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 1.972 -11.324 7.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 3.520 -11.296 7.762 1.00 0.00 H new ATOM 311 N GLN A 90 3.119 -6.888 1.728 1.00 0.00 N ATOM 312 CA GLN A 90 4.016 -7.007 0.600 1.00 0.00 C ATOM 313 C GLN A 90 4.598 -5.640 0.239 1.00 0.00 C ATOM 314 O GLN A 90 5.817 -5.467 0.247 1.00 0.00 O ATOM 315 CB GLN A 90 3.238 -7.684 -0.547 1.00 0.00 C ATOM 316 CG GLN A 90 4.054 -8.749 -1.277 1.00 0.00 C ATOM 317 CD GLN A 90 4.769 -8.190 -2.505 1.00 0.00 C ATOM 318 OE1 GLN A 90 5.505 -7.210 -2.420 1.00 0.00 O ATOM 319 NE2 GLN A 90 4.525 -8.746 -3.683 1.00 0.00 N ATOM 0 H GLN A 90 2.219 -7.342 1.572 1.00 0.00 H new ATOM 0 HA GLN A 90 4.879 -7.631 0.832 1.00 0.00 H new ATOM 0 HB2 GLN A 90 2.333 -8.140 -0.145 1.00 0.00 H new ATOM 0 HB3 GLN A 90 2.921 -6.924 -1.261 1.00 0.00 H new ATOM 0 HG2 GLN A 90 4.789 -9.173 -0.593 1.00 0.00 H new ATOM 0 HG3 GLN A 90 3.396 -9.563 -1.582 1.00 0.00 H new ATOM 0 HE21 GLN A 90 3.913 -9.559 -3.746 1.00 0.00 H new ATOM 0 HE22 GLN A 90 4.949 -8.360 -4.527 1.00 0.00 H new ATOM 328 N ILE A 91 3.728 -4.660 0.003 1.00 0.00 N ATOM 329 CA ILE A 91 4.106 -3.301 -0.361 1.00 0.00 C ATOM 330 C ILE A 91 4.865 -2.630 0.807 1.00 0.00 C ATOM 331 O ILE A 91 5.881 -1.975 0.561 1.00 0.00 O ATOM 332 CB ILE A 91 2.852 -2.506 -0.804 1.00 0.00 C ATOM 333 CG1 ILE A 91 1.923 -3.238 -1.807 1.00 0.00 C ATOM 334 CG2 ILE A 91 3.278 -1.163 -1.436 1.00 0.00 C ATOM 335 CD1 ILE A 91 0.517 -2.628 -1.843 1.00 0.00 C ATOM 0 H ILE A 91 2.719 -4.794 0.062 1.00 0.00 H new ATOM 0 HA ILE A 91 4.789 -3.318 -1.211 1.00 0.00 H new ATOM 0 HB ILE A 91 2.275 -2.369 0.110 1.00 0.00 H new ATOM 0 HG12 ILE A 91 2.362 -3.195 -2.804 1.00 0.00 H new ATOM 0 HG13 ILE A 91 1.854 -4.291 -1.534 1.00 0.00 H new ATOM 0 HG21 ILE A 91 2.392 -0.609 -1.745 1.00 0.00 H new ATOM 0 HG22 ILE A 91 3.835 -0.577 -0.705 1.00 0.00 H new ATOM 0 HG23 ILE A 91 3.908 -1.353 -2.305 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -0.098 -3.173 -2.559 1.00 0.00 H new ATOM 0 HD12 ILE A 91 0.066 -2.695 -0.853 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.582 -1.582 -2.143 1.00 0.00 H new ATOM 347 N LYS A 92 4.443 -2.821 2.075 1.00 0.00 N ATOM 348 CA LYS A 92 5.117 -2.215 3.236 1.00 0.00 C ATOM 349 C LYS A 92 6.596 -2.569 3.230 1.00 0.00 C ATOM 350 O LYS A 92 7.449 -1.686 3.174 1.00 0.00 O ATOM 351 CB LYS A 92 4.514 -2.610 4.608 1.00 0.00 C ATOM 352 CG LYS A 92 3.018 -2.334 4.748 1.00 0.00 C ATOM 353 CD LYS A 92 2.577 -2.023 6.182 1.00 0.00 C ATOM 354 CE LYS A 92 1.082 -1.677 6.170 1.00 0.00 C ATOM 355 NZ LYS A 92 0.648 -1.045 7.429 1.00 0.00 N ATOM 0 H LYS A 92 3.635 -3.393 2.318 1.00 0.00 H new ATOM 0 HA LYS A 92 4.967 -1.141 3.125 1.00 0.00 H new ATOM 0 HB2 LYS A 92 4.691 -3.672 4.776 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.045 -2.070 5.392 1.00 0.00 H new ATOM 0 HG2 LYS A 92 2.751 -1.494 4.106 1.00 0.00 H new ATOM 0 HG3 LYS A 92 2.463 -3.200 4.387 1.00 0.00 H new ATOM 0 HD2 LYS A 92 2.762 -2.881 6.829 1.00 0.00 H new ATOM 0 HD3 LYS A 92 3.155 -1.190 6.583 1.00 0.00 H new ATOM 0 HE2 LYS A 92 0.873 -1.006 5.337 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.502 -2.584 6.002 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -0.368 -0.829 7.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 0.823 -1.695 8.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 1.182 -0.165 7.578 1.00 0.00 H new ATOM 1028 N SER B 160 3.345 9.659 -1.638 1.00 0.00 N ATOM 1029 CA SER B 160 4.487 8.766 -1.632 1.00 0.00 C ATOM 1030 C SER B 160 4.089 7.456 -2.311 1.00 0.00 C ATOM 1031 O SER B 160 2.925 7.048 -2.271 1.00 0.00 O ATOM 1032 CB SER B 160 4.938 8.539 -0.189 1.00 0.00 C ATOM 1033 OG SER B 160 5.220 9.777 0.433 1.00 0.00 O ATOM 0 HA SER B 160 5.323 9.198 -2.182 1.00 0.00 H new ATOM 0 HB2 SER B 160 4.160 8.014 0.365 1.00 0.00 H new ATOM 0 HB3 SER B 160 5.824 7.905 -0.172 1.00 0.00 H new ATOM 0 HG SER B 160 4.678 10.482 0.020 1.00 0.00 H new ATOM 1039 N ALA B 161 5.074 6.768 -2.893 1.00 0.00 N ATOM 1040 CA ALA B 161 4.860 5.508 -3.599 1.00 0.00 C ATOM 1041 C ALA B 161 4.143 4.448 -2.763 1.00 0.00 C ATOM 1042 O ALA B 161 3.417 3.633 -3.335 1.00 0.00 O ATOM 1043 CB ALA B 161 6.215 4.984 -4.068 1.00 0.00 C ATOM 0 H ALA B 161 6.047 7.073 -2.886 1.00 0.00 H new ATOM 0 HA ALA B 161 4.201 5.711 -4.443 1.00 0.00 H new ATOM 0 HB1 ALA B 161 6.077 4.042 -4.599 1.00 0.00 H new ATOM 0 HB2 ALA B 161 6.676 5.712 -4.736 1.00 0.00 H new ATOM 0 HB3 ALA B 161 6.861 4.823 -3.205 1.00 0.00 H new ATOM 1049 N PHE B 162 4.353 4.473 -1.443 1.00 0.00 N ATOM 1050 CA PHE B 162 3.740 3.555 -0.505 1.00 0.00 C ATOM 1051 C PHE B 162 2.227 3.744 -0.566 1.00 0.00 C ATOM 1052 O PHE B 162 1.507 2.848 -0.997 1.00 0.00 O ATOM 1053 CB PHE B 162 4.306 3.816 0.907 1.00 0.00 C ATOM 1054 CG PHE B 162 3.879 2.867 2.021 1.00 0.00 C ATOM 1055 CD1 PHE B 162 2.519 2.604 2.303 1.00 0.00 C ATOM 1056 CD2 PHE B 162 4.871 2.266 2.824 1.00 0.00 C ATOM 1057 CE1 PHE B 162 2.165 1.737 3.349 1.00 0.00 C ATOM 1058 CE2 PHE B 162 4.510 1.418 3.885 1.00 0.00 C ATOM 1059 CZ PHE B 162 3.154 1.156 4.146 1.00 0.00 C ATOM 0 H PHE B 162 4.970 5.152 -0.997 1.00 0.00 H new ATOM 0 HA PHE B 162 3.965 2.519 -0.759 1.00 0.00 H new ATOM 0 HB2 PHE B 162 5.394 3.793 0.843 1.00 0.00 H new ATOM 0 HB3 PHE B 162 4.026 4.828 1.200 1.00 0.00 H new ATOM 0 HD1 PHE B 162 1.748 3.073 1.710 1.00 0.00 H new ATOM 0 HD2 PHE B 162 5.914 2.459 2.622 1.00 0.00 H new ATOM 0 HE1 PHE B 162 1.124 1.519 3.538 1.00 0.00 H new ATOM 0 HE2 PHE B 162 5.275 0.967 4.500 1.00 0.00 H new ATOM 0 HZ PHE B 162 2.877 0.506 4.963 1.00 0.00 H new ATOM 1069 N ASP B 163 1.733 4.901 -0.119 1.00 0.00 N ATOM 1070 CA ASP B 163 0.306 5.210 -0.084 1.00 0.00 C ATOM 1071 C ASP B 163 -0.316 5.178 -1.476 1.00 0.00 C ATOM 1072 O ASP B 163 -1.467 4.765 -1.607 1.00 0.00 O ATOM 1073 CB ASP B 163 0.016 6.516 0.666 1.00 0.00 C ATOM 1074 CG ASP B 163 0.269 6.375 2.171 1.00 0.00 C ATOM 1075 OD1 ASP B 163 -0.486 5.638 2.848 1.00 0.00 O ATOM 1076 OD2 ASP B 163 1.229 6.978 2.693 1.00 0.00 O ATOM 0 H ASP B 163 2.321 5.657 0.232 1.00 0.00 H new ATOM 0 HA ASP B 163 -0.180 4.419 0.488 1.00 0.00 H new ATOM 0 HB2 ASP B 163 0.643 7.313 0.265 1.00 0.00 H new ATOM 0 HB3 ASP B 163 -1.020 6.810 0.497 1.00 0.00 H new ATOM 1081 N LEU B 164 0.442 5.529 -2.525 1.00 0.00 N ATOM 1082 CA LEU B 164 -0.059 5.506 -3.897 1.00 0.00 C ATOM 1083 C LEU B 164 -0.573 4.110 -4.233 1.00 0.00 C ATOM 1084 O LEU B 164 -1.632 3.946 -4.847 1.00 0.00 O ATOM 1085 CB LEU B 164 1.074 5.844 -4.887 1.00 0.00 C ATOM 1086 CG LEU B 164 0.622 5.761 -6.356 1.00 0.00 C ATOM 1087 CD1 LEU B 164 -0.447 6.801 -6.704 1.00 0.00 C ATOM 1088 CD2 LEU B 164 1.814 5.923 -7.286 1.00 0.00 C ATOM 0 H LEU B 164 1.412 5.834 -2.442 1.00 0.00 H new ATOM 0 HA LEU B 164 -0.859 6.241 -3.980 1.00 0.00 H new ATOM 0 HB2 LEU B 164 1.444 6.848 -4.681 1.00 0.00 H new ATOM 0 HB3 LEU B 164 1.907 5.159 -4.728 1.00 0.00 H new ATOM 0 HG LEU B 164 0.176 4.776 -6.492 1.00 0.00 H new ATOM 0 HD11 LEU B 164 -0.729 6.697 -7.752 1.00 0.00 H new ATOM 0 HD12 LEU B 164 -1.324 6.646 -6.075 1.00 0.00 H new ATOM 0 HD13 LEU B 164 -0.050 7.802 -6.533 1.00 0.00 H new ATOM 0 HD21 LEU B 164 1.479 5.862 -8.321 1.00 0.00 H new ATOM 0 HD22 LEU B 164 2.282 6.892 -7.113 1.00 0.00 H new ATOM 0 HD23 LEU B 164 2.537 5.131 -7.092 