USER MOD reduce.3.24.130724 H: found=0, std=0, add=686, rem=0, adj=6 USER MOD reduce.3.24.130724 removed 704 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 SER OG : rot 180:sc= 0 USER MOD Set 1.2: B 209 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl -152:sc= -0.275 (180deg=-1.67!) USER MOD Single : A 18 ASN : amide:sc= -0.419 X(o=-0.42,f=-0.63) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 GLN : amide:sc= -0.875 K(o=-0.88,f=-3.6!) USER MOD Single : A 30 GLN : amide:sc= -0.251 X(o=-0.25,f=-0.25) USER MOD Single : A 32 ASN : amide:sc= -0.115 K(o=-0.12,f=-2.2!) USER MOD Single : A 45 GLN : amide:sc= -0.792 K(o=-0.79,f=-2.7!) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : B 217 SER OG : rot 49:sc= 0.509 USER MOD Single : B 218 ASN :FLIP amide:sc= -0.0143 F(o=-1.6!,f=-0.014) USER MOD Single : B 222 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 223 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : B 230 GLN : amide:sc= -0.224 X(o=-0.22,f=-0.7) USER MOD Single : B 232 ASN : amide:sc= -0.441 K(o=-0.44,f=-1.6!) USER MOD Single : B 245 GLN : amide:sc= -0.0314 X(o=-0.031,f=-0.51!) USER MOD Single : B 246 TYR OH : rot 180:sc= 0 USER MOD Single : B 249 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 111 N MET A 9 -14.623 -13.665 7.256 1.00 1.00 N ATOM 112 CA MET A 9 -13.984 -12.873 6.211 1.00 1.00 C ATOM 113 C MET A 9 -12.942 -13.707 5.474 1.00 1.00 C ATOM 114 O MET A 9 -12.498 -14.744 5.969 1.00 1.00 O ATOM 115 CB MET A 9 -13.316 -11.644 6.822 1.00 1.00 C ATOM 116 CG MET A 9 -14.359 -10.812 7.572 1.00 1.00 C ATOM 117 SD MET A 9 -13.625 -9.233 8.068 1.00 1.00 S ATOM 118 CE MET A 9 -12.293 -9.911 9.086 1.00 1.00 C ATOM 0 HA MET A 9 -14.748 -12.554 5.502 1.00 1.00 H new ATOM 0 HB2 MET A 9 -12.522 -11.950 7.503 1.00 1.00 H new ATOM 0 HB3 MET A 9 -12.851 -11.044 6.040 1.00 1.00 H new ATOM 0 HG2 MET A 9 -15.227 -10.638 6.936 1.00 1.00 H new ATOM 0 HG3 MET A 9 -14.710 -11.354 8.450 1.00 1.00 H new ATOM 0 HE1 MET A 9 -12.028 -9.194 9.863 1.00 1.00 H new ATOM 0 HE2 MET A 9 -12.625 -10.840 9.548 1.00 1.00 H new ATOM 0 HE3 MET A 9 -11.422 -10.108 8.461 1.00 1.00 H new ATOM 128 N GLY A 10 -12.555 -13.248 4.289 1.00 1.00 N ATOM 129 CA GLY A 10 -11.567 -13.958 3.488 1.00 1.00 C ATOM 130 C GLY A 10 -10.192 -13.873 4.133 1.00 1.00 C ATOM 131 O GLY A 10 -10.031 -13.269 5.193 1.00 1.00 O ATOM 0 H GLY A 10 -12.909 -12.391 3.864 1.00 1.00 H new ATOM 0 HA2 GLY A 10 -11.860 -15.002 3.381 1.00 1.00 H new ATOM 0 HA3 GLY A 10 -11.531 -13.533 2.485 1.00 1.00 H new ATOM 135 N ARG A 11 -9.204 -14.484 3.492 1.00 1.00 N ATOM 136 CA ARG A 11 -7.833 -14.476 4.013 1.00 1.00 C ATOM 137 C ARG A 11 -6.853 -14.064 2.928 1.00 1.00 C ATOM 138 O ARG A 11 -6.861 -14.615 1.830 1.00 1.00 O ATOM 139 CB ARG A 11 -7.463 -15.865 4.531 1.00 1.00 C ATOM 140 CG ARG A 11 -6.068 -15.821 5.158 1.00 1.00 C ATOM 141 CD ARG A 11 -5.725 -17.193 5.736 1.00 1.00 C ATOM 142 NE ARG A 11 -6.590 -17.493 6.871 1.00 1.00 N ATOM 143 CZ ARG A 11 -6.496 -18.651 7.518 1.00 1.00 C ATOM 144 NH1 ARG A 11 -5.619 -19.541 7.140 1.00 1.00 N ATOM 145 NH2 ARG A 11 -7.280 -18.897 8.531 1.00 1.00 N ATOM 0 H ARG A 11 -9.320 -14.991 2.614 1.00 1.00 H new ATOM 0 HA ARG A 11 -7.780 -13.756 4.830 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -8.194 -16.197 5.268 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -7.484 -16.587 3.714 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -5.330 -15.536 4.409 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -6.034 -15.065 5.943 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -5.842 -17.958 4.969 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -4.681 -17.213 6.050 1.00 1.00 H new ATOM 0 HE ARG A 11 -7.278 -16.804 7.173 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -5.006 -19.348 6.348 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -5.547 -20.429 7.636 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -7.965 -18.201 8.827 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -7.208 -19.785 9.028 1.00 1.00 H new ATOM 159 N ILE A 12 -6.012 -13.082 3.242 1.00 1.00 N ATOM 160 CA ILE A 12 -5.022 -12.583 2.286 1.00 1.00 C ATOM 161 C ILE A 12 -3.635 -12.594 2.896 1.00 1.00 C ATOM 162 O ILE A 12 -3.472 -12.403 4.095 1.00 1.00 O ATOM 163 CB ILE A 12 -5.378 -11.160 1.853 1.00 1.00 C ATOM 164 CG1 ILE A 12 -6.809 -11.132 1.277 1.00 1.00 C ATOM 165 CG2 ILE A 12 -4.384 -10.679 0.785 1.00 1.00 C ATOM 166 CD1 