1.00 0.00 H new ATOM 1100 N ASP B 165 0.226 3.106 -3.881 1.00 0.00 N ATOM 1101 CA ASP B 165 -0.103 1.725 -4.142 1.00 0.00 C ATOM 1102 C ASP B 165 -1.153 1.212 -3.168 1.00 0.00 C ATOM 1103 O ASP B 165 -1.979 0.398 -3.561 1.00 0.00 O ATOM 1104 CB ASP B 165 1.165 0.887 -4.131 1.00 0.00 C ATOM 1105 CG ASP B 165 0.968 -0.447 -4.862 1.00 0.00 C ATOM 1106 OD1 ASP B 165 0.103 -0.571 -5.758 1.00 0.00 O ATOM 1107 OD2 ASP B 165 1.812 -1.346 -4.654 1.00 0.00 O ATOM 0 H ASP B 165 1.119 3.237 -3.406 1.00 0.00 H new ATOM 0 HA ASP B 165 -0.548 1.643 -5.134 1.00 0.00 H new ATOM 0 HB2 ASP B 165 1.974 1.445 -4.603 1.00 0.00 H new ATOM 0 HB3 ASP B 165 1.467 0.697 -3.101 1.00 0.00 H new ATOM 1112 N VAL B 166 -1.177 1.679 -1.912 1.00 0.00 N ATOM 1113 CA VAL B 166 -2.192 1.262 -0.937 1.00 0.00 C ATOM 1114 C VAL B 166 -3.557 1.635 -1.527 1.00 0.00 C ATOM 1115 O VAL B 166 -4.494 0.834 -1.492 1.00 0.00 O ATOM 1116 CB VAL B 166 -1.943 1.952 0.419 1.00 0.00 C ATOM 1117 CG1 VAL B 166 -3.128 1.866 1.386 1.00 0.00 C ATOM 1118 CG2 VAL B 166 -0.718 1.358 1.122 1.00 0.00 C ATOM 0 H VAL B 166 -0.501 2.349 -1.547 1.00 0.00 H new ATOM 0 HA VAL B 166 -2.151 0.189 -0.750 1.00 0.00 H new ATOM 0 HB VAL B 166 -1.783 3.001 0.171 1.00 0.00 H new ATOM 0 HG11 VAL B 166 -2.876 2.374 2.317 1.00 0.00 H new ATOM 0 HG12 VAL B 166 -3.999 2.343 0.937 1.00 0.00 H new ATOM 0 HG13 VAL B 166 -3.353 0.820 1.593 1.00 0.00 H new ATOM 0 HG21 VAL B 166 -0.565 1.863 2.076 1.00 0.00 H new ATOM 0 HG22 VAL B 166 -0.879 0.294 1.296 1.00 0.00 H new ATOM 0 HG23 VAL B 166 0.163 1.494 0.495 1.00 0.00 H new ATOM 1128 N VAL B 167 -3.666 2.838 -2.089 1.00 0.00 N ATOM 1129 CA VAL B 167 -4.853 3.376 -2.727 1.00 0.00 C ATOM 1130 C VAL B 167 -5.207 2.450 -3.902 1.00 0.00 C ATOM 1131 O VAL B 167 -6.341 1.966 -3.971 1.00 0.00 O ATOM 1132 CB VAL B 167 -4.541 4.857 -3.062 1.00 0.00 C ATOM 1133 CG1 VAL B 167 -5.512 5.527 -4.029 1.00 0.00 C ATOM 1134 CG2 VAL B 167 -4.519 5.702 -1.777 1.00 0.00 C ATOM 0 H VAL B 167 -2.884 3.493 -2.109 1.00 0.00 H new ATOM 0 HA VAL B 167 -5.752 3.396 -2.111 1.00 0.00 H new ATOM 0 HB VAL B 167 -3.569 4.818 -3.555 1.00 0.00 H new ATOM 0 HG11 VAL B 167 -5.205 6.559 -4.196 1.00 0.00 H new ATOM 0 HG12 VAL B 167 -5.510 4.989 -4.977 1.00 0.00 H new ATOM 0 HG13 VAL B 167 -6.516 5.512 -3.605 1.00 0.00 H new ATOM 0 HG21 VAL B 167 -4.299 6.740 -2.028 1.00 0.00 H new ATOM 0 HG22 VAL B 167 -5.491 5.645 -1.288 1.00 0.00 H new ATOM 0 HG23 VAL B 167 -3.751 5.321 -1.104 1.00 0.00 H new ATOM 1144 N LYS B 168 -4.268 2.143 -4.807 1.00 0.00 N ATOM 1145 CA LYS B 168 -4.509 1.262 -5.963 1.00 0.00 C ATOM 1146 C LYS B 168 -4.906 -0.161 -5.541 1.00 0.00 C ATOM 1147 O LYS B 168 -5.728 -0.786 -6.218 1.00 0.00 O ATOM 1148 CB LYS B 168 -3.257 1.230 -6.856 1.00 0.00 C ATOM 1149 CG LYS B 168 -3.052 2.539 -7.643 1.00 0.00 C ATOM 1150 CD LYS B 168 -1.595 2.756 -8.097 1.00 0.00 C ATOM 1151 CE LYS B 168 -1.445 2.476 -9.595 1.00 0.00 C ATOM 1152 NZ LYS B 168 -0.041 2.527 -10.048 1.00 0.00 N ATOM 0 H LYS B 168 -3.314 2.500 -4.759 1.00 0.00 H new ATOM 0 HA LYS B 168 -5.350 1.670 -6.523 1.00 0.00 H new ATOM 0 HB2 LYS B 168 -2.380 1.042 -6.237 1.00 0.00 H new ATOM 0 HB3 LYS B 168 -3.337 0.399 -7.557 1.00 0.00 H new ATOM 0 HG2 LYS B 168 -3.701 2.534 -8.519 1.00 0.00 H new ATOM 0 HG3 LYS B 168 -3.361 3.380 -7.022 1.00 0.00 H new ATOM 0 HD2 LYS B 168 -1.291 3.780 -7.882 1.00 0.00 H new ATOM 0 HD3 LYS B 168 -0.932 2.101 -7.532 1.00 0.00 H new ATOM 0 HE2 LYS B 168 -1.859 1.493 -9.820 1.00 0.00 H new ATOM 0 HE3 LYS B 168 -2.030 3.204 -10.157 1.00 0.00 H new ATOM 0 HZ1 LYS B 168 0.002 2.330 -11.068 1.00 0.00 H new ATOM 0 HZ2 LYS B 168 0.350 3.472 -9.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 168 0.516 1.814 -9.534 1.00 0.00 H new ATOM 1166 N LEU B 169 -4.332 -0.689 -4.459 1.00 0.00 N ATOM 1167 CA LEU B 169 -4.589 -2.013 -3.901 1.00 0.00 C ATOM 1168 C LEU B 169 -6.031 -2.043 -3.400 1.00 0.00 C ATOM 1169 O LEU B 169 -6.849 -2.829 -3.887 1.00 0.00 O ATOM 1170 CB LEU B 169 -3.575 -2.283 -2.765 1.00 0.00 C ATOM 1171 CG LEU B 169 -3.466 -3.713 -2.195 1.00 0.00 C ATOM 1172 CD1 LEU B 169 -3.053 -3.623 -0.720 1.00 0.00 C ATOM 1173 CD2 LEU B 169 -4.720 -4.583 -2.280 1.00 0.00 C ATOM 0 H LEU B 169 -3.636 -0.173 -3.920 1.00 0.00 H new ATOM 0 HA LEU B 169 -4.465 -2.796 -4.649 1.00 0.00 H new ATOM 0 HB2 LEU B 169 -2.588 -1.995 -3.127 1.00 0.00 H new ATOM 0 HB3 LEU B 169 -3.818 -1.615 -1.939 1.00 0.00 H new ATOM 0 HG LEU B 169 -2.730 -4.206 -2.830 1.00 0.00 H new ATOM 0 HD11 LEU B 169 -2.972 -4.627 -0.303 1.00 0.00 H new ATOM 0 HD12 LEU B 169 -2.090 -3.119 -0.642 1.00 0.00 H new ATOM 0 HD13 LEU B 169 -3.804 -3.059 -0.166 1.00 0.00 H new ATOM 0 HD21 LEU B 169 -4.514 -5.562 -1.847 1.00 0.00 H new ATOM 0 HD22 LEU B 169 -5.531 -4.106 -1.730 1.00 0.00 H new ATOM 0 HD23 LEU B 169 -5.010 -4.702 -3.324 1.00 0.00 H new ATOM 1185 N THR B 170 -6.336 -1.164 -2.447 1.00 0.00 N ATOM 1186 CA THR B 170 -7.644 -1.044 -1.828 1.00 0.00 C ATOM 1187 C THR B 170 -8.730 -0.874 -2.881 1.00 0.00 C ATOM 1188 O THR B 170 -9.749 -1.550 -2.780 1.00 0.00 O ATOM 1189 CB THR B 170 -7.631 0.100 -0.798 1.00 0.00 C ATOM 1190 OG1 THR B 170 -6.512 -0.002 0.060 1.00 0.00 O ATOM 1191 CG2 THR B 170 -8.884 0.090 0.080 1.00 0.00 C ATOM 0 H THR B 170 -5.657 -0.499 -2.077 1.00 0.00 H new ATOM 0 HA THR B 170 -7.877 -1.964 -1.293 1.00 0.00 H new ATOM 0 HB THR B 170 -7.591 1.025 -1.374 1.00 0.00 H new ATOM 0 HG1 THR B 170 -5.781 0.550 -0.289 1.00 0.00 H new ATOM 0 HG21 THR B 170 -8.835 0.913 0.793 1.00 0.00 H new ATOM 0 HG22 THR B 170 -9.768 0.205 -0.547 1.00 0.00 H new ATOM 0 HG23 THR B 170 -8.942 -0.855 0.620 1.00 0.00 H new ATOM 1199 N ALA B 171 -8.519 -0.003 -3.877 1.00 0.00 N ATOM 1200 CA ALA B 171 -9.492 0.238 -4.932 1.00 0.00 C ATOM 1201 C ALA B 171 -9.823 -1.038 -5.713 1.00 0.00 C ATOM 1202 O ALA B 171 -10.974 -1.247 -6.090 1.00 0.00 O ATOM 1203 CB ALA B 171 -9.013 1.347 -5.852 1.00 0.00 C ATOM 0 H ALA B 171 -7.667 0.550 -3.967 1.00 0.00 H new ATOM 0 HA ALA B 171 -10.420 0.562 -4.460 1.00 0.00 H new ATOM 0 HB1 ALA B 171 -9.752 1.515 -6.635 1.00 0.00 H new ATOM 0 HB2 ALA B 171 -8.879 2.264 -5.278 1.00 0.00 H new ATOM 0 HB3 ALA B 171 -8.064 1.060 -6.304 1.00 0.00 H new ATOM 1209 N GLN B 172 -8.839 -1.898 -5.989 1.00 0.00 N ATOM 1210 CA GLN B 172 -9.112 -3.141 -6.705 1.00 0.00 C ATOM 1211 C GLN B 172 -10.003 -4.020 -5.819 1.00 0.00 C ATOM 1212 O GLN B 172 -10.988 -4.565 -6.310 1.00 0.00 O ATOM 1213 CB GLN B 172 -7.809 -3.884 -7.075 1.00 0.00 C ATOM 1214 CG GLN B 172 -7.637 -4.012 -8.602 1.00 0.00 C ATOM 1215 CD GLN B 172 -6.863 -5.275 -8.974 1.00 0.00 C ATOM 1216 OE1 GLN B 172 -7.315 -6.091 -9.765 1.00 0.00 O ATOM 1217 NE2 GLN B 172 -5.696 -5.496 -8.403 1.00 0.00 N ATOM 0 H GLN B 172 -7.862 -1.758 -5.731 1.00 0.00 H new ATOM 0 HA GLN B 172 -9.620 -2.912 -7.642 1.00 0.00 H new ATOM 0 HB2 GLN B 172 -6.955 -3.351 -6.656 1.00 0.00 H new ATOM 0 HB3 GLN B 172 -7.817 -4.877 -6.626 1.00 0.00 H new ATOM 0 HG2 GLN B 172 -8.617 -4.031 -9.079 1.00 0.00 H new ATOM 0 HG3 GLN B 172 -7.113 -3.137 -8.985 1.00 0.00 H new ATOM 0 HE21 GLN B 172 -5.315 -4.818 -7.743 1.00 0.00 H new ATOM 0 HE22 GLN B 172 -5.174 -6.345 -8.621 1.00 0.00 H new ATOM 1226 N PHE B 173 -9.654 -4.161 -4.533 1.00 0.00 N ATOM 1227 CA PHE B 173 -10.428 -4.961 -3.594 1.00 0.00 C ATOM 1228 C PHE B 173 -11.863 -4.449 -3.519 1.00 0.00 C ATOM 1229 O PHE B 173 -12.758 -5.227 -3.804 1.00 0.00 O ATOM 1230 CB PHE B 173 -9.737 -5.020 -2.224 1.00 0.00 C ATOM 1231 CG PHE B 173 -8.790 -6.200 -2.107 1.00 0.00 C ATOM 1232 CD1 PHE B 173 -7.586 -6.214 -2.837 1.00 0.00 C ATOM 1233 CD2 PHE B 173 -9.137 -7.313 -1.316 1.00 0.00 C ATOM 1234 CE1 PHE B 173 -6.732 -7.328 -2.775 1.00 0.00 C ATOM 1235 CE2 PHE B 173 -8.279 -8.425 -1.251 1.00 0.00 C ATOM 1236 CZ PHE B 173 -7.079 -8.433 -1.982 1.00 0.00 C ATOM 0 H PHE B 173 -8.829 -3.723 -4.123 1.00 0.00 H new ATOM 0 HA PHE B 173 -10.478 -5.989 -3.954 1.00 0.00 H new ATOM 0 HB2 PHE B 173 -9.184 -4.095 -2.058 1.00 0.00 H new ATOM 0 HB3 PHE B 173 -10.493 -5.084 -1.441 1.00 0.00 H new ATOM 0 HD1 PHE B 173 -7.318 -5.364 -3.447 1.00 0.00 H new ATOM 0 HD2 PHE B 173 -10.062 -7.312 -0.759 1.00 0.00 H new ATOM 0 HE1 PHE B 173 -5.810 -7.334 -3.337 1.00 0.00 H new ATOM 0 HE2 PHE B 173 -8.543 -9.274 -0.638 1.00 0.00 H new ATOM 0 HZ PHE B 173 -6.423 -9.290 -1.934 1.00 0.00 H new ATOM 1246 N VAL B 174 -12.118 -3.176 -3.222 1.00 0.00 N ATOM 1247 CA VAL B 174 -13.486 -2.663 -3.125 1.00 0.00 C ATOM 1248 C VAL B 174 -14.295 -2.860 -4.414 1.00 0.00 C ATOM 1249 O VAL B 174 -15.511 -2.930 -4.343 1.00 0.00 O ATOM 1250 CB VAL B 174 -13.478 -1.192 -2.680 1.00 0.00 C ATOM 1251 CG1 VAL B 174 -12.820 -1.029 -1.303 1.00 0.00 C ATOM 1252 CG2 VAL B 174 -12.776 -0.300 -3.669 1.00 0.00 C ATOM 0 H VAL B 174 -11.395 -2.479 -3.044 1.00 0.00 H new ATOM 0 HA VAL B 174 -13.995 -3.254 -2.363 1.00 0.00 H new ATOM 0 HB VAL B 174 -14.523 -0.888 -2.622 1.00 0.00 H new ATOM 0 HG11 VAL B 174 -12.830 0.023 -1.017 1.00 0.00 H new ATOM 0 HG12 VAL B 174 -13.372 -1.611 -0.565 1.00 0.00 H new ATOM 0 HG13 VAL B 174 -11.790 -1.383 -1.348 1.00 0.00 H new ATOM 0 HG21 VAL B 174 -12.797 0.729 -3.310 1.00 0.00 H new ATOM 0 HG22 VAL B 174 -11.741 -0.624 -3.781 1.00 0.00 H new ATOM 0 HG23 VAL B 174 -13.281 -0.358 -4.633 1.00 0.00 H new ATOM 1262 N ALA B 175 -13.673 -2.953 -5.584 1.00 0.00 N ATOM 1263 CA ALA B 175 -14.342 -3.168 -6.855 1.00 0.00 C ATOM 1264 C ALA B 175 -14.608 -4.660 -7.098 1.00 0.00 C ATOM 1265 O ALA B 175 -15.632 -5.024 -7.670 1.00 0.00 O ATOM 1266 CB ALA B 175 -13.461 -2.616 -7.967 1.00 0.00 C ATOM 0 H ALA B 175 -12.660 -2.878 -5.673 1.00 0.00 H new ATOM 0 HA ALA B 175 -15.304 -2.656 -6.840 1.00 0.00 H new ATOM 0 HB1 ALA B 175 -13.950 -2.770 -8.929 1.00 0.00 H new ATOM 0 HB2 ALA B 175 -13.300 -1.550 -7.808 1.00 0.00 H new ATOM 0 HB3 ALA B 175 -12.501 -3.133 -7.961 1.00 0.00 H new ATOM 1272 N ARG B 176 -13.667 -5.521 -6.703 1.00 0.00 N ATOM 1273 CA ARG B 176 -13.728 -6.977 -6.852 1.00 0.00 C ATOM 1274 C ARG B 176 -14.652 -7.579 -5.794 1.00 0.00 C ATOM 1275 O ARG B 176 -15.354 -8.550 -6.062 1.00 0.00 O ATOM 1276 CB ARG B 176 -12.291 -7.499 -6.689 1.00 0.00 C ATOM 1277 CG ARG B 176 -12.066 -8.978 -7.038 1.00 0.00 C ATOM 1278 CD ARG B 176 -10.620 -9.326 -6.653 1.00 0.00 C ATOM 1279 NE ARG B 176 -10.161 -10.621 -7.189 1.00 0.00 N ATOM 1280 CZ ARG B 176 -9.167 -10.804 -8.071 1.00 0.00 C ATOM 1281 NH1 ARG B 176 -8.626 -9.773 -8.707 1.00 0.00 N ATOM 1282 NH2 ARG B 176 -8.719 -12.031 -8.320 1.00 0.00 N ATOM 0 H ARG B 176 -12.807 -5.210 -6.252 1.00 0.00 H new ATOM 0 HA ARG B 176 -14.130 -7.259 -7.825 1.00 0.00 H new ATOM 0 HB2 ARG B 176 -11.634 -6.895 -7.314 1.00 0.00 H new ATOM 0 HB3 ARG B 176 -11.983 -7.340 -5.656 1.00 0.00 H new ATOM 0 HG2 ARG B 176 -12.770 -9.611 -6.498 1.00 0.00 H new ATOM 0 HG3 ARG B 176 -12.232 -9.151 -8.101 1.00 0.00 H new ATOM 0 HD2 ARG B 176 -9.958 -8.538 -7.012 1.00 0.00 H new ATOM 0 HD3 ARG B 176 -10.536 -9.342 -5.566 1.00 0.00 H new ATOM 0 HE ARG B 176 -10.645 -11.456 -6.858 1.00 0.00 H new ATOM 0 HH11 ARG B 176 -8.965 -8.828 -8.528 1.00 0.00 H new ATOM 0 HH12 ARG B 176 -7.871 -9.925 -9.375 1.00 0.00 H new ATOM 0 HH21 ARG B 176 -9.131 -12.831 -7.841 1.00 0.00 H new ATOM 0 HH22 ARG B 176 -7.963 -12.172 -8.990 1.00 0.00 H new ATOM 1296 N ASN B 177 -14.621 -7.021 -4.589 1.00 0.00 N ATOM 1297 CA ASN B 177 -15.394 -7.414 -3.424 1.00 0.00 C ATOM 1298 C ASN B 177 -16.779 -6.795 -3.571 1.00 0.00 C ATOM 1299 O ASN B 177 -17.773 -7.488 -3.808 1.00 0.00 O ATOM 1300 CB ASN B 177 -14.718 -6.961 -2.103 1.00 0.00 C ATOM 1301 CG ASN B 177 -13.285 -7.437 -1.880 1.00 0.00 C ATOM 1302 OD1 ASN B 177 -12.489 -6.750 -1.257 1.00 0.00 O ATOM 1303 ND2 ASN B 177 -12.891 -8.591 -2.384 1.00 0.00 N ATOM 0 H ASN B 177 -14.012 -6.227 -4.390 1.00 0.00 H new ATOM 0 HA ASN B 177 -15.460 -8.501 -3.371 1.00 0.00 H new ATOM 0 HB2 ASN B 177 -14.726 -5.872 -2.071 1.00 0.00 H new ATOM 0 HB3 ASN B 177 -15.328 -7.309 -1.269 1.00 0.00 H new ATOM 0 HD21 ASN B 177 -11.929 -8.903 -2.252 1.00 0.00 H new ATOM 0 HD22 ASN B 177 -13.549 -9.171 -2.905 1.00 0.00 H new ATOM 1310 N GLY B 178 -16.823 -5.467 -3.474 1.00 0.00 N ATOM 1311 CA GLY B 178 -17.991 -4.611 -3.568 1.00 0.00 C ATOM 1312 C GLY B 178 -17.888 -3.495 -2.527 1.00 0.00 C ATOM 1313 O GLY B 178 -17.044 -3.550 -1.625 1.00 0.00 O ATOM 0 H GLY B 178 -15.973 -4.926 -3.315 1.00 0.00 H new ATOM 0 HA2 GLY B 178 -18.063 -4.185 -4.569 1.00 0.00 H new ATOM 0 HA3 GLY B 178 -18.897 -5.194 -3.404 1.00 0.00 H new ATOM 1317 N ARG B 179 -18.797 -2.518 -2.606 1.00 0.00 N ATOM 1318 CA ARG B 179 -18.878 -1.349 -1.720 1.00 0.00 C ATOM 1319 C ARG B 179 -18.800 -1.721 -0.254 1.00 0.00 C ATOM 1320 O ARG B 179 -18.190 -0.976 0.508 1.00 0.00 O ATOM 1321 CB ARG B 179 -20.194 -0.607 -1.994 1.00 0.00 C ATOM 1322 CG ARG B 179 -20.535 0.555 -1.048 1.00 0.00 C ATOM 1323 CD ARG B 179 -19.460 1.627 -0.971 1.00 0.00 C ATOM 1324 NE ARG B 179 -19.909 2.798 -0.213 1.00 0.00 N ATOM 1325 CZ ARG B 179 -19.431 4.034 -0.366 1.00 0.00 C ATOM 1326 NH1 ARG B 179 -18.567 4.306 -1.342 1.00 0.00 N ATOM 1327 NH2 ARG B 179 -19.798 4.986 0.482 1.00 0.00 N ATOM 0 H ARG B 179 -19.527 -2.519 -3.318 1.00 0.00 H new ATOM 0 HA ARG B 179 -18.020 -0.711 -1.933 1.00 0.00 H new ATOM 0 HB2 ARG B 179 -20.162 -0.220 -3.012 1.00 0.00 H new ATOM 0 HB3 ARG B 179 -21.008 -1.330 -1.954 1.00 0.00 H new ATOM 0 HG2 ARG B 179 -21.468 1.014 -1.375 1.00 0.00 H new ATOM 0 HG3 ARG B 179 -20.709 0.157 -0.048 1.00 0.00 H new ATOM 0 HD2 ARG B 179 -18.567 1.213 -0.503 1.00 0.00 H new ATOM 0 HD3 ARG B 179 -19.179 1.933 -1.979 1.00 0.00 H new ATOM 0 HE ARG B 179 -20.641 2.658 0.483 1.00 0.00 H new ATOM 0 HH11 ARG B 179 -18.267 3.567 -1.978 1.00 0.00 H new ATOM 0 HH12 ARG B 179 -18.205 5.253 -1.454 1.00 0.00 H new ATOM 0 HH21 ARG B 179 -20.441 4.770 1.244 1.00 0.00 H new ATOM 0 HH22 ARG B 179 -19.437 5.934 0.372 1.00 0.00 H new ATOM 1341 N GLN B 180 -19.407 -2.843 0.130 1.00 0.00 N ATOM 1342 CA GLN B 180 -19.414 -3.308 1.503 1.00 0.00 C ATOM 1343 C GLN B 180 -17.999 -3.280 2.081 1.00 0.00 C ATOM 1344 O GLN B 180 -17.794 -2.617 3.088 1.00 0.00 O ATOM 1345 CB GLN B 180 -20.073 -4.696 1.565 1.00 0.00 C ATOM 1346 CG GLN B 180 -20.564 -5.089 2.965 1.00 0.00 C ATOM 1347 CD GLN B 180 -21.772 -4.277 3.443 1.00 0.00 C ATOM 1348 OE1 GLN B 180 -22.191 -3.298 2.825 1.00 0.00 O ATOM 1349 NE2 GLN B 180 -22.351 -4.661 4.559 1.00 0.00 N ATOM 0 H GLN B 180 -19.910 -3.455 -0.513 1.00 0.00 H new ATOM 0 HA GLN B 180 -20.008 -2.641 2.128 1.00 0.00 H new ATOM 0 HB2 GLN B 180 -20.917 -4.718 0.875 1.00 0.00 H new ATOM 0 HB3 GLN B 180 -19.358 -5.443 1.218 1.00 0.00 H new ATOM 0 HG2 GLN B 180 -20.825 -6.147 2.965 1.00 