ILE A 12 -6.792 -11.594 -0.190 1.00 1.00 C ATOM 0 H ILE A 12 -5.995 -12.615 4.149 1.00 1.00 H new ATOM 0 HA ILE A 12 -5.029 -13.239 1.416 1.00 1.00 H new ATOM 0 HB ILE A 12 -5.325 -10.500 2.719 1.00 1.00 H new ATOM 0 HG12 ILE A 12 -7.459 -11.780 1.864 1.00 1.00 H new ATOM 0 HG13 ILE A 12 -7.218 -10.124 1.345 1.00 1.00 H new ATOM 0 HG21 ILE A 12 -4.641 -9.665 0.479 1.00 1.00 H new ATOM 0 HG22 ILE A 12 -3.375 -10.689 1.196 1.00 1.00 H new ATOM 0 HG23 ILE A 12 -4.430 -11.341 -0.079 1.00 1.00 H new ATOM 0 HD11 ILE A 12 -7.806 -11.572 -0.590 1.00 1.00 H new ATOM 0 HD12 ILE A 12 -6.157 -10.928 -0.774 1.00 1.00 H new ATOM 0 HD13 ILE A 12 -6.402 -12.610 -0.247 1.00 1.00 H new ATOM 178 N LEU A 13 -2.631 -12.828 2.057 1.00 1.00 N ATOM 179 CA LEU A 13 -1.247 -12.869 2.524 1.00 1.00 C ATOM 180 C LEU A 13 -0.559 -11.544 2.251 1.00 1.00 C ATOM 181 O LEU A 13 -0.692 -10.972 1.168 1.00 1.00 O ATOM 182 CB LEU A 13 -0.489 -14.000 1.816 1.00 1.00 C ATOM 183 CG LEU A 13 -0.777 -15.326 2.507 1.00 1.00 C ATOM 184 CD1 LEU A 13 -2.281 -15.616 2.462 1.00 1.00 C ATOM 185 CD2 LEU A 13 -0.016 -16.449 1.802 1.00 1.00 C ATOM 0 H LEU A 13 -2.747 -12.991 1.057 1.00 1.00 H new ATOM 0 HA LEU A 13 -1.247 -13.052 3.598 1.00 1.00 H new ATOM 0 HB2 LEU A 13 -0.790 -14.052 0.770 1.00 1.00 H new ATOM 0 HB3 LEU A 13 0.582 -13.797 1.830 1.00 1.00 H new ATOM 0 HG LEU A 13 -0.453 -15.268 3.546 1.00 1.00 H new ATOM 0 HD11 LEU A 13 -2.483 -16.566 2.957 1.00 1.00 H new ATOM 0 HD12 LEU A 13 -2.821 -14.818 2.972 1.00 1.00 H new ATOM 0 HD13 LEU A 13 -2.610 -15.671 1.424 1.00 1.00 H new ATOM 0 HD21 LEU A 13 -0.224 -17.397 2.298 1.00 1.00 H new ATOM 0 HD22 LEU A 13 -0.335 -16.507 0.761 1.00 1.00 H new ATOM 0 HD23 LEU A 13 1.054 -16.245 1.843 1.00 1.00 H new ATOM 197 N LEU A 14 0.188 -11.060 3.241 1.00 1.00 N ATOM 198 CA LEU A 14 0.909 -9.802 3.100 1.00 1.00 C ATOM 199 C LEU A 14 2.362 -9.974 3.512 1.00 1.00 C ATOM 200 O LEU A 14 2.656 -10.604 4.524 1.00 1.00 O ATOM 201 CB LEU A 14 0.253 -8.719 3.965 1.00 1.00 C ATOM 202 CG LEU A 14 1.018 -7.396 3.811 1.00 1.00 C ATOM 203 CD1 LEU A 14 0.998 -6.953 2.337 1.00 1.00 C ATOM 204 CD2 LEU A 14 0.357 -6.327 4.677 1.00 1.00 C ATOM 0 H LEU A 14 0.308 -11.519 4.144 1.00 1.00 H new ATOM 0 HA LEU A 14 0.872 -9.498 2.054 1.00 1.00 H new ATOM 0 HB2 LEU A 14 -0.787 -8.585 3.669 1.00 1.00 H new ATOM 0 HB3 LEU A 14 0.249 -9.028 5.010 1.00 1.00 H new ATOM 0 HG LEU A 14 2.051 -7.535 4.128 1.00 1.00 H new ATOM 0 HD11 LEU A 14 1.542 -6.014 2.232 1.00 1.00 H new ATOM 0 HD12 LEU A 14 1.471 -7.717 1.721 1.00 1.00 H new ATOM 0 HD13 LEU A 14 -0.033 -6.813 2.013 1.00 1.00 H new ATOM 0 HD21 LEU A 14 0.898 -5.387 4.570 1.00 1.00 H new ATOM 0 HD22 LEU A 14 -0.677 -6.190 4.360 1.00 1.00 H new ATOM 0 HD23 LEU A 14 0.377 -6.640 5.721 1.00 1.00 H new ATOM 216 N ASP A 15 3.274 -9.407 2.720 1.00 1.00 N ATOM 217 CA ASP A 15 4.704 -9.499 3.011 1.00 1.00 C ATOM 218 C ASP A 15 5.308 -8.112 3.185 1.00 1.00 C ATOM 219 O ASP A 15 5.210 -7.266 2.299 1.00 1.00 O ATOM 220 CB ASP A 15 5.412 -10.224 1.871 1.00 1.00 C ATOM 221 CG ASP A 15 5.163 -9.502 0.552 1.00 1.00 C ATOM 222 OD1 ASP A 15 5.828 -9.833 -0.416 1.00 1.00 O ATOM 223 OD2 ASP A 15 4.309 -8.632 0.528 1.00 1.00 O ATOM 0 H ASP A 15 3.048 -8.881 1.876 1.00 1.00 H new ATOM 0 HA ASP A 15 4.835 -10.055 3.939 1.00 1.00 H new ATOM 0 HB2 ASP A 15 6.482 -10.273 2.071 1.00 1.00 H new ATOM 0 HB3 ASP A 15 5.053 -11.251 1.805 1.00 1.00 H new ATOM 229 N LEU A 16 5.938 -7.889 4.337 1.00 1.00 N ATOM 230 CA LEU A 16 6.572 -6.600 4.629 1.00 1.00 C ATOM 231 C LEU A 16 8.003 -6.800 5.097 1.00 1.00 C ATOM 232 O LEU A 16 8.340 -7.827 5.679 1.00 1.00 O ATOM 233 CB LEU A 16 5.774 -5.864 5.706 1.00 1.00 C ATOM 234 CG LEU A 16 4.417 -5.434 5.134 1.00 1.00 C ATOM 235 CD1 LEU A 16 3.505 -4.973 6.274 1.00 1.00 C ATOM 236 CD2 LEU A 16 4.607 -4.278 4.129 1.00 1.00 C ATOM 0 H LEU A 16 6.024 -8.580 5.082 1.00 1.00 H new ATOM 0 HA LEU A 16 6.586 -6.005 3.716 1.00 1.00 H new ATOM 0 HB2 LEU A 16 5.627 -6.511 6.571 1.00 1.00 H new ATOM 0 HB3 LEU A 16 6.328 -4.991 6.051 1.00 1.00 H new ATOM 0 HG LEU A 16 3.963 -6.282 4.620 1.00 1.00 H new ATOM 0 HD11 LEU A 16 2.541 -4.667 5.868 1.00 1.00 H new ATOM 0 HD12 LEU A 16 3.359 -5.793 6.977 1.00 1.00 H new ATOM 0 HD13 LEU A 16 3.965 -4.130 6.790 1.00 1.00 H new ATOM 0 HD21 LEU A 16 3.638 -3.981 3.729 1.00 1.00 H new ATOM 0 HD22 LEU A 16 5.067 -3.429 4.634 1.00 1.00 H new ATOM 0 HD23 LEU A 16 5.251 -4.607 3.313 1.00 