0.00 H new ATOM 0 HG3 GLN B 180 -19.748 -4.962 3.676 1.00 0.00 H new ATOM 0 HE21 GLN B 180 -21.997 -5.473 5.064 1.00 0.00 H new ATOM 0 HE22 GLN B 180 -23.155 -4.147 4.920 1.00 0.00 H new ATOM 1358 N PHE B 181 -17.023 -3.919 1.429 1.00 0.00 N ATOM 1359 CA PHE B 181 -15.635 -3.965 1.880 1.00 0.00 C ATOM 1360 C PHE B 181 -15.095 -2.565 2.182 1.00 0.00 C ATOM 1361 O PHE B 181 -14.365 -2.384 3.157 1.00 0.00 O ATOM 1362 CB PHE B 181 -14.795 -4.672 0.810 1.00 0.00 C ATOM 1363 CG PHE B 181 -13.355 -4.928 1.201 1.00 0.00 C ATOM 1364 CD1 PHE B 181 -13.003 -6.110 1.871 1.00 0.00 C ATOM 1365 CD2 PHE B 181 -12.349 -4.007 0.861 1.00 0.00 C ATOM 1366 CE1 PHE B 181 -11.659 -6.369 2.187 1.00 0.00 C ATOM 1367 CE2 PHE B 181 -11.006 -4.254 1.183 1.00 0.00 C ATOM 1368 CZ PHE B 181 -10.665 -5.438 1.848 1.00 0.00 C ATOM 0 H PHE B 181 -17.181 -4.426 0.558 1.00 0.00 H new ATOM 0 HA PHE B 181 -15.577 -4.524 2.814 1.00 0.00 H new ATOM 0 HB2 PHE B 181 -15.266 -5.625 0.569 1.00 0.00 H new ATOM 0 HB3 PHE B 181 -14.809 -4.071 -0.099 1.00 0.00 H new ATOM 0 HD1 PHE B 181 -13.767 -6.822 2.144 1.00 0.00 H new ATOM 0 HD2 PHE B 181 -12.614 -3.096 0.345 1.00 0.00 H new ATOM 0 HE1 PHE B 181 -11.390 -7.285 2.691 1.00 0.00 H new ATOM 0 HE2 PHE B 181 -10.242 -3.537 0.920 1.00 0.00 H new ATOM 0 HZ PHE B 181 -9.634 -5.635 2.101 1.00 0.00 H new ATOM 1378 N LEU B 182 -15.434 -1.584 1.337 1.00 0.00 N ATOM 1379 CA LEU B 182 -15.010 -0.202 1.502 1.00 0.00 C ATOM 1380 C LEU B 182 -15.611 0.350 2.789 1.00 0.00 C ATOM 1381 O LEU B 182 -14.869 0.780 3.671 1.00 0.00 O ATOM 1382 CB LEU B 182 -15.440 0.648 0.291 1.00 0.00 C ATOM 1383 CG LEU B 182 -14.609 1.931 0.080 1.00 0.00 C ATOM 1384 CD1 LEU B 182 -15.182 2.687 -1.117 1.00 0.00 C ATOM 1385 CD2 LEU B 182 -14.574 2.868 1.281 1.00 0.00 C ATOM 0 H LEU B 182 -16.016 -1.736 0.514 1.00 0.00 H new ATOM 0 HA LEU B 182 -13.923 -0.161 1.564 1.00 0.00 H new ATOM 0 HB2 LEU B 182 -15.373 0.036 -0.608 1.00 0.00 H new ATOM 0 HB3 LEU B 182 -16.487 0.925 0.411 1.00 0.00 H new ATOM 0 HG LEU B 182 -13.580 1.609 -0.083 1.00 0.00 H new ATOM 0 HD11 LEU B 182 -14.606 3.598 -1.281 1.00 0.00 H new ATOM 0 HD12 LEU B 182 -15.127 2.058 -2.005 1.00 0.00 H new ATOM 0 HD13 LEU B 182 -16.222 2.946 -0.920 1.00 0.00 H new ATOM 0 HD21 LEU B 182 -13.968 3.742 1.043 1.00 0.00 H new ATOM 0 HD22 LEU B 182 -15.588 3.185 1.525 1.00 0.00 H new ATOM 0 HD23 LEU B 182 -14.141 2.348 2.136 1.00 0.00 H new ATOM 1397 N THR B 183 -16.940 0.332 2.915 1.00 0.00 N ATOM 1398 CA THR B 183 -17.595 0.858 4.102 1.00 0.00 C ATOM 1399 C THR B 183 -17.076 0.155 5.364 1.00 0.00 C ATOM 1400 O THR B 183 -16.859 0.816 6.383 1.00 0.00 O ATOM 1401 CB THR B 183 -19.114 0.758 3.922 1.00 0.00 C ATOM 1402 OG1 THR B 183 -19.514 1.373 2.707 1.00 0.00 O ATOM 1403 CG2 THR B 183 -19.856 1.450 5.066 1.00 0.00 C ATOM 0 H THR B 183 -17.576 -0.040 2.210 1.00 0.00 H new ATOM 0 HA THR B 183 -17.354 1.913 4.235 1.00 0.00 H new ATOM 0 HB THR B 183 -19.364 -0.303 3.911 1.00 0.00 H new ATOM 0 HG1 THR B 183 -20.486 1.299 2.607 1.00 0.00 H new ATOM 0 HG21 THR B 183 -20.931 1.361 4.909 1.00 0.00 H new ATOM 0 HG22 THR B 183 -19.587 0.979 6.012 1.00 0.00 H new ATOM 0 HG23 THR B 183 -19.579 2.504 5.094 1.00 0.00 H new ATOM 1411 N GLN B 184 -16.828 -1.156 5.308 1.00 0.00 N ATOM 1412 CA GLN B 184 -16.309 -1.902 6.442 1.00 0.00 C ATOM 1413 C GLN B 184 -14.942 -1.335 6.845 1.00 0.00 C ATOM 1414 O GLN B 184 -14.732 -1.098 8.035 1.00 0.00 O ATOM 1415 CB GLN B 184 -16.250 -3.404 6.138 1.00 0.00 C ATOM 1416 CG GLN B 184 -17.643 -4.024 5.960 1.00 0.00 C ATOM 1417 CD GLN B 184 -17.678 -5.478 6.410 1.00 0.00 C ATOM 1418 OE1 GLN B 184 -17.854 -5.762 7.591 1.00 0.00 O ATOM 1419 NE2 GLN B 184 -17.492 -6.421 5.501 1.00 0.00 N ATOM 0 H GLN B 184 -16.983 -1.723 4.474 1.00 0.00 H new ATOM 0 HA GLN B 184 -16.986 -1.788 7.289 1.00 0.00 H new ATOM 0 HB2 GLN B 184 -15.666 -3.565 5.232 1.00 0.00 H new ATOM 0 HB3 GLN B 184 -15.729 -3.915 6.948 1.00 0.00 H new ATOM 0 HG2 GLN B 184 -18.372 -3.449 6.531 1.00 0.00 H new ATOM 0 HG3 GLN B 184 -17.938 -3.961 4.912 1.00 0.00 H new ATOM 0 HE21 GLN B 184 -17.347 -6.166 4.524 1.00 0.00 H new ATOM 0 HE22 GLN B 184 -17.493 -7.403 5.777 1.00 0.00 H new ATOM 1428 N LEU B 185 -14.027 -1.092 5.893 1.00 0.00 N ATOM 1429 CA LEU B 185 -12.709 -0.522 6.190 1.00 0.00 C ATOM 1430 C LEU B 185 -12.871 0.838 6.873 1.00 0.00 C ATOM 1431 O LEU B 185 -12.139 1.141 7.819 1.00 0.00 O ATOM 1432 CB LEU B 185 -11.868 -0.333 4.915 1.00 0.00 C ATOM 1433 CG LEU B 185 -11.161 -1.589 4.383 1.00 0.00 C ATOM 1434 CD1 LEU B 185 -10.453 -1.218 3.074 1.00 0.00 C ATOM 1435 CD2 LEU B 185 -10.114 -2.142 5.363 1.00 0.00 C ATOM 0 H LEU B 185 -14.181 -1.285 4.903 1.00 0.00 H new ATOM 0 HA LEU B 185 -12.194 -1.222 6.847 1.00 0.00 H new ATOM 0 HB2 LEU B 185 -12.517 0.055 4.130 1.00 0.00 H new ATOM 0 HB3 LEU B 185 -11.114 0.429 5.111 1.00 0.00 H new ATOM 0 HG LEU B 185 -11.916 -2.362 4.239 1.00 0.00 H new ATOM 0 HD11 LEU B 185 -9.942 -2.095 2.675 1.00 0.00 H new ATOM 0 HD12 LEU B 185 -11.188 -0.866 2.350 1.00 0.00 H new ATOM 0 HD13 LEU B 185 -9.725 -0.430 3.265 1.00 0.00 H new ATOM 0 HD21 LEU B 185 -9.647 -3.029 4.934 1.00 0.00 H new ATOM 0 HD22 LEU B 185 -9.353 -1.384 5.548 1.00 0.00 H new ATOM 0 HD23 LEU B 185 -10.599 -2.406 6.303 1.00 0.00 H new ATOM 1447 N MET B 186 -13.827 1.651 6.413 1.00 0.00 N ATOM 1448 CA MET B 186 -14.084 2.970 6.985 1.00 0.00 C ATOM 1449 C MET B 186 -14.597 2.870 8.423 1.00 0.00 C ATOM 1450 O MET B 186 -14.523 3.852 9.158 1.00 0.00 O ATOM 1451 CB MET B 186 -15.074 3.759 6.122 1.00 0.00 C ATOM 1452 CG MET B 186 -14.517 3.990 4.719 1.00 0.00 C ATOM 1453 SD MET B 186 -15.538 5.029 3.661 1.00 0.00 S ATOM 1454 CE MET B 186 -15.051 6.654 4.272 1.00 0.00 C ATOM 0 H MET B 186 -14.442 1.411 5.635 1.00 0.00 H new ATOM 0 HA MET B 186 -13.134 3.505 7.003 1.00 0.00 H new ATOM 0 HB2 MET B 186 -16.017 3.217 6.057 1.00 0.00 H new ATOM 0 HB3 MET B 186 -15.289 4.718 6.594 1.00 0.00 H new ATOM 0 HG2 MET B 186 -13.530 4.444 4.806 1.00 0.00 H new ATOM 0 HG3 MET B 186 -14.382 3.023 4.234 1.00 0.00 H new ATOM 0 HE1 MET B 186 -15.450 7.425 3.613 1.00 0.00 H new ATOM 0 HE2 MET B 186 -15.445 6.797 5.278 1.00 0.00 H new ATOM 0 HE3 MET B 186 -13.963 6.723 4.295 1.00 0.00 H new ATOM 1464 N GLN B 187 -15.142 1.716 8.826 1.00 0.00 N ATOM 1465 CA GLN B 187 -15.646 1.492 10.168 1.00 0.00 C ATOM 1466 C GLN B 187 -14.532 0.954 11.068 1.00 0.00 C ATOM 1467 O GLN B 187 -14.286 1.534 12.126 1.00 0.00 O ATOM 1468 CB GLN B 187 -16.821 0.497 10.158 1.00 0.00 C ATOM 1469 CG GLN B 187 -18.131 1.053 9.598 1.00 0.00 C ATOM 1470 CD GLN B 187 -18.608 2.295 10.328 1.00 0.00 C ATOM 1471 OE1 GLN B 187 -19.063 2.202 11.460 1.00 0.00 O ATOM 1472 NE2 GLN B 187 -18.531 3.463 9.707 1.00 0.00 N ATOM 0 H GLN B 187 -15.242 0.906 8.214 1.00 0.00 H new ATOM 0 HA GLN B 187 -16.000 2.447 10.556 1.00 0.00 H new ATOM 0 HB2 GLN B 187 -16.534 -0.376 9.572 1.00 0.00 H new ATOM 0 HB3 GLN B 187 -16.996 0.153 11.177 1.00 0.00 H new ATOM 0 HG2 GLN B 187 -17.998 1.288 8.542 1.00 0.00 H new ATOM 0 HG3 GLN B 187 -18.901 0.284 9.659 1.00 0.00 H new ATOM 0 HE21 GLN B 187 -18.148 3.515 8.763 1.00 0.00 H new ATOM 0 HE22 GLN B 187 -18.855 4.311 10.173 1.00 0.00 H new ATOM 1481 N LYS B 188 -13.878 -0.156 10.703 1.00 0.00 N ATOM 1482 CA LYS B 188 -12.828 -0.746 11.539 1.00 0.00 C ATOM 1483 C LYS B 188 -11.593 0.136 11.710 1.00 0.00 C ATOM 1484 O LYS B 188 -11.048 0.158 12.817 1.00 0.00 O ATOM 1485 CB LYS B 188 -12.492 -2.179 11.099 1.00 0.00 C ATOM 1486 CG LYS B 188 -12.037 -2.327 9.644 1.00 0.00 C ATOM 1487 CD LYS B 188 -11.260 -3.616 9.390 1.00 0.00 C ATOM 1488 CE LYS B 188 -12.047 -4.907 9.669 1.00 0.00 C ATOM 1489 NZ LYS B 188 -11.258 -6.122 9.356 1.00 0.00 N ATOM 0 H LYS B 188 -14.058 -0.662 9.836 1.00 0.00 H new ATOM 0 HA LYS B 188 -13.248 -0.810 12.543 1.00 0.00 H new ATOM 0 HB2 LYS B 188 -11.708 -2.567 11.749 1.00 0.00 H new ATOM 0 HB3 LYS B 188 -13.371 -2.804 11.253 1.00 0.00 H new ATOM 0 HG2 LYS B 188 -12.910 -2.301 8.992 1.00 0.00 H new ATOM 0 HG3 LYS B 188 -11.413 -1.474 9.376 1.00 0.00 H new ATOM 0 HD2 LYS B 188 -10.929 -3.626 8.352 1.00 0.00 H new ATOM 0 HD3 LYS B 188 -10.364 -3.612 10.010 1.00 0.00 H new ATOM 0 HE2 LYS B 188 -12.345 -4.929 10.717 1.00 0.00 H new ATOM 0 HE3 LYS B 188 -12.962 -4.908 9.077 1.00 0.00 H new ATOM 0 HZ1 LYS B 188 -11.828 -6.968 9.559 1.00 0.00 H new ATOM 0 HZ2 LYS B 188 -10.995 -6.115 8.350 1.00 0.00 H new ATOM 0 HZ3 LYS B 188 -10.397 -6.136 9.939 1.00 0.00 H new ATOM 1503 N GLU B 189 -11.172 0.884 10.689 1.00 0.00 N ATOM 1504 CA GLU B 189 -9.987 1.748 10.757 1.00 0.00 C ATOM 1505 C GLU B 189 -10.407 3.226 10.779 1.00 0.00 C ATOM 1506 O GLU B 189 -9.684 4.076 10.266 1.00 0.00 O ATOM 1507 CB GLU B 189 -9.035 1.410 9.584 1.00 0.00 C ATOM 1508 CG GLU B 189 -8.302 0.065 9.699 1.00 0.00 C ATOM 1509 CD GLU B 189 -7.154 0.095 10.715 1.00 0.00 C ATOM 1510 OE1 GLU B 189 -7.405 -0.156 11.918 1.00 0.00 O ATOM 1511 OE2 GLU B 189 -5.983 0.339 10.339 1.00 0.00 O ATOM 0 H GLU B 189 -11.645 0.909 9.785 1.00 0.00 H new ATOM 0 HA GLU B 189 -9.441 1.566 11.683 1.00 0.00 H new ATOM 0 HB2 GLU B 189 -9.611 1.413 8.658 1.00 0.00 H new ATOM 0 HB3 GLU B 189 -8.292 2.204 9.500 1.00 0.00 H new ATOM 0 HG2 GLU B 189 -9.015 -0.708 9.987 1.00 0.00 H new ATOM 0 HG3 GLU B 189 -7.908 -0.213 8.721 1.00 0.00 H new ATOM 1518 N GLN B 190 -11.568 3.566 11.351 1.00 0.00 N ATOM 1519 CA GLN B 190 -12.084 4.945 11.412 1.00 0.00 C ATOM 1520 C GLN B 190 -11.163 5.970 12.108 1.00 0.00 C ATOM 1521 O GLN B 190 -11.392 7.177 11.999 1.00 0.00 O ATOM 1522 CB GLN B 190 -13.485 4.948 12.061 1.00 0.00 C ATOM 1523 CG GLN B 190 -13.458 4.726 13.582 1.00 0.00 C ATOM 1524 CD GLN B 190 -14.849 4.522 14.182 1.00 0.00 C ATOM 1525 OE1 GLN B 190 -15.318 5.312 15.002 1.00 0.00 O ATOM 1526 NE2 GLN B 190 -15.506 3.423 13.867 1.00 0.00 N ATOM 0 H GLN B 190 -12.186 2.884 11.791 1.00 0.00 H new ATOM 0 HA GLN B 190 -12.133 5.282 10.377 1.00 0.00 H new ATOM 0 HB2 GLN B 190 -13.972 5.900 11.850 1.00 0.00 H new ATOM 0 HB3 GLN B 190 -14.092 4.169 11.599 1.00 0.00 H new ATOM 0 HG2 GLN B 190 -12.841 3.856 13.805 1.00 0.00 H new ATOM 0 HG3 GLN B 190 -12.985 5.583 14.060 1.00 0.00 H new ATOM 0 HE21 GLN B 190 -15.114 2.771 13.187 1.00 0.00 H new ATOM 0 HE22 GLN B 190 -16.406 3.224 14.303 1.00 0.00 H new ATOM 1535 N ARG B 191 -10.146 5.526 12.856 1.00 0.00 N ATOM 1536 CA ARG B 191 -9.212 6.410 13.557 1.00 0.00 C ATOM 1537 C ARG B 191 -7.827 6.394 12.925 1.00 0.00 C ATOM 1538 O ARG B 191 -6.983 7.169 13.366 1.00 0.00 O ATOM 1539 CB ARG B 191 -9.159 6.052 15.057 1.00 0.00 C ATOM 1540 CG ARG B 191 -10.433 6.525 15.761 1.00 0.00 C ATOM 1541 CD ARG B 191 -10.345 6.481 17.288 1.00 0.00 C ATOM 1542 NE ARG B 191 -11.590 7.000 17.882 1.00 0.00 N ATOM 1543 CZ ARG B 191 -11.827 7.231 19.178 1.00 0.00 C ATOM 1544 NH1 ARG B 191 -10.920 6.946 20.103 1.00 0.00 N ATOM 1545 NH2 ARG B 191 -12.994 7.746 19.541 1.00 0.00 N ATOM 0 H ARG B 191 -9.948 4.535 12.992 1.00 0.00 H new ATOM 0 HA ARG B 191 -9.582 7.431 13.462 1.00 0.00 H new ATOM 0 HB2 ARG B 191 -9.048 4.974 15.177 1.00 0.00 H new ATOM 0 HB3 ARG B 191 -8.287 6.516 15.518 1.00 0.00 H new ATOM 0 HG2 ARG B 191 -10.653 7.546 15.448 1.00 0.00 H new ATOM 0 HG3 ARG B 191 -11.269 5.905 15.436 1.00 0.00 H new ATOM 0 HD2 ARG B 191 -10.173 5.457 17.621 1.00 0.00 H new ATOM 0 HD3 ARG B 191 -9.496 7.074 17.628 1.00 0.00 H new ATOM 0 HE ARG B 191 -12.352 7.205 17.236 1.00 0.00 H new ATOM 0 HH11 ARG B 191 -10.023 6.543 19.831 1.00 0.00 H new ATOM 0 HH12 ARG B 191 -11.119 7.129 21.086 1.00 0.00 H new ATOM 0 HH21 ARG B 191 -13.698 7.961 18.835 1.00 0.00 H new ATOM 0 HH22 ARG B 191 -13.187 7.927 20.526 1.00 0.00 H new ATOM 1559 N ASN B 192 -7.565 5.533 11.944 1.00 0.00 N ATOM 1560 CA ASN B 192 -6.263 5.467 11.300 1.00 0.00 C ATOM 1561 C ASN B 192 -6.170 6.536 10.212 1.00 0.00 C ATOM 1562 O ASN B 192 -6.915 6.466 9.227 1.00 0.00 O ATOM 1563 CB ASN B 192 -6.050 4.074 10.691 1.00 0.00 C ATOM 1564 CG ASN B 192 -4.619 3.902 10.191 1.00 0.00 C ATOM 1565 OD1 ASN B 192 -3.854 4.853 10.099 1.00 0.00 O ATOM 1566 ND2 ASN B 192 -4.228 2.696 9.833 1.00 0.00 N ATOM 0 H ASN B 192 -8.246 4.868 11.578 1.00 0.00 H new ATOM 0 HA ASN B 192 -5.486 5.648 12.043 1.00 0.00 H new ATOM 0 HB2 ASN B 192 -6.271 3.311 11.437 1.00 0.00 H new ATOM 0 HB3 ASN B 192 -6.746 3.925 9.866 1.00 0.00 H new ATOM 0 HD21 ASN B 192 -3.283 2.551 9.477 1.00 0.00 H new ATOM 0 HD22 ASN B 192 -4.870 1.907 9.912 1.00 0.00 H new ATOM 1573 N TYR B 193 -5.286 7.526 10.377 1.00 0.00 N ATOM 1574 CA TYR B 193 -5.130 8.567 9.364 1.00 0.00 C ATOM 1575 C TYR B 193 -4.626 7.971 8.043 1.00 0.00 C ATOM 1576 O TYR B 193 -4.877 8.545 6.986 1.00 0.00 O ATOM 1577 CB TYR B 193 -4.217 9.715 9.836 1.00 0.00 C ATOM 1578 CG TYR B 193 -2.752 9.368 10.061 1.00 0.00 C ATOM 1579 CD1 TYR B 193 -1.900 9.118 8.967 1.00 0.00 C ATOM 1580 CD2 TYR B 193 -2.228 9.332 11.366 1.00 0.00 C ATOM 1581 CE1 TYR B 193 -0.560 8.755 9.182 1.00 0.00 C ATOM 1582 CE2 TYR B 193 -0.876 9.009 11.592 1.00 0.00 C ATOM 1583 CZ TYR B 193 -0.039 8.703 10.496 1.00 0.00 C ATOM 1584 OH TYR B 193 1.271 8.396 10.691 1.00 0.00 O ATOM 0 H TYR B 193 -4.678 7.626 11.190 1.00 0.00 H new ATOM 0 HA TYR B 193 -6.117 8.998 9.196 1.00 0.00 H new ATOM 0 HB2 TYR B 193 -4.269 10.517 9.100 1.00 0.00 H new ATOM 0 HB3 TYR B 193 -4.621 10.111 10.768 1.00 0.00 H new ATOM 0 HD1 TYR B 193 -2.279 9.206 7.959 1.00 0.00 H new ATOM 0 HD2 TYR B 193 -2.871 9.555 12.205 1.00 0.00 H new ATOM 0 HE1 TYR B 193 0.074 8.515 8.341 1.00 0.00 H new ATOM 0 HE2 TYR B 193 -0.481 8.995 12.597 1.00 0.00 H new ATOM 0 HH TYR B 193 1.469 8.403 11.651 1.00 0.00 H new ATOM 1594 N GLN B 194 -3.950 6.815 8.060 1.00 0.00 N ATOM 1595 CA GLN B 194 -3.439 6.214 6.843 1.00 0.00 C ATOM 1596 C GLN B 194 -4.572 5.766 5.921 1.00 0.00 C ATOM 1597 O GLN B 194 -4.339 5.643 4.719 1.00 0.00 O ATOM 1598 CB GLN B 194 -2.451 5.075 7.145 1.00 0.00 C ATOM 1599 CG GLN B 194 -1.301 5.177 6.138 1.00 0.00 C ATOM 1600 CD GLN B 194 -0.388 3.956 6.048 1.00 0.00 C ATOM 1601 OE1 GLN B 194 -0.253 3.155 6.976 1.00 0.00 O ATOM 1602 NE2 GLN B 194 0.257 3.793 4.906 1.00 0.00 N ATOM 0 H GLN B 194 -3.749 6.285 8.908 1.00 0.00 H new ATOM 0 HA GLN B 194 -2.880 6.981 6.308 1.00 0.00 H new ATOM 0 HB2 GLN B 194 -2.075 5.155 8.165 1.00 0.00 H new ATOM 0 HB3 GLN B 194 -2.946 4.107 7.063 1.00 0.00 H new ATOM 0 HG2 GLN B 194 -1.723 5.366 5.151 1.00 0.00 H new ATOM 0 HG3 GLN B 194 -0.693 6.044 6.396 1.00 0.00 H new ATOM 0 HE21 GLN B 194 0.133 4.466 4.150 1.00 0.00 H new ATOM 0 HE22 GLN B 194 0.879 2.994 4.781 1.00 0.00 H new ATOM 1611 N PHE B 195 -5.776 5.516 6.446 1.00 0.00 N ATOM 1612 CA PHE B 195 -6.944 5.109 5.666 