1.00 H new ATOM 248 N SER A 17 8.844 -5.804 4.837 1.00 1.00 N ATOM 249 CA SER A 17 10.244 -5.875 5.237 1.00 1.00 C ATOM 250 C SER A 17 10.366 -5.861 6.760 1.00 1.00 C ATOM 251 O SER A 17 9.477 -5.377 7.460 1.00 1.00 O ATOM 252 CB SER A 17 11.014 -4.693 4.647 1.00 1.00 C ATOM 253 OG SER A 17 11.340 -4.973 3.293 1.00 1.00 O ATOM 0 H SER A 17 8.583 -4.944 4.355 1.00 1.00 H new ATOM 0 HA SER A 17 10.667 -6.806 4.860 1.00 1.00 H new ATOM 0 HB2 SER A 17 10.413 -3.786 4.708 1.00 1.00 H new ATOM 0 HB3 SER A 17 11.922 -4.513 5.222 1.00 1.00 H new ATOM 0 HG SER A 17 11.832 -4.216 2.912 1.00 1.00 H new ATOM 259 N ASN A 18 11.474 -6.397 7.262 1.00 1.00 N ATOM 260 CA ASN A 18 11.703 -6.443 8.701 1.00 1.00 C ATOM 261 C ASN A 18 11.747 -5.033 9.279 1.00 1.00 C ATOM 262 O ASN A 18 11.352 -4.810 10.422 1.00 1.00 O ATOM 263 CB ASN A 18 13.024 -7.160 8.996 1.00 1.00 C ATOM 264 CG ASN A 18 14.180 -6.423 8.328 1.00 1.00 C ATOM 265 OD1 ASN A 18 14.753 -5.504 8.913 1.00 1.00 O ATOM 266 ND2 ASN A 18 14.554 -6.769 7.126 1.00 1.00 N ATOM 0 H ASN A 18 12.222 -6.802 6.699 1.00 1.00 H new ATOM 0 HA ASN A 18 10.882 -6.989 9.165 1.00 1.00 H new ATOM 0 HB2 ASN A 18 13.188 -7.210 10.073 1.00 1.00 H new ATOM 0 HB3 ASN A 18 12.979 -8.187 8.633 1.00 1.00 H new ATOM 0 HD21 ASN A 18 15.323 -6.277 6.670 1.00 1.00 H new ATOM 0 HD22 ASN A 18 14.078 -7.531 6.643 1.00 1.00 H new ATOM 273 N GLU A 19 12.220 -4.084 8.480 1.00 1.00 N ATOM 274 CA GLU A 19 12.302 -2.696 8.923 1.00 1.00 C ATOM 275 C GLU A 19 10.912 -2.159 9.241 1.00 1.00 C ATOM 276 O GLU A 19 10.744 -1.362 10.161 1.00 1.00 O ATOM 277 CB GLU A 19 12.949 -1.838 7.832 1.00 1.00 C ATOM 278 CG GLU A 19 14.414 -2.248 7.658 1.00 1.00 C ATOM 279 CD GLU A 19 15.209 -1.896 8.910 1.00 1.00 C ATOM 280 OE1 GLU A 19 15.185 -0.739 9.297 1.00 1.00 O ATOM 281 OE2 GLU A 19 15.820 -2.790 9.472 1.00 1.00 O ATOM 0 H GLU A 19 12.551 -4.247 7.529 1.00 1.00 H new ATOM 0 HA GLU A 19 12.912 -2.653 9.825 1.00 1.00 H new ATOM 0 HB2 GLU A 19 12.412 -1.962 6.892 1.00 1.00 H new ATOM 0 HB3 GLU A 19 12.885 -0.783 8.099 1.00 1.00 H new ATOM 0 HG2 GLU A 19 14.480 -3.319 7.465 1.00 1.00 H new ATOM 0 HG3 GLU A 19 14.841 -1.742 6.792 1.00 1.00 H new ATOM 289 N VAL A 20 9.921 -2.601 8.479 1.00 1.00 N ATOM 290 CA VAL A 20 8.545 -2.161 8.698 1.00 1.00 C ATOM 291 C VAL A 20 8.017 -2.706 10.022 1.00 1.00 C ATOM 292 O VAL A 20 7.334 -2.000 10.763 1.00 1.00 O ATOM 293 CB VAL A 20 7.655 -2.641 7.544 1.00 1.00 C ATOM 294 CG1 VAL A 20 6.195 -2.304 7.850 1.00 1.00 C ATOM 295 CG2 VAL A 20 8.079 -1.946 6.249 1.00 1.00 C ATOM 0 H VAL A 20 10.040 -3.259 7.709 1.00 1.00 H new ATOM 0 HA VAL A 20 8.527 -1.072 8.737 1.00 1.00 H new ATOM 0 HB VAL A 20 7.761 -3.720 7.429 1.00 1.00 H new ATOM 0 HG11 VAL A 20 5.563 -2.645 7.030 1.00 1.00 H new ATOM 0 HG12 VAL A 20 5.892 -2.801 8.772 1.00 1.00 H new ATOM 0 HG13 VAL A 20 6.087 -1.226 7.967 1.00 1.00 H new ATOM 0 HG21 VAL A 20 7.447 -2.287 5.429 1.00 1.00 H new ATOM 0 HG22 VAL A 20 7.974 -0.867 6.364 1.00 1.00 H new ATOM 0 HG23 VAL A 20 9.119 -2.188 6.030 1.00 1.00 H new ATOM 305 N ILE A 21 8.324 -3.966 10.306 1.00 1.00 N ATOM 306 CA ILE A 21 7.865 -4.591 11.542 1.00 1.00 C ATOM 307 C ILE A 21 8.276 -3.744 12.738 1.00 1.00 C ATOM 308 O ILE A 21 7.499 -3.560 13.674 1.00 1.00 O ATOM 309 CB ILE A 21 8.467 -5.997 11.667 1.00 1.00 C ATOM 310 CG1 ILE A 21 8.141 -6.804 10.406 1.00 1.00 C ATOM 311 CG2 ILE A 21 7.874 -6.700 12.891 1.00 1.00 C ATOM 312 CD1 ILE A 21 8.756 -8.201 10.521 1.00 1.00 C ATOM 0 H ILE A 21 8.883 -4.571 9.704 1.00 1.00 H new ATOM 0 HA ILE A 21 6.778 -4.667 11.520 1.00 1.00 H new ATOM 0 HB ILE A 21 9.548 -5.921 11.781 1.00 1.00 H new ATOM 0 HG12 ILE A 21 7.061 -6.880 10.279 1.00 1.00 H new ATOM 0 HG13 ILE A 21 8.531 -6.295 9.525 1.00 1.00 H new ATOM 0 HG21 ILE A 21 8.302 -7.699 12.980 1.00 1.00 H new ATOM 0 HG22 ILE A 21 8.105 -6.125 13.788 1.00 1.00 H new ATOM 0 HG23 ILE A 21 6.793 -6.777 12.778 1.00 1.00 H new ATOM 0 HD11 ILE A 21 8.524 -8.775 9.624 1.00 1.00 H new ATOM 0 HD12 ILE A 21 9.837 -8.115 10.627 1.00 1.00 H new ATOM 0 HD13 ILE A 21 8.345 -8.709 11.393 1.00 1.00 H new ATOM 324 N LYS A 22 9.501 -3.227 12.703 1.00 1.00 N ATOM 325 CA LYS A 22 9.992 -2.391 13.790 1.00 1.00 C ATOM 326 C LYS A 22 9.154 -1.123 13.901 1.00 1.00 C ATOM 327 O LYS A 22 8.872 -0.645 14.999 1.00 1.00 O ATOM 328 CB LYS A 22 11.454 -2.023 13.540 1.00 1.00 C ATOM 329 CG LYS A 22 12.006 -1.271 14.755 1.00 1.00 C ATOM 330 CD LYS A 22 