1.00 0.00 C ATOM 1613 C PHE B 195 -7.915 6.280 5.492 1.00 0.00 C ATOM 1614 O PHE B 195 -9.029 6.096 4.998 1.00 0.00 O ATOM 1615 CB PHE B 195 -7.604 3.877 6.290 1.00 0.00 C ATOM 1616 CG PHE B 195 -6.844 2.605 5.988 1.00 0.00 C ATOM 1617 CD1 PHE B 195 -6.950 2.016 4.712 1.00 0.00 C ATOM 1618 CD2 PHE B 195 -5.987 2.049 6.952 1.00 0.00 C ATOM 1619 CE1 PHE B 195 -6.202 0.864 4.409 1.00 0.00 C ATOM 1620 CE2 PHE B 195 -5.254 0.885 6.653 1.00 0.00 C ATOM 1621 CZ PHE B 195 -5.361 0.290 5.381 1.00 0.00 C ATOM 0 H PHE B 195 -5.967 5.593 7.445 1.00 0.00 H new ATOM 0 HA PHE B 195 -6.622 4.821 4.665 1.00 0.00 H new ATOM 0 HB2 PHE B 195 -7.670 4.011 7.370 1.00 0.00 H new ATOM 0 HB3 PHE B 195 -8.624 3.786 5.917 1.00 0.00 H new ATOM 0 HD1 PHE B 195 -7.604 2.448 3.969 1.00 0.00 H new ATOM 0 HD2 PHE B 195 -5.890 2.514 7.922 1.00 0.00 H new ATOM 0 HE1 PHE B 195 -6.273 0.419 3.428 1.00 0.00 H new ATOM 0 HE2 PHE B 195 -4.609 0.448 7.400 1.00 0.00 H new ATOM 0 HZ PHE B 195 -4.800 -0.604 5.152 1.00 0.00 H new ATOM 1631 N ASP B 196 -7.513 7.501 5.859 1.00 0.00 N ATOM 1632 CA ASP B 196 -8.368 8.680 5.729 1.00 0.00 C ATOM 1633 C ASP B 196 -8.666 9.003 4.262 1.00 0.00 C ATOM 1634 O ASP B 196 -9.636 9.697 3.975 1.00 0.00 O ATOM 1635 CB ASP B 196 -7.738 9.872 6.456 1.00 0.00 C ATOM 1636 CG ASP B 196 -8.782 10.826 7.027 1.00 0.00 C ATOM 1637 OD1 ASP B 196 -9.675 10.337 7.759 1.00 0.00 O ATOM 1638 OD2 ASP B 196 -8.576 12.057 6.941 1.00 0.00 O ATOM 0 H ASP B 196 -6.592 7.697 6.252 1.00 0.00 H new ATOM 0 HA ASP B 196 -9.326 8.461 6.201 1.00 0.00 H new ATOM 0 HB2 ASP B 196 -7.104 9.507 7.264 1.00 0.00 H new ATOM 0 HB3 ASP B 196 -7.093 10.415 5.765 1.00 0.00 H new ATOM 1643 N PHE B 197 -7.866 8.470 3.322 1.00 0.00 N ATOM 1644 CA PHE B 197 -8.061 8.674 1.885 1.00 0.00 C ATOM 1645 C PHE B 197 -9.405 8.090 1.426 1.00 0.00 C ATOM 1646 O PHE B 197 -9.875 8.412 0.332 1.00 0.00 O ATOM 1647 CB PHE B 197 -6.902 8.069 1.076 1.00 0.00 C ATOM 1648 CG PHE B 197 -6.805 6.549 1.105 1.00 0.00 C ATOM 1649 CD1 PHE B 197 -7.650 5.757 0.302 1.00 0.00 C ATOM 1650 CD2 PHE B 197 -5.848 5.925 1.924 1.00 0.00 C ATOM 1651 CE1 PHE B 197 -7.562 4.354 0.351 1.00 0.00 C ATOM 1652 CE2 PHE B 197 -5.761 4.523 1.970 1.00 0.00 C ATOM 1653 CZ PHE B 197 -6.627 3.736 1.194 1.00 0.00 C ATOM 0 H PHE B 197 -7.062 7.883 3.545 1.00 0.00 H new ATOM 0 HA PHE B 197 -8.075 9.748 1.701 1.00 0.00 H new ATOM 0 HB2 PHE B 197 -7.000 8.390 0.039 1.00 0.00 H new ATOM 0 HB3 PHE B 197 -5.966 8.483 1.451 1.00 0.00 H new ATOM 0 HD1 PHE B 197 -8.367 6.229 -0.353 1.00 0.00 H new ATOM 0 HD2 PHE B 197 -5.177 6.525 2.520 1.00 0.00 H new ATOM 0 HE1 PHE B 197 -8.216 3.751 -0.262 1.00 0.00 H new ATOM 0 HE2 PHE B 197 -5.026 4.050 2.604 1.00 0.00 H new ATOM 0 HZ PHE B 197 -6.573 2.659 1.246 1.00 0.00 H new ATOM 1663 N LEU B 198 -9.996 7.180 2.214 1.00 0.00 N ATOM 1664 CA LEU B 198 -11.283 6.573 1.914 1.00 0.00 C ATOM 1665 C LEU B 198 -12.387 7.623 2.066 1.00 0.00 C ATOM 1666 O LEU B 198 -13.484 7.416 1.550 1.00 0.00 O ATOM 1667 CB LEU B 198 -11.561 5.376 2.837 1.00 0.00 C ATOM 1668 CG LEU B 198 -10.597 4.187 2.673 1.00 0.00 C ATOM 1669 CD1 LEU B 198 -10.855 3.145 3.768 1.00 0.00 C ATOM 1670 CD2 LEU B 198 -10.748 3.513 1.303 1.00 0.00 C ATOM 0 H LEU B 198 -9.582 6.847 3.085 1.00 0.00 H new ATOM 0 HA LEU B 198 -11.264 6.206 0.888 1.00 0.00 H new ATOM 0 HB2 LEU B 198 -11.519 5.717 3.871 1.00 0.00 H new ATOM 0 HB3 LEU B 198 -12.578 5.027 2.657 1.00 0.00 H new ATOM 0 HG LEU B 198 -9.584 4.580 2.755 1.00 0.00 H new ATOM 0 HD11 LEU B 198 -10.168 2.308 3.643 1.00 0.00 H new ATOM 0 HD12 LEU B 198 -10.699 3.599 4.747 1.00 0.00 H new ATOM 0 HD13 LEU B 198 -11.881 2.786 3.694 1.00 0.00 H new ATOM 0 HD21 LEU B 198 -10.050 2.679 1.229 1.00 0.00 H new ATOM 0 HD22 LEU B 198 -11.767 3.144 1.189 1.00 0.00 H new ATOM 0 HD23 LEU B 198 -10.534 4.236 0.516 1.00 0.00 H new ATOM 1682 N ARG B 199 -12.153 8.724 2.786 1.00 0.00 N ATOM 1683 CA ARG B 199 -13.148 9.770 2.958 1.00 0.00 C ATOM 1684 C ARG B 199 -12.975 10.812 1.862 1.00 0.00 C ATOM 1685 O ARG B 199 -11.843 11.150 1.524 1.00 0.00 O ATOM 1686 CB ARG B 199 -12.976 10.468 4.314 1.00 0.00 C ATOM 1687 CG ARG B 199 -13.264 9.524 5.485 1.00 0.00 C ATOM 1688 CD ARG B 199 -13.398 10.277 6.807 1.00 0.00 C ATOM 1689 NE ARG B 199 -14.580 11.156 6.817 1.00 0.00 N ATOM 1690 CZ ARG B 199 -15.213 11.619 7.897 1.00 0.00 C ATOM 1691 NH1 ARG B 199 -14.790 11.320 9.117 1.00 0.00 N ATOM 1692 NH2 ARG B 199 -16.329 12.313 7.731 1.00 0.00 N ATOM 0 H ARG B 199 -11.270 8.909 3.262 1.00 0.00 H new ATOM 0 HA ARG B 199 -14.137 9.314 2.909 1.00 0.00 H new ATOM 0 HB2 ARG B 199 -11.959 10.851 4.398 1.00 0.00 H new ATOM 0 HB3 ARG B 199 -13.645 11.327 4.367 1.00 0.00 H new ATOM 0 HG2 ARG B 199 -14.183 8.971 5.288 1.00 0.00 H new ATOM 0 HG3 ARG B 199 -12.462 8.790 5.565 1.00 0.00 H new ATOM 0 HD2 ARG B 199 -13.469 9.562 7.627 1.00 0.00 H new ATOM 0 HD3 ARG B 199 -12.501 10.872 6.979 1.00 0.00 H new ATOM 0 HE ARG B 199 -14.951 11.438 5.910 1.00 0.00 H new ATOM 0 HH11 ARG B 199 -13.969 10.728 9.241 1.00 0.00 H new ATOM 0 HH12 ARG B 199 -15.285 11.682 9.932 1.00 0.00 H new ATOM 0 HH21 ARG B 199 -16.688 12.484 6.792 1.00 0.00 H new ATOM 0 HH22 ARG B 199 -16.829 12.676 8.542 1.00 0.00 H new ATOM 1706 N PRO B 200 -14.071 11.402 1.358 1.00 0.00 N ATOM 1707 CA PRO B 200 -14.010 12.438 0.331 1.00 0.00 C ATOM 1708 C PRO B 200 -13.337 13.708 0.860 1.00 0.00 C ATOM 1709 O PRO B 200 -12.940 14.580 0.087 1.00 0.00 O ATOM 1710 CB PRO B 200 -15.446 12.661 -0.121 1.00 0.00 C ATOM 1711 CG PRO B 200 -16.281 12.194 1.067 1.00 0.00 C ATOM 1712 CD PRO B 200 -15.447 11.086 1.690 1.00 0.00 C ATOM 0 HA PRO B 200 -13.394 12.138 -0.517 1.00 0.00 H new ATOM 0 HB2 PRO B 200 -15.633 13.709 -0.354 1.00 0.00 H new ATOM 0 HB3 PRO B 200 -15.675 12.089 -1.020 1.00 0.00 H new ATOM 0 HG2 PRO B 200 -16.459 13.005 1.773 1.00 0.00 H new ATOM 0 HG3 PRO B 200 -17.257 11.828 0.749 1.00 0.00 H new ATOM 0 HD2 PRO B 200 -15.591 11.047 2.770 1.00 0.00 H new ATOM 0 HD3 PRO B 200 -15.732 10.111 1.295 1.00 0.00 H new ATOM 1720 N GLN B 201 -13.187 13.798 2.182 1.00 0.00 N ATOM 1721 CA GLN B 201 -12.543 14.869 2.915 1.00 0.00 C ATOM 1722 C GLN B 201 -11.077 14.994 2.458 1.00 0.00 C ATOM 1723 O GLN B 201 -10.465 16.038 2.655 1.00 0.00 O ATOM 1724 CB GLN B 201 -12.664 14.489 4.398 1.00 0.00 C ATOM 1725 CG GLN B 201 -12.447 15.641 5.385 1.00 0.00 C ATOM 1726 CD GLN B 201 -12.926 15.215 6.776 1.00 0.00 C ATOM 1727 OE1 GLN B 201 -14.111 14.937 6.970 1.00 0.00 O ATOM 1728 NE2 GLN B 201 -12.028 15.114 7.742 1.00 0.00 N ATOM 0 H GLN B 201 -13.539 13.070 2.804 1.00 0.00 H new ATOM 0 HA GLN B 201 -13.003 15.842 2.740 1.00 0.00 H new ATOM 0 HB2 GLN B 201 -13.654 14.067 4.569 1.00 0.00 H new ATOM 0 HB3 GLN B 201 -11.940 13.704 4.616 1.00 0.00 H new ATOM 0 HG2 GLN B 201 -11.392 15.912 5.419 1.00 0.00 H new ATOM 0 HG3 GLN B 201 -12.993 16.525 5.055 1.00 0.00 H new ATOM 0 HE21 GLN B 201 -11.053 15.349 7.558 1.00 0.00 H new ATOM 0 HE22 GLN B 201 -12.311 14.801 8.671 1.00 0.00 H new ATOM 1737 N HIS B 202 -10.526 13.930 1.859 1.00 0.00 N ATOM 1738 CA HIS B 202 -9.180 13.824 1.336 1.00 0.00 C ATOM 1739 C HIS B 202 -9.265 14.006 -0.180 1.00 0.00 C ATOM 1740 O HIS B 202 -10.085 13.350 -0.830 1.00 0.00 O ATOM 1741 CB HIS B 202 -8.667 12.408 1.644 1.00 0.00 C ATOM 1742 CG HIS B 202 -7.223 12.358 2.060 1.00 0.00 C ATOM 1743 ND1 HIS B 202 -6.133 12.393 1.224 1.00 0.00 N ATOM 1744 CD2 HIS B 202 -6.762 12.231 3.344 1.00 0.00 C ATOM 1745 CE1 HIS B 202 -5.035 12.267 1.982 1.00 0.00 C ATOM 1746 NE2 HIS B 202 -5.364 12.169 3.283 1.00 0.00 N ATOM 0 H HIS B 202 -11.054 13.068 1.724 1.00 0.00 H new ATOM 0 HA HIS B 202 -8.515 14.568 1.775 1.00 0.00 H new ATOM 0 HB2 HIS B 202 -9.278 11.976 2.436 1.00 0.00 H new ATOM 0 HB3 HIS B 202 -8.802 11.784 0.761 1.00 0.00 H new ATOM 0 HD2 HIS B 202 -7.366 12.187 4.239 1.00 0.00 H new ATOM 0 HE1 HIS B 202 -4.025 12.247 1.601 1.00 0.00 H new ATOM 0 HE2 HIS B 202 -4.722 12.069 4.069 1.00 0.00 H new ATOM 1754 N SER B 203 -8.384 14.808 -0.783 1.00 0.00 N ATOM 1755 CA SER B 203 -8.408 15.023 -2.233 1.00 0.00 C ATOM 1756 C SER B 203 -8.217 13.693 -2.978 1.00 0.00 C ATOM 1757 O SER B 203 -8.894 13.436 -3.977 1.00 0.00 O ATOM 1758 CB SER B 203 -7.342 16.050 -2.641 1.00 0.00 C ATOM 1759 OG SER B 203 -7.792 16.746 -3.783 1.00 0.00 O ATOM 0 H SER B 203 -7.648 15.317 -0.293 1.00 0.00 H new ATOM 0 HA SER B 203 -9.383 15.424 -2.511 1.00 0.00 H new ATOM 0 HB2 SER B 203 -7.157 16.747 -1.823 1.00 0.00 H new ATOM 0 HB3 SER B 203 -6.397 15.549 -2.853 1.00 0.00 H new ATOM 0 HG SER B 203 -7.119 17.406 -4.050 1.00 0.00 H new ATOM 1765 N LEU B 204 -7.368 12.811 -2.422 1.00 0.00 N ATOM 1766 CA LEU B 204 -7.035 11.484 -2.945 1.00 0.00 C ATOM 1767 C LEU B 204 -8.262 10.660 -3.300 1.00 0.00 C ATOM 1768 O LEU B 204 -8.152 9.786 -4.157 1.00 0.00 O ATOM 1769 CB LEU B 204 -6.219 10.661 -1.934 1.00 0.00 C ATOM 1770 CG LEU B 204 -4.768 11.098 -1.713 1.00 0.00 C ATOM 1771 CD1 LEU B 204 -4.155 10.122 -0.703 1.00 0.00 C ATOM 1772 CD2 LEU B 204 -3.944 11.126 -3.006 1.00 0.00 C ATOM 0 H LEU B 204 -6.874 13.019 -1.554 1.00 0.00 H new ATOM 0 HA LEU B 204 -6.454 11.681 -3.846 1.00 0.00 H new ATOM 0 HB2 LEU B 204 -6.735 10.691 -0.974 1.00 0.00 H new ATOM 0 HB3 LEU B 204 -6.216 9.622 -2.262 1.00 0.00 H new ATOM 0 HG LEU B 204 -4.756 12.122 -1.341 1.00 0.00 H new ATOM 0 HD11 LEU B 204 -3.117 10.397 -0.515 1.00 0.00 H new ATOM 0 HD12 LEU B 204 -4.716 10.164 0.230 1.00 0.00 H new ATOM 0 HD13 LEU B 204 -4.195 9.110 -1.105 1.00 0.00 H new ATOM 0 HD21 LEU B 204 -2.926 11.443 -2.782 1.00 0.00 H new ATOM 0 HD22 LEU B 204 -3.925 10.129 -3.447 1.00 0.00 H new ATOM 0 HD23 LEU B 204 -4.395 11.825 -3.710 1.00 0.00 H new ATOM 1784 N PHE B 205 -9.403 10.911 -2.656 1.00 0.00 N ATOM 1785 CA PHE B 205 -10.647 10.209 -2.924 1.00 0.00 C ATOM 1786 C PHE B 205 -10.945 10.223 -4.420 1.00 0.00 C ATOM 1787 O PHE B 205 -11.362 9.217 -4.981 1.00 0.00 O ATOM 1788 CB PHE B 205 -11.769 10.912 -2.161 1.00 0.00 C ATOM 1789 CG PHE B 205 -13.165 10.347 -2.363 1.00 0.00 C ATOM 1790 CD1 PHE B 205 -13.917 10.656 -3.515 1.00 0.00 C ATOM 1791 CD2 PHE B 205 -13.752 9.589 -1.337 1.00 0.00 C ATOM 1792 CE1 PHE B 205 -15.246 10.218 -3.634 1.00 0.00 C ATOM 1793 CE2 PHE B 205 -15.088 9.176 -1.444 1.00 0.00 C ATOM 1794 CZ PHE B 205 -15.833 9.481 -2.594 1.00 0.00 C ATOM 0 H PHE B 205 -9.484 11.618 -1.925 1.00 0.00 H new ATOM 0 HA PHE B 205 -10.567 9.171 -2.600 1.00 0.00 H new ATOM 0 HB2 PHE B 205 -11.535 10.878 -1.097 1.00 0.00 H new ATOM 0 HB3 PHE B 205 -11.778 11.962 -2.452 1.00 0.00 H new ATOM 0 HD1 PHE B 205 -13.468 11.233 -4.310 1.00 0.00 H new ATOM 0 HD2 PHE B 205 -13.174 9.324 -0.464 1.00 0.00 H new ATOM 0 HE1 PHE B 205 -15.814 10.448 -4.523 1.00 0.00 H new ATOM 0 HE2 PHE B 205 -15.546 8.621 -0.638 1.00 0.00 H new ATOM 0 HZ PHE B 205 -16.857 9.149 -2.678 1.00 0.00 H new ATOM 1804 N ASN B 206 -10.691 11.344 -5.093 1.00 0.00 N ATOM 1805 CA ASN B 206 -10.952 11.482 -6.520 1.00 0.00 C ATOM 1806 C ASN B 206 -10.100 10.560 -7.385 1.00 0.00 C ATOM 1807 O ASN B 206 -10.525 10.200 -8.483 1.00 0.00 O ATOM 1808 CB ASN B 206 -10.788 12.941 -6.926 1.00 0.00 C ATOM 1809 CG ASN B 206 -12.033 13.698 -6.515 1.00 0.00 C ATOM 1810 OD1 ASN B 206 -13.055 13.620 -7.190 1.00 0.00 O ATOM 1811 ND2 ASN B 206 -12.003 14.356 -5.370 1.00 0.00 N ATOM 0 H ASN B 206 -10.298 12.181 -4.662 1.00 0.00 H new ATOM 0 HA ASN B 206 -11.981 11.168 -6.697 1.00 0.00 H new ATOM 0 HB2 ASN B 206 -9.908 13.371 -6.447 1.00 0.00 H new ATOM 0 HB3 ASN B 206 -10.635 13.020 -8.002 1.00 0.00 H new ATOM 0 HD21 ASN B 206 -12.845 14.817 -5.025 1.00 0.00 H new ATOM 0 HD22 ASN B 206 -11.138 14.403 -4.831 1.00 0.00 H new ATOM 1818 N TYR B 207 -8.899 10.198 -6.937 1.00 0.00 N ATOM 1819 CA TYR B 207 -8.006 9.293 -7.655 1.00 0.00 C ATOM 1820 C TYR B 207 -8.334 7.851 -7.235 1.00 0.00 C ATOM 1821 O TYR B 207 -8.191 6.918 -8.022 1.00 0.00 O ATOM 1822 CB TYR B 207 -6.556 9.649 -7.308 1.00 0.00 C ATOM 1823 CG TYR B 207 -5.537 8.629 -7.766 1.00 0.00 C ATOM 1824 CD1 TYR B 207 -5.243 8.463 -9.131 1.00 0.00 C ATOM 1825 CD2 TYR B 207 -4.917 7.804 -6.812 1.00 0.00 C ATOM 1826 CE1 TYR B 207 -4.328 7.478 -9.541 1.00 0.00 C ATOM 1827 CE2 TYR B 207 -4.021 6.802 -7.212 1.00 0.00 C ATOM 1828 CZ TYR B 207 -3.719 6.639 -8.583 1.00 0.00 C ATOM 1829 OH TYR B 207 -2.860 5.666 -8.985 1.00 0.00 O ATOM 0 H TYR B 207 -8.514 10.530 -6.053 1.00 0.00 H new ATOM 0 HA TYR B 207 -8.138 9.386 -8.733 1.00 0.00 H new ATOM 0 HB2 TYR B 207 -6.314 10.613 -7.755 1.00 0.00 H new ATOM 0 HB3 TYR B 207 -6.472 9.769 -6.228 1.00 0.00 H new ATOM 0 HD1 TYR B 207 -5.721 9.094 -9.866 1.00 0.00 H new ATOM 0 HD2 TYR B 207 -5.132 7.943 -5.763 1.00 0.00 H new ATOM 0 HE1 TYR B 207 -4.091 7.363 -10.588 1.00 0.00 H new ATOM 0 HE2 TYR B 207 -3.564 6.158 -6.476 1.00 0.00 H new ATOM 0 HH TYR B 207 -2.105 6.072 -9.461 1.00 0.00 H new ATOM 1839 N PHE B 208 -8.810 7.662 -6.005 1.00 0.00 N ATOM 1840 CA PHE B 208 -9.184 6.358 -5.502 1.00 0.00 C ATOM 1841 C PHE B 208 -10.456 5.898 -6.215 1.00 0.00 C ATOM 1842 O PHE B 208 -10.467 4.850 -6.859 1.00 0.00 O ATOM 1843 CB PHE B 208 -9.375 6.427 -3.983 1.00 0.00 C ATOM 1844 CG PHE B 208 -10.045 5.203 -3.387 1.00 0.00 C ATOM 1845 CD1 PHE B 208 -11.450 5.139 -3.326 1.00 0.00 C ATOM 1846 CD2 PHE B 208 -9.284 4.127 -2.896 1.00 0.00 C ATOM 1847 CE1 PHE B 208 -12.086 4.030 -2.758 1.00 0.00 C ATOM 1848 CE2 PHE B 208 -9.923 3.015 -2.325 1.00 0.00 C ATOM 1849 CZ PHE B 208 -11.324 2.973 -2.239 1.00 0.00 C ATOM 0 H PHE B 208 -8.944 8.418 -5.333 1.00 0.00 H new ATOM 0 HA PHE B 208 -8.397 5.631 -5.702 1.00 0.00 H new ATOM 0 HB2 PHE B 208 -8.402 6.561 -3.511 1.00 0.00 H new ATOM 0 HB3 PHE B 208 -9.971 7.308 -3.742 1.00 0.00 H new ATOM 0 HD1 PHE B 208 -12.041 5.952 -3.721 1.00 0.00 H new ATOM 0 HD2 PHE B 208 -8.206 4.156 -2.958 1.00 0.00 H new ATOM 0 HE1 PHE B 208 -13.164 3.988 -2.719 1.00 0.00 H new ATOM 0 HE2 PHE B 208 -9.335 2.190 -1.951 1.00 0.00 H new ATOM 0 HZ PHE B 208 -11.813 2.129 -1.775 1.00 0.00 H new ATOM 1859 N THR B 209 -11.509 6.714 -6.148 1.00 0.00 N ATOM 1860 CA THR B 209 -12.811 6.452 -6.734 1.00 0.00 C ATOM 1861 C THR B 209 -12.679 6.232 -8.239 1.00 0.00 C ATOM 1862 O THR B 209 -13.229 5.260 -8.746 1.00 0.00 O ATOM 1863 CB THR B 209 -13.795 7.549 -6.271 1.00 0.00 C ATOM 1864 OG1 THR B 209 -15.075 7.014 -6.040 1.00 0.00 O ATOM 1865 CG2 THR B 209 -13.906 8.777 -7.171 1.00 0.00 C ATOM 0 H THR B 209 -11.469 7.610 -5.663 1.00 0.00 H new ATOM 0 HA THR B 209 -13.245 5.517 -6.380 1.00 0.00 H new ATOM 0 HB THR B 209 -13.353 7.915 -5.344 1.00 0.00 H new ATOM 0 HG1 THR B 209 -15.680 7.727 -5.746 1.00 0.00 H new ATOM 0 HG21 THR B 209 -14.625 9.477 -6.745 