13.471 -0.888 14.502 1.00 1.00 C ATOM 331 CE LYS A 22 14.375 -2.107 14.713 1.00 1.00 C ATOM 332 NZ LYS A 22 15.794 -1.670 14.748 1.00 1.00 N ATOM 0 H LYS A 22 10.164 -3.371 11.942 1.00 1.00 H new ATOM 0 HA LYS A 22 9.914 -2.948 14.724 1.00 1.00 H new ATOM 0 HB2 LYS A 22 12.041 -2.923 13.359 1.00 1.00 H new ATOM 0 HB3 LYS A 22 11.537 -1.403 12.647 1.00 1.00 H new ATOM 0 HG2 LYS A 22 11.413 -0.376 14.942 1.00 1.00 H new ATOM 0 HG3 LYS A 22 11.931 -1.894 15.646 1.00 1.00 H new ATOM 0 HD2 LYS A 22 13.587 -0.511 13.486 1.00 1.00 H new ATOM 0 HD3 LYS A 22 13.767 -0.084 15.176 1.00 1.00 H new ATOM 0 HE2 LYS A 22 14.115 -2.609 15.645 1.00 1.00 H new ATOM 0 HE3 LYS A 22 14.225 -2.828 13.909 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 16.408 -2.497 14.891 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 16.038 -1.209 13.848 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 15.931 -0.997 15.529 1.00 1.00 H new ATOM 346 N GLN A 23 8.751 -0.579 12.751 1.00 1.00 N ATOM 347 CA GLN A 23 7.938 0.632 12.734 1.00 1.00 C ATOM 348 C GLN A 23 6.569 0.356 13.345 1.00 1.00 C ATOM 349 O GLN A 23 6.102 1.094 14.206 1.00 1.00 O ATOM 350 CB GLN A 23 7.771 1.116 11.293 1.00 1.00 C ATOM 351 CG GLN A 23 9.129 1.477 10.709 1.00 1.00 C ATOM 352 CD GLN A 23 9.004 1.767 9.220 1.00 1.00 C ATOM 353 OE1 GLN A 23 7.916 1.668 8.660 1.00 1.00 O ATOM 354 NE2 GLN A 23 10.059 2.127 8.542 1.00 1.00 N ATOM 0 H GLN A 23 8.973 -0.955 11.829 1.00 1.00 H new ATOM 0 HA GLN A 23 8.437 1.403 13.322 1.00 1.00 H new ATOM 0 HB2 GLN A 23 7.301 0.338 10.691 1.00 1.00 H new ATOM 0 HB3 GLN A 23 7.111 1.983 11.265 1.00 1.00 H new ATOM 0 HG2 GLN A 23 9.533 2.349 11.223 1.00 1.00 H new ATOM 0 HG3 GLN A 23 9.831 0.658 10.869 1.00 1.00 H new ATOM 0 HE21 GLN A 23 10.962 2.209 9.009 1.00 1.00 H new ATOM 0 HE22 GLN A 23 9.981 2.327 7.545 1.00 1.00 H new ATOM 363 N LEU A 24 5.932 -0.718 12.895 1.00 1.00 N ATOM 364 CA LEU A 24 4.614 -1.085 13.405 1.00 1.00 C ATOM 365 C LEU A 24 4.670 -1.345 14.901 1.00 1.00 C ATOM 366 O LEU A 24 3.747 -0.990 15.636 1.00 1.00 O ATOM 367 CB LEU A 24 4.109 -2.340 12.685 1.00 1.00 C ATOM 368 CG LEU A 24 3.789 -2.002 11.223 1.00 1.00 C ATOM 369 CD1 LEU A 24 3.615 -3.299 10.426 1.00 1.00 C ATOM 370 CD2 LEU A 24 2.491 -1.174 11.141 1.00 1.00 C ATOM 0 H LEU A 24 6.302 -1.347 12.183 1.00 1.00 H new ATOM 0 HA LEU A 24 3.930 -0.257 13.220 1.00 1.00 H new ATOM 0 HB2 LEU A 24 4.863 -3.126 12.730 1.00 1.00 H new ATOM 0 HB3 LEU A 24 3.219 -2.724 13.183 1.00 1.00 H new ATOM 0 HG LEU A 24 4.610 -1.419 10.806 1.00 1.00 H new ATOM 0 HD11 LEU A 24 3.388 -3.060 9.387 1.00 1.00 H new ATOM 0 HD12 LEU A 24 4.536 -3.880 10.471 1.00 1.00 H new ATOM 0 HD13 LEU A 24 2.797 -3.881 10.852 1.00 1.00 H new ATOM 0 HD21 LEU A 24 2.274 -0.940 10.099 1.00 1.00 H new ATOM 0 HD22 LEU A 24 1.666 -1.748 11.563 1.00 1.00 H new ATOM 0 HD23 LEU A 24 2.614 -0.248 11.703 1.00 1.00 H new ATOM 382 N ASP A 25 5.749 -1.972 15.345 1.00 1.00 N ATOM 383 CA ASP A 25 5.911 -2.283 16.758 1.00 1.00 C ATOM 384 C ASP A 25 5.776 -1.019 17.604 1.00 1.00 C ATOM 385 O ASP A 25 5.084 -1.014 18.621 1.00 1.00 O ATOM 386 CB ASP A 25 7.285 -2.910 17.001 1.00 1.00 C ATOM 387 CG ASP A 25 7.351 -3.495 18.408 1.00 1.00 C ATOM 388 OD1 ASP A 25 6.307 -3.621 19.025 1.00 1.00 O ATOM 389 OD2 ASP A 25 8.445 -3.810 18.847 1.00 1.00 O ATOM 0 H ASP A 25 6.522 -2.274 14.752 1.00 1.00 H new ATOM 0 HA ASP A 25 5.131 -2.988 17.046 1.00 1.00 H new ATOM 0 HB2 ASP A 25 7.473 -3.691 16.264 1.00 1.00 H new ATOM 0 HB3 ASP A 25 8.064 -2.158 16.874 1.00 1.00 H new ATOM 395 N ASP A 26 6.439 0.049 17.179 1.00 1.00 N ATOM 396 CA ASP A 26 6.386 1.310 17.910 1.00 1.00 C ATOM 397 C ASP A 26 4.951 1.829 17.986 1.00 1.00 C ATOM 398 O ASP A 26 4.498 2.274 19.039 1.00 1.00 O ATOM 399 CB ASP A 26 7.269 2.349 17.219 1.00 1.00 C ATOM 400 CG ASP A 26 7.473 3.552 18.135 1.00 1.00 C ATOM 401 OD1 ASP A 26 7.847 4.598 17.632 1.00 1.00 O ATOM 402 OD2 ASP A 26 7.253 3.410 19.326 1.00 1.00 O ATOM 0 H ASP A 26 7.016 0.069 16.338 1.00 1.00 H new ATOM 0 HA ASP A 26 6.750 1.137 18.922 1.00 1.00 H new ATOM 0 HB2 ASP A 26 8.233 1.908 16.964 1.00 1.00 H new ATOM 0 HB3 ASP A 26 6.807 2.667 16.284 1.00 1.00 H new ATOM 408 N LEU A 27 4.241 1.763 16.867 1.00 1.00 N ATOM 409 CA LEU A 27 2.861 2.214 16.821 1.00 1.00 C ATOM 410 C LEU A 27 1.942 1.221 17.513 1.00 1.00 C ATOM 411 O LEU A 27 0.883 1.593 18.025 1.00 1.00 O ATOM 412 CB LEU A 27 2.423 2.404 15.357 1.00 1.00 