1.00 0.00 H new ATOM 0 HG22 THR B 209 -12.932 9.260 -7.249 1.00 0.00 H new ATOM 0 HG23 THR B 209 -14.240 8.472 -8.163 1.00 0.00 H new ATOM 1873 N LYS B 210 -11.906 7.056 -8.969 1.00 0.00 N ATOM 1874 CA LYS B 210 -11.740 6.870 -10.415 1.00 0.00 C ATOM 1875 C LYS B 210 -11.179 5.473 -10.720 1.00 0.00 C ATOM 1876 O LYS B 210 -11.467 4.915 -11.778 1.00 0.00 O ATOM 1877 CB LYS B 210 -10.977 8.061 -11.044 1.00 0.00 C ATOM 1878 CG LYS B 210 -9.524 8.268 -10.630 1.00 0.00 C ATOM 1879 CD LYS B 210 -8.477 7.408 -11.350 1.00 0.00 C ATOM 1880 CE LYS B 210 -8.324 7.789 -12.822 1.00 0.00 C ATOM 1881 NZ LYS B 210 -7.451 8.957 -13.034 1.00 0.00 N ATOM 0 H LYS B 210 -11.393 7.848 -8.583 1.00 0.00 H new ATOM 0 HA LYS B 210 -12.711 6.887 -10.911 1.00 0.00 H new ATOM 0 HB2 LYS B 210 -11.004 7.942 -12.127 1.00 0.00 H new ATOM 0 HB3 LYS B 210 -11.526 8.973 -10.810 1.00 0.00 H new ATOM 0 HG2 LYS B 210 -9.271 9.316 -10.787 1.00 0.00 H new ATOM 0 HG3 LYS B 210 -9.444 8.078 -9.560 1.00 0.00 H new ATOM 0 HD2 LYS B 210 -7.515 7.515 -10.848 1.00 0.00 H new ATOM 0 HD3 LYS B 210 -8.760 6.358 -11.277 1.00 0.00 H new ATOM 0 HE2 LYS B 210 -7.920 6.938 -13.370 1.00 0.00 H new ATOM 0 HE3 LYS B 210 -9.308 7.999 -13.240 1.00 0.00 H new ATOM 0 HZ1 LYS B 210 -7.389 9.164 -14.051 1.00 0.00 H new ATOM 0 HZ2 LYS B 210 -7.846 9.781 -12.537 1.00 0.00 H new ATOM 0 HZ3 LYS B 210 -6.501 8.752 -12.663 1.00 0.00 H new ATOM 1895 N LEU B 211 -10.363 4.897 -9.830 1.00 0.00 N ATOM 1896 CA LEU B 211 -9.817 3.558 -10.021 1.00 0.00 C ATOM 1897 C LEU B 211 -10.917 2.546 -9.705 1.00 0.00 C ATOM 1898 O LEU B 211 -11.072 1.613 -10.480 1.00 0.00 O ATOM 1899 CB LEU B 211 -8.546 3.333 -9.179 1.00 0.00 C ATOM 1900 CG LEU B 211 -7.294 3.984 -9.804 1.00 0.00 C ATOM 1901 CD1 LEU B 211 -6.155 4.093 -8.796 1.00 0.00 C ATOM 1902 CD2 LEU B 211 -6.746 3.189 -10.990 1.00 0.00 C ATOM 0 H LEU B 211 -10.067 5.347 -8.964 1.00 0.00 H new ATOM 0 HA LEU B 211 -9.501 3.430 -11.056 1.00 0.00 H new ATOM 0 HB2 LEU B 211 -8.701 3.739 -8.179 1.00 0.00 H new ATOM 0 HB3 LEU B 211 -8.375 2.262 -9.065 1.00 0.00 H new ATOM 0 HG LEU B 211 -7.627 4.969 -10.133 1.00 0.00 H new ATOM 0 HD11 LEU B 211 -5.291 4.556 -9.272 1.00 0.00 H new ATOM 0 HD12 LEU B 211 -6.474 4.703 -7.951 1.00 0.00 H new ATOM 0 HD13 LEU B 211 -5.885 3.098 -8.443 1.00 0.00 H new ATOM 0 HD21 LEU B 211 -5.866 3.693 -11.390 1.00 0.00 H new ATOM 0 HD22 LEU B 211 -6.472 2.187 -10.661 1.00 0.00 H new ATOM 0 HD23 LEU B 211 -7.509 3.120 -11.766 1.00 0.00 H new ATOM 1914 N VAL B 212 -11.679 2.704 -8.611 1.00 0.00 N ATOM 1915 CA VAL B 212 -12.758 1.771 -8.265 1.00 0.00 C ATOM 1916 C VAL B 212 -13.753 1.685 -9.413 1.00 0.00 C ATOM 1917 O VAL B 212 -14.052 0.582 -9.844 1.00 0.00 O ATOM 1918 CB VAL B 212 -13.510 2.168 -6.981 1.00 0.00 C ATOM 1919 CG1 VAL B 212 -14.637 1.175 -6.646 1.00 0.00 C ATOM 1920 CG2 VAL B 212 -12.558 2.229 -5.787 1.00 0.00 C ATOM 0 H VAL B 212 -11.565 3.473 -7.950 1.00 0.00 H new ATOM 0 HA VAL B 212 -12.288 0.804 -8.084 1.00 0.00 H new ATOM 0 HB VAL B 212 -13.942 3.151 -7.169 1.00 0.00 H new ATOM 0 HG11 VAL B 212 -15.142 1.492 -5.733 1.00 0.00 H new ATOM 0 HG12 VAL B 212 -15.354 1.148 -7.467 1.00 0.00 H new ATOM 0 HG13 VAL B 212 -14.215 0.181 -6.500 1.00 0.00 H new ATOM 0 HG21 VAL B 212 -13.114 2.511 -4.893 1.00 0.00 H new ATOM 0 HG22 VAL B 212 -12.100 1.251 -5.636 1.00 0.00 H new ATOM 0 HG23 VAL B 212 -11.780 2.968 -5.979 1.00 0.00 H new ATOM 1930 N GLU B 213 -14.238 2.820 -9.918 1.00 0.00 N ATOM 1931 CA GLU B 213 -15.209 2.880 -11.009 1.00 0.00 C ATOM 1932 C GLU B 213 -14.666 2.071 -12.201 1.00 0.00 C ATOM 1933 O GLU B 213 -15.332 1.168 -12.707 1.00 0.00 O ATOM 1934 CB GLU B 213 -15.505 4.349 -11.381 1.00 0.00 C ATOM 1935 CG GLU B 213 -16.036 5.215 -10.216 1.00 0.00 C ATOM 1936 CD GLU B 213 -17.558 5.237 -10.042 1.00 0.00 C ATOM 1937 OE1 GLU B 213 -18.197 6.161 -10.590 1.00 0.00 O ATOM 1938 OE2 GLU B 213 -18.094 4.462 -9.210 1.00 0.00 O ATOM 0 H GLU B 213 -13.961 3.739 -9.573 1.00 0.00 H new ATOM 0 HA GLU B 213 -16.156 2.438 -10.700 1.00 0.00 H new ATOM 0 HB2 GLU B 213 -14.592 4.803 -11.767 1.00 0.00 H new ATOM 0 HB3 GLU B 213 -16.235 4.365 -12.190 1.00 0.00 H new ATOM 0 HG2 GLU B 213 -15.588 4.857 -9.289 1.00 0.00 H new ATOM 0 HG3 GLU B 213 -15.691 6.239 -10.362 1.00 0.00 H new ATOM 1945 N GLN B 214 -13.415 2.329 -12.595 1.00 0.00 N ATOM 1946 CA GLN B 214 -12.757 1.642 -13.701 1.00 0.00 C ATOM 1947 C GLN B 214 -12.494 0.150 -13.415 1.00 0.00 C ATOM 1948 O GLN B 214 -12.279 -0.635 -14.345 1.00 0.00 O ATOM 1949 CB GLN B 214 -11.460 2.406 -13.993 1.00 0.00 C ATOM 1950 CG GLN B 214 -10.787 1.945 -15.288 1.00 0.00 C ATOM 1951 CD GLN B 214 -10.032 3.075 -15.984 1.00 0.00 C ATOM 1952 OE1 GLN B 214 -10.601 4.125 -16.277 1.00 0.00 O ATOM 1953 NE2 GLN B 214 -8.749 2.894 -16.253 1.00 0.00 N ATOM 0 H GLN B 214 -12.827 3.031 -12.146 1.00 0.00 H new ATOM 0 HA GLN B 214 -13.411 1.640 -14.573 1.00 0.00 H new ATOM 0 HB2 GLN B 214 -11.677 3.472 -14.060 1.00 0.00 H new ATOM 0 HB3 GLN B 214 -10.769 2.273 -13.161 1.00 0.00 H new ATOM 0 HG2 GLN B 214 -10.096 1.132 -15.066 1.00 0.00 H new ATOM 0 HG3 GLN B 214 -11.542 1.545 -15.965 1.00 0.00 H new ATOM 0 HE21 GLN B 214 -8.294 2.016 -16.002 1.00 0.00 H new ATOM 0 HE22 GLN B 214 -8.215 3.632 -16.711 1.00 0.00 H new ATOM 1962 N TYR B 215 -12.490 -0.261 -12.148 1.00 0.00 N ATOM 1963 CA TYR B 215 -12.267 -1.633 -11.724 1.00 0.00 C ATOM 1964 C TYR B 215 -13.595 -2.369 -11.488 1.00 0.00 C ATOM 1965 O TYR B 215 -13.587 -3.600 -11.568 1.00 0.00 O ATOM 1966 CB TYR B 215 -11.419 -1.671 -10.445 1.00 0.00 C ATOM 1967 CG TYR B 215 -9.959 -1.242 -10.495 1.00 0.00 C ATOM 1968 CD1 TYR B 215 -9.166 -1.379 -11.649 1.00 0.00 C ATOM 1969 CD2 TYR B 215 -9.363 -0.774 -9.310 1.00 0.00 C ATOM 1970 CE1 TYR B 215 -7.792 -1.082 -11.609 1.00 0.00 C ATOM 1971 CE2 TYR B 215 -7.990 -0.487 -9.248 1.00 0.00 C ATOM 1972 CZ TYR B 215 -7.195 -0.653 -10.403 1.00 0.00 C ATOM 1973 OH TYR B 215 -5.852 -0.425 -10.335 1.00 0.00 O ATOM 0 H TYR B 215 -12.647 0.376 -11.367 1.00 0.00 H new ATOM 0 HA TYR B 215 -11.730 -2.141 -12.525 1.00 0.00 H new ATOM 0 HB2 TYR B 215 -11.917 -1.045 -9.705 1.00 0.00 H new ATOM 0 HB3 TYR B 215 -11.445 -2.693 -10.067 1.00 0.00 H new ATOM 0 HD1 TYR B 215 -9.616 -1.715 -12.572 1.00 0.00 H new ATOM 0 HD2 TYR B 215 -9.974 -0.633 -8.430 1.00 0.00 H new ATOM 0 HE1 TYR B 215 -7.192 -1.182 -12.502 1.00 0.00 H new ATOM 0 HE2 TYR B 215 -7.546 -0.143 -8.326 1.00 0.00 H new ATOM 0 HH TYR B 215 -5.615 -0.135 -9.430 1.00 0.00 H new ATOM 1983 N THR B 216 -14.714 -1.678 -11.220 1.00 0.00 N ATOM 1984 CA THR B 216 -16.028 -2.284 -10.973 1.00 0.00 C ATOM 1985 C THR B 216 -16.610 -2.967 -12.212 1.00 0.00 C ATOM 1986 O THR B 216 -15.957 -3.082 -13.253 1.00 0.00 O ATOM 1987 CB THR B 216 -17.027 -1.264 -10.374 1.00 0.00 C ATOM 1988 OG1 THR B 216 -16.947 0.047 -10.899 1.00 0.00 O ATOM 1989 CG2 THR B 216 -16.873 -1.200 -8.862 1.00 0.00 C ATOM 0 H THR B 216 -14.729 -0.659 -11.168 1.00 0.00 H new ATOM 0 HA THR B 216 -15.865 -3.067 -10.232 1.00 0.00 H new ATOM 0 HB THR B 216 -18.008 -1.643 -10.662 1.00 0.00 H new ATOM 0 HG1 THR B 216 -16.449 0.032 -11.743 1.00 0.00 H new ATOM 0 HG21 THR B 216 -17.581 -0.479 -8.454 1.00 0.00 H new ATOM 0 HG22 THR B 216 -17.069 -2.183 -8.434 1.00 0.00 H new ATOM 0 HG23 THR B 216 -15.858 -0.892 -8.612 1.00 0.00 H new