C ATOM 413 CG LEU A 27 2.870 3.776 14.857 1.00 1.00 C ATOM 414 CD1 LEU A 27 4.393 3.846 14.825 1.00 1.00 C ATOM 415 CD2 LEU A 27 2.316 4.009 13.451 1.00 1.00 C ATOM 0 H LEU A 27 4.599 1.402 15.983 1.00 1.00 H new ATOM 0 HA LEU A 27 2.792 3.166 17.346 1.00 1.00 H new ATOM 0 HB2 LEU A 27 2.855 1.621 14.734 1.00 1.00 H new ATOM 0 HB3 LEU A 27 1.340 2.313 15.277 1.00 1.00 H new ATOM 0 HG LEU A 27 2.492 4.545 15.531 1.00 1.00 H new ATOM 0 HD11 LEU A 27 4.705 4.827 14.467 1.00 1.00 H new ATOM 0 HD12 LEU A 27 4.786 3.684 15.829 1.00 1.00 H new ATOM 0 HD13 LEU A 27 4.779 3.077 14.156 1.00 1.00 H new ATOM 0 HD21 LEU A 27 2.634 4.988 13.092 1.00 1.00 H new ATOM 0 HD22 LEU A 27 2.691 3.237 12.779 1.00 1.00 H new ATOM 0 HD23 LEU A 27 1.227 3.968 13.478 1.00 1.00 H new ATOM 427 N GLU A 28 2.334 -0.043 17.505 1.00 1.00 N ATOM 428 CA GLU A 28 1.529 -1.083 18.126 1.00 1.00 C ATOM 429 C GLU A 28 1.664 -1.039 19.643 1.00 1.00 C ATOM 430 O GLU A 28 0.683 -1.203 20.370 1.00 1.00 O ATOM 431 CB GLU A 28 1.963 -2.456 17.602 1.00 1.00 C ATOM 432 CG GLU A 28 1.106 -3.550 18.254 1.00 1.00 C ATOM 433 CD GLU A 28 1.654 -3.909 19.636 1.00 1.00 C ATOM 434 OE1 GLU A 28 2.705 -3.403 19.988 1.00 1.00 O ATOM 435 OE2 GLU A 28 1.010 -4.680 20.323 1.00 1.00 O ATOM 0 H GLU A 28 3.200 -0.373 17.078 1.00 1.00 H new ATOM 0 HA GLU A 28 0.484 -0.911 17.870 1.00 1.00 H new ATOM 0 HB2 GLU A 28 1.856 -2.493 16.518 1.00 1.00 H new ATOM 0 HB3 GLU A 28 3.017 -2.625 17.824 1.00 1.00 H new ATOM 0 HG2 GLU A 28 0.075 -3.207 18.343 1.00 1.00 H new ATOM 0 HG3 GLU A 28 1.094 -4.436 17.620 1.00 1.00 H new ATOM 443 N VAL A 29 2.888 -0.840 20.113 1.00 1.00 N ATOM 444 CA VAL A 29 3.142 -0.795 21.549 1.00 1.00 C ATOM 445 C VAL A 29 2.472 0.422 22.176 1.00 1.00 C ATOM 446 O VAL A 29 1.739 0.305 23.157 1.00 1.00 O ATOM 447 CB VAL A 29 4.651 -0.739 21.812 1.00 1.00 C ATOM 448 CG1 VAL A 29 4.907 -0.463 23.299 1.00 1.00 C ATOM 449 CG2 VAL A 29 5.290 -2.077 21.424 1.00 1.00 C ATOM 0 H VAL A 29 3.714 -0.708 19.529 1.00 1.00 H new ATOM 0 HA VAL A 29 2.726 -1.697 21.999 1.00 1.00 H new ATOM 0 HB VAL A 29 5.090 0.060 21.215 1.00 1.00 H new ATOM 0 HG11 VAL A 29 5.981 -0.424 23.482 1.00 1.00 H new ATOM 0 HG12 VAL A 29 4.457 0.491 23.575 1.00 1.00 H new ATOM 0 HG13 VAL A 29 4.465 -1.259 23.898 1.00 1.00 H new ATOM 0 HG21 VAL A 29 6.363 -2.036 21.612 1.00 1.00 H new ATOM 0 HG22 VAL A 29 4.848 -2.877 22.018 1.00 1.00 H new ATOM 0 HG23 VAL A 29 5.114 -2.271 20.366 1.00 1.00 H new ATOM 459 N GLN A 30 2.726 1.590 21.599 1.00 1.00 N ATOM 460 CA GLN A 30 2.147 2.824 22.115 1.00 1.00 C ATOM 461 C GLN A 30 0.636 2.687 22.255 1.00 1.00 C ATOM 462 O GLN A 30 0.064 3.068 23.276 1.00 1.00 O ATOM 463 CB GLN A 30 2.466 3.983 21.168 1.00 1.00 C ATOM 464 CG GLN A 30 3.953 4.331 21.261 1.00 1.00 C ATOM 465 CD GLN A 30 4.264 4.943 22.623 1.00 1.00 C ATOM 466 OE1 GLN A 30 3.691 5.969 22.988 1.00 1.00 O ATOM 467 NE2 GLN A 30 5.132 4.363 23.406 1.00 1.00 N ATOM 0 H GLN A 30 3.324 1.709 20.781 1.00 1.00 H new ATOM 0 HA GLN A 30 2.577 3.024 23.096 1.00 1.00 H new ATOM 0 HB2 GLN A 30 2.210 3.710 20.144 1.00 1.00 H new ATOM 0 HB3 GLN A 30 1.862 4.853 21.426 1.00 1.00 H new ATOM 0 HG2 GLN A 30 4.554 3.434 21.111 1.00 1.00 H new ATOM 0 HG3 GLN A 30 4.221 5.031 20.469 1.00 1.00 H new ATOM 0 HE21 GLN A 30 5.606 3.513 23.101 1.00 1.00 H new ATOM 0 HE22 GLN A 30 5.337 4.760 24.323 1.00 1.00 H new ATOM 476 N ARG A 31 -0.004 2.144 21.224 1.00 1.00 N ATOM 477 CA ARG A 31 -1.450 1.964 21.244 1.00 1.00 C ATOM 478 C ARG A 31 -1.827 0.699 22.010 1.00 1.00 C ATOM 479 O ARG A 31 -2.876 0.639 22.649 1.00 1.00 O ATOM 480 CB ARG A 31 -1.989 1.885 19.817 1.00 1.00 C ATOM 481 CG ARG A 31 -1.668 3.188 19.081 1.00 1.00 C ATOM 482 CD ARG A 31 -2.282 3.151 17.681 1.00 1.00 C ATOM 483 NE ARG A 31 -3.738 3.238 17.770 1.00 1.00 N ATOM 484 CZ ARG A 31 -4.349 4.408 17.908 1.00 1.00 C ATOM 485 NH1 ARG A 31 -3.647 5.505 17.969 1.00 1.00 N ATOM 486 NH2 ARG A 31 -5.650 4.460 17.984 1.00 1.00 N ATOM 0 H ARG A 31 0.453 1.823 20.370 1.00 1.00 H new ATOM 0 HA ARG A 31 -1.894 2.822 21.749 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -1.543 1.039 19.294 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -3.066 1.718 19.832 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -2.060 4.039 19.639 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -0.588 3.322 19.012 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -1.896 3.977 17.084 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -1.995 2.230 17.174 1.00 1.00 H new ATOM 0 HE ARG A 31 -4.295 2.384 17.725 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -2.630 5.463 17.911 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -4.115 6.405 18.075 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -6.198 3.601 17.937 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -6.119 5.359 18.090 1.00 1.00 H new ATOM 500 N ASN A 32 -0.967 -0.310 21.931 1.00 1.00 N ATOM 501 CA ASN A 32 -1.218 -1.574 22.614 1.00 1.00 C ATOM 502 C ASN A 32 -2.469 -2.247 22.068 1.00 1.00 C ATOM 503 O ASN A 32 -3.469 -2.391 22.772 1.00 1.00 O ATOM 504 CB ASN A 32 -1.382 -1.332 24.116 1.00 1.00 C ATOM 505 CG ASN A 32 -1.212 -2.642 24.876 1.00 1.00 C ATOM 506 OD1 ASN A 32 -0.611 -3.587 24.364 1.00 1.00 O ATOM 507 ND2 ASN A 32 -1.704 -2.756 26.078 1.00 1.00 N ATOM 0 H ASN A 32 -0.094 -0.278 21.404 1.00 1.00 H new ATOM 0 HA ASN A 32 -0.365 -2.230 22.440 1.00 1.00 H new ATOM 0 HB2 ASN A 32 -0.645 -0.605 24.458 1.00 1.00 H new ATOM 0 HB3 ASN A 32 -2.366 -0.909 24.319 1.00 1.00 H new ATOM 0 HD21 ASN A 32 -1.591 -3.628 26.595 1.00 1.00 H new ATOM 0 HD22 ASN A 32 -2.202 -1.973 26.502 1.00 1.00 H new ATOM 514 N LEU A 33 -2.410 -2.645 20.806 1.00 1.00 N ATOM 515 CA LEU A 33 -3.552 -3.294 20.169 1.00 1.00 C ATOM 516 C LEU A 33 -3.084 -4.267 19.093 1.00 1.00 C ATOM 517 O LEU A 33 -1.980 -4.161 18.575 1.00 1.00 O ATOM 518 CB LEU A 33 -4.487 -2.230 19.541 1.00 1.00 C ATOM 519 CG LEU A 33 -3.681 -0.988 19.177 1.00 1.00 C ATOM 520 CD1 LEU A 33 -2.604 -1.361 18.148 1.00 1.00 C ATOM 521 CD2 LEU A 33 -4.619 0.060 18.580 1.00 1.00 C ATOM 0 H LEU A 33 -1.593 -2.533 20.205 1.00 1.00 H new ATOM 0 HA LEU A 33 -4.100 -3.850 20.930 1.00 1.00 H new ATOM 0 HB2 LEU A 33 -4.970 -2.636 18.652 1.00 1.00 H new ATOM 0 HB3 LEU A 33 -5.279 -1.969 20.243 1.00 1.00 H new ATOM 0 HG LEU A 33 -3.202 -0.585 20.069 1.00 1.00 H new ATOM 0 HD11 LEU A 33 -2.027 -0.474 17.887 1.00 1.00 H new ATOM 0 HD12 LEU A 33 -1.940 -2.114 18.573 1.00 1.00 H new ATOM 0 HD13 LEU A 33 -3.079 -1.761 17.252 1.00 1.00 H new ATOM 0 HD21 LEU A 33 -4.049 0.951 18.317 1.00 1.00 H new ATOM 0 HD22 LEU A 33 -5.094 -0.344 17.686 1.00 1.00 H new ATOM 0 HD23 LEU A 33 -5.385 0.321 19.310 1.00 1.00 H new ATOM 533 N PRO A 34 -3.915 -5.201 18.735 1.00 1.00 N ATOM 534 CA PRO A 34 -3.587 -6.216 17.687 1.00 1.00 C ATOM 535 C PRO A 34 -3.224 -5.569 16.351 1.00 1.00 C ATOM 536 O PRO A 34 -3.823 -4.574 15.948 1.00 1.00 O ATOM 537 CB PRO A 34 -4.883 -7.051 17.561 1.00 1.00 C ATOM 538 CG PRO A 34 -5.950 -6.222 18.204 1.00 1.00 C ATOM 539 CD PRO A 34 -5.266 -5.415 19.288 1.00 1.00 C ATOM 0 HA PRO A 34 -2.716 -6.813 17.958 1.00 1.00 H new ATOM 0 HB2 PRO A 34 -5.119 -7.255 16.517 1.00 1.00 H new ATOM 0 HB3 PRO A 34 -4.780 -8.015 18.059 1.00 1.00 H new ATOM 0 HG2 PRO A 34 -6.427 -5.567 17.474 1.00 1.00 H new ATOM 0 HG3 PRO A 34 -6.732 -6.854 18.625 1.00 1.00 H new ATOM 0 HD2 PRO A 34 -5.780 -4.472 19.475 1.00 1.00 H new ATOM 0 HD3 PRO A 34 -5.235 -5.954 20.235 1.00 1.00 H new ATOM 547 N ARG A 35 -2.242 -6.151 15.669 1.00 1.00 N ATOM 548 CA ARG A 35 -1.810 -5.627 14.379 1.00 1.00 C ATOM 549 C ARG A 35 -2.954 -5.670 13.377 1.00 1.00 C ATOM 550 O ARG A 35 -3.178 -4.717 12.633 1.00 1.00 O ATOM 551 CB ARG A 35 -0.636 -6.455 13.851 1.00 1.00 C ATOM 552 CG ARG A 35 -0.116 -5.833 12.555 1.00 1.00 C ATOM 553 CD ARG A 35 1.147 -6.568 12.105 1.00 1.00 C ATOM 554 NE ARG A 35 2.219 -6.366 13.072 1.00 1.00 N ATOM 555 CZ ARG A 35 3.378 -7.006 12.958 1.00 1.00 C ATOM 556 NH1 ARG A 35 3.571 -7.833 11.967 1.00 1.00 N ATOM 557 NH2 ARG A 35 4.322 -6.809 13.838 1.00 1.00 N ATOM 0 H ARG A 35 -1.735 -6.978 15.985 1.00 1.00 H new ATOM 0 HA ARG A 35 -1.496 -4.592 14.511 1.00 1.00 H new ATOM 0 HB2 ARG A 35 0.160 -6.492 14.594 1.00 1.00 H new ATOM 0 HB3 ARG A 35 -0.953 -7.482 13.672 1.00 1.00 H new ATOM 0 HG2 ARG A 35 -0.879 -5.892 11.779 1.00 1.00 H new ATOM 0 HG3 ARG A 35 0.101 -4.776 12.708 1.00 1.00 H new ATOM 0 HD2 ARG A 35 0.939 -7.633 11.999 1.00 1.00 H new ATOM 0 HD3 ARG A 35 1.458 -6.205 11.125 1.00 1.00 H new ATOM 0 HE ARG A 35 2.077 -5.722 13.850 1.00 1.00 H new ATOM 0 HH11 ARG A 35 2.832 -7.988 11.281 1.00 1.00 H new ATOM 0 HH12 ARG A 35 4.460 -8.325 11.879 1.00 1.00 H new ATOM 0 HH21 ARG A 35 4.170 -6.164 14.613 1.00 1.00 H new ATOM 0 HH22 ARG A 35 5.212 -7.300 13.750 1.00 1.00 H new ATOM 571 N ALA A 36 -3.679 -6.782 13.357 1.00 1.00 N ATOM 572 CA ALA A 36 -4.797 -6.934 12.425 1.00 1.00 C ATOM 573 C ALA A 36 -5.679 -5.692 12.451 1.00 1.00 C ATOM 574 O ALA A 36 -6.122 -5.215 11.405 1.00 1.00 O ATOM 575 CB ALA A 36 -5.632 -8.156 12.818 1.00 1.00 C ATOM 0 H ALA A 36 -3.518 -7.584 13.966 1.00 1.00 H new ATOM 0 HA ALA A 36 -4.399 -7.068 11.419 1.00 1.00 H new ATOM 0 HB1 ALA A 36 -6.464 -8.267 12.123 1.00 1.00 H new ATOM 0 HB2 ALA A 36 -5.008 -9.049 12.783 1.00 1.00 H new ATOM 0 HB3 ALA A 36 -6.019 -8.023 13.828 1.00 1.00 H new ATOM 581 N ASP A 37 -5.913 -5.159 13.647 1.00 1.00 N ATOM 582 CA ASP A 37 -6.728 -3.957 13.785 1.00 1.00 C ATOM 583 C ASP A 37 -6.065 -2.773 13.086 1.00 1.00 C ATOM 584 O ASP A 37 -6.734 -1.962 12.446 1.00 1.00 O ATOM 585 CB ASP A 37 -6.927 -3.632 15.266 1.00 1.00 C ATOM 586 CG ASP A 37 -7.670 -2.308 15.416 1.00 1.00 C ATOM 587 OD1 ASP A 37 -7.775 -1.834 16.536 1.00 1.00 O ATOM 588 OD2 ASP A 37 -8.113 -1.783 14.408 1.00 1.00 O ATOM 0 H ASP A 37 -5.554 -5.535 14.525 1.00 1.00 H new ATOM 0 HA ASP A 37 -7.696 -4.141 13.319 1.00 1.00 H new ATOM 0 HB2 ASP A 37 -7.490 -4.431 15.749 1.00 1.00 H new ATOM 0 HB3 ASP A 37 -5.961 -3.575 15.767 1.00 1.00 H new ATOM 594 N LEU A 38 -4.746 -2.681 13.209 1.00 1.00 N ATOM 595 CA LEU A 38 -4.005 -1.596 12.580 1.00 1.00 C ATOM 596 C LEU A 38 -4.093 -1.686 11.064 1.00 1.00 C ATOM 597 O LEU A 38 -4.285 -0.675 10.385 1.00 1.00 O ATOM 598 CB LEU A 38 -2.536 -1.650 13.015 1.00 1.00 C ATOM 599 CG LEU A 38 -2.424 -1.300 14.503 1.00 1.00 C ATOM 600 CD1 LEU A 38 -0.984 -1.522 14.975 1.00 1.00 C ATOM 601 CD2 LEU A 38 -2.822 0.176 14.729 1.00 1.00 C ATOM 0 H LEU A 38 -4.172 -3.340 13.735 1.00 1.00 H new ATOM 0 HA LEU A 38 -4.446 -0.651 12.896 1.00 1.00 H new ATOM 0 HB2 LEU A 38 -2.130 -2.645 12.834 1.00 1.00 H new ATOM 0 HB3 LEU A 38 -1.945 -0.952 12.422 1.00 1.00 H new ATOM 0 HG LEU A 38 -3.096 -1.942 15.073 1.00 1.00 H new ATOM 0 HD11 LEU A 38 -0.905 -1.273 16.033 1.00 1.00 H new ATOM 0 HD12 LEU A 38 -0.709 -2.566 14.827 1.00 1.00 H new ATOM 0 HD13 LEU A 38 -0.311 -0.885 14.401 1.00 1.00 H new ATOM 0 HD21 LEU A 38 -2.740 0.417 15.789 1.00 1.00 H new ATOM 0 HD22 LEU A 38 -2.158 0.824 14.157 1.00 1.00 H new ATOM 0 HD23 LEU A 38 -3.850 0.330 14.401 1.00 1.00 H new ATOM 613 N LEU A 39 -3.945 -2.895 10.539 1.00 1.00 N ATOM 614 CA LEU A 39 -4.003 -3.099 9.097 1.00 1.00 C ATOM 615 C LEU A 39 -5.372 -2.721 8.553 1.00 1.00 C ATOM 616 O LEU A 39 -5.478 -2.002 7.560 1.00 1.00 O ATOM 617 CB LEU A 39 -3.712 -4.569 8.774 1.00 1.00 C ATOM 618 CG LEU A 39 -2.247 -4.885 9.096 1.00 1.00 C ATOM 619 CD1 LEU A 39 -2.029 -6.398 9.043 1.00 1.00 C ATOM 620 CD2 LEU A 39 -1.319 -4.195 8.075 1.00 1.00 C ATOM 0 H LEU A 39 -3.785 -3.742 11.084 1.00 1.00 H new ATOM 0 HA LEU A 39 -3.254 -2.462 8.627 1.00 1.00 H new ATOM 0 HB2 LEU A 39 -4.370 -5.216 9.353 1.00 1.00 H new ATOM 0 HB3 LEU A 39 -3.915 -4.768 7.722 1.00 1.00 H new ATOM 0 HG LEU A 39 -2.014 -4.515 10.095 1.00 1.00 H new ATOM 0 HD11 LEU A 39 -0.987 -6.624 9.272 1.00 1.00 H new ATOM 0 HD12 LEU A 39 -2.675 -6.884 9.774 1.00 1.00 H new ATOM 0 HD13 LEU A 39 -2.269 -6.765 8.045 1.00 1.00 H new ATOM 0 HD21 LEU A 39 -0.281 -4.426 8.313 1.00 1.00 H new ATOM 0 HD22 LEU A 39 -1.550 -4.554 7.072 1.00 1.00 H new ATOM 0 HD23 LEU A 39 -1.470 -3.116 8.117 1.00 1.00 H new ATOM 632 N ARG A 40 -6.418 -3.207 9.210 1.00 1.00 N ATOM 633 CA ARG A 40 -7.780 -2.912 8.781 1.00 1.00 C ATOM 634 C ARG A 40 -8.018 -1.407 8.759 1.00 1.00 C ATOM 635 O ARG A 40 -8.602 -0.877 7.814 1.00 1.00 O ATOM 636 CB ARG A 40 -8.781 -3.575 9.730 1.00 1.00 C ATOM 637 CG ARG A 40 -10.205 -3.303 9.242 1.00 1.00 C ATOM 638 CD ARG A 40 -11.194 -4.094 10.098 1.00 1.00 C ATOM 639 NE ARG A 40 -11.151 -3.633 11.480 1.00 1.00 N ATOM 640 CZ ARG A 40 -11.685 -4.353 12.462 1.00 1.00 C ATOM 641 NH1 ARG A 40 -12.257 -5.496 12.196 1.00 1.00 N ATOM 642 NH2 ARG A 40 -11.632 -3.921 13.692 1.00 1.00 N ATOM 0 H ARG A 40 -6.351 -3.802 10.035 1.00 1.00 H new ATOM 0 HA ARG A 40 -7.919 -3.306 7.774 1.00 1.00 H new ATOM 0 HB2 ARG A 40 -8.600 -4.649 9.775 1.00 1.00 H new ATOM 0 HB3 ARG A 40 -8.651 -3.188 10.741 1.00 1.00 H new ATOM 0 HG2 ARG A 40 -10.425 -2.237 9.303 1.00 1.00 H new ATOM 0 HG3 ARG A 40 -10.303 -3.589 8.195 1.00 1.00 H new ATOM 0 HD2 ARG A 40 -12.202 -3.979 9.701 1.00 1.00 H new ATOM 0 HD3 ARG A 40 -10.954 -5.156 10.055 1.00 1.00 H new ATOM 0 HE ARG A 40 -10.704 -2.743 11.698 1.00 1.00 H new ATOM 0 HH11 ARG A 40 -12.294 -5.836 11.235 1.00 1.00 H new ATOM 0 HH12 ARG A 40 -12.667 -6.049 12.949 1.00 1.00 H new ATOM 0 HH21 ARG A 40 -11.181 -3.030 13.901 1.00 1.00 H new ATOM 0 HH22 ARG A 40 -12.042 -4.474 14.445 1.00 1.00 H new ATOM 656 N GLU A 41 -7.558 -0.725 9.800 1.00 1.00 N ATOM 657 CA GLU A 41 -7.724 0.722 9.884 1.00 1.00 C ATOM 658 C GLU A 41 -6.894 1.422 8.812 1.00 1.00 C ATOM 659 O GLU A 41 -7.342 2.399 8.210 1.00 1.00 O ATOM 660 CB GLU A 41 -7.298 1.217 11.268 1.00 1.00 C ATOM 661 CG GLU A 41 -8.318 0.759 12.311 1.00 1.00 C ATOM 662 CD GLU A 41 -7.865 1.179 13.705 1.00 1.00 C ATOM 663 OE1 GLU A 41 -6.814 1.792 13.804 1.00 1.00 O ATOM 664 OE2 GLU A 41 -8.575 0.884 14.651 1.00 1.00 O ATOM 0 H GLU A 41 -7.071 -1.145 10.592 1.00 1.00 H new ATOM 0 HA GLU A 41 -8.776 0.958 9.722 1.00 1.00 H new ATOM 0 HB2 GLU A 41 -6.310 0.830 11.516 1.00 1.00 H new ATOM 0 HB3 GLU A 41 -7.224 2.304 11.270 1.00 1.00 H new ATOM 0 HG2 GLU A 41 -9.294 1.192 12.091 1.00 1.00 H new ATOM 0 HG3 GLU A 41 -8.433 -0.324 12.268 1.00 1.00 H new ATOM 672 N ALA A 42 -5.686 0.919 8.578 1.00 1.00 N ATOM 673 CA ALA A 42 -4.809 1.509 7.574 1.00 1.00 C ATOM 674 C ALA A 42 -5.476 1.477 6.205 1.00 1.00 C ATOM 675 O ALA A 42 -5.485 2.478 5.487 1.00 1.00 O ATOM 676 CB ALA A 42 -3.486 0.736 7.523 1.00 1.00 C ATOM 0 H ALA A 42 -5.295 0.112 9.065 1.00 1.00 H new ATOM 0 HA ALA A 42 -4.612 2.546 7.845 1.00 1.00 H new ATOM 0 HB1 ALA A 42 -2.834 1.180 6.771 1.00 1.00 H new ATOM 0 HB2 ALA A 42 -3.000 0.782 8.498 1.00 1.00 H new ATOM 0 HB3 ALA A 42 -3.682 -0.304 7.264 1.00 1.00 H new ATOM 682 N VAL A 43 -6.040 0.323 5.846 1.00 1.00 N ATOM 683 CA VAL A 43 -6.716 0.187 4.563 1.00 1.00 C ATOM 684 C VAL A 43 -8.000 1.016 4.554 1.00 1.00 C ATOM 685 O VAL A 43 -8.231 1.805 3.639 1.00 1.00 O ATOM 686 CB VAL A 43 -7.041 -1.287 4.301 1.00 1.00 C ATOM 687 CG1 VAL A 43 -7.857 -1.411 3.014 1.00 1.00 C ATOM 688 CG2 VAL A 43 -5.737 -2.075 4.156 1.00 1.00 C ATOM 0 H VAL A 43 -6.041 -0.520 6.421 1.00 1.00 H new ATOM 0 HA VAL A 43 -6.058 0.552 3.775 1.00 1.00 H new ATOM 0 HB VAL A 43 -7.619 -1.686 5.135 1.00 1.00 H new ATOM 0 HG11 VAL A 43 -8.087 -2.460 2.829 1.00 1.00 H new ATOM 0 HG12 VAL A 43 -8.785 -0.848 3.116 1.00 1.00 H new ATOM 0 HG13 VAL A 43 -7.281 -1.013 2.178 1.00 1.00 H new ATOM 0 HG21 VAL A 43 -5.965 -3.124 3.969 1.00 1.00 H new ATOM 0 HG22 VAL A 43 -5.161 -1.675 3.322 1.00 1.00 H new ATOM 0 HG23 VAL A 43 -5.155 -1.988 5.074 1.00 1.00 H new ATOM 698 N ASP A 44 -8.835 0.823 5.573 1.00 1.00 N ATOM 699 CA ASP A 44 -10.092 1.552 5.661 1.00 1.00 C ATOM 700 C ASP A 44 -9.832 3.043 5.536 1.00 1.00 C ATOM 701 O ASP A 44 -10.489 3.729 4.759 1.00 1.00 O ATOM 702 CB ASP A 44 -10.759 1.248 7.010 1.00 1.00 C ATOM 703 CG ASP A 44 -11.519 -0.076 6.947 1.00 1.00 C ATOM 704 OD1 ASP A 44 -12.008 -0.500 7.979 1.00 1.00 O ATOM 705 OD2 ASP A 44 -11.595 -0.646 5.874 1.00 1.00 O ATOM 0 H ASP A 44 -8.664 0.174 6.341 1.00 1.00 H new ATOM 0 HA ASP A 44 -10.752 1.241 4.852 1.00 1.00 H new ATOM 0 HB2 ASP A 44 -10.003 1.203 7.794 1.00 1.00 H new ATOM 0 HB3 ASP A 44 -11.443 2.054 7.274 1.00 1.00 H new ATOM 711 N GLN A 45 -8.857 3.542 6.290 1.00 1.00 N ATOM 712 CA GLN A 45 -8.519 4.958 6.240 1.00 1.00 C ATOM 713 C GLN A 45 -8.175 5.374 4.815 1.00 1.00 C ATOM 714 O GLN A 45 -8.588 6.437 4.353 1.00 1.00 O ATOM 715 CB GLN A 45 -7.325 5.231 7.165 1.00 1.00 C ATOM 716 CG GLN A 45 -7.798 5.274 8.618 1.00 1.00 C ATOM 717 CD GLN A 45 -6.597 5.268 9.556 1.00 1.00 C ATOM 718 OE1 GLN A 45 -5.572 4.661 9.250 1.00 1.00 O ATOM 719 NE2 GLN A 45 -6.663 5.911 10.690 1.00 1.00 N ATOM 0 H GLN A 45 -8.292 2.992 6.937 1.00 1.00 H new ATOM 0 HA GLN A 45 -9.379 5.539 6.572 1.00 1.00 H new ATOM 0 HB2 GLN A 45 -6.571 4.454 7.041 1.00 1.00 H new ATOM 0 HB3 GLN A 45 -6.854 6.177 6.898 1.00 1.00 H new ATOM 0 HG2 GLN A 45 -8.398 6.168 8.788 1.00 1.00 H new ATOM 0 HG3 GLN A 45 -8.437 4.416 8.827 1.00 1.00 H new ATOM 0 HE21 GLN A 45 -7.514 6.414 10.942 1.00 1.00 H new ATOM 0 HE22 GLN A 45 -5.864 5.911 11.324 1.00 1.00 H new ATOM 728 N TYR A 46 -7.417 4.531 4.124 1.00 1.00 N ATOM 729 CA TYR A 46 -7.026 4.821 2.749 1.00 1.00 C ATOM 730 C TYR A 46 -8.250 4.877 1.844 1.00 1.00 C ATOM 731 O TYR A 46 -8.369 5.756 0.992 1.00 1.00 O ATOM 732 CB TYR A 46 -6.060 3.750 2.244 1.00 1.00 C ATOM 733 CG TYR A 46 -5.681 4.048 0.811 1.00 1.00 C ATOM 734 CD1 TYR A 46 -4.803 5.101 0.524 1.00 1.00 C ATOM 735 CD2 TYR A 46 -6.209 3.275 -0.229 1.00 1.00 C ATOM 736 CE1 TYR A 46 -4.452 5.379 -0.801 1.00 1.00 C ATOM 737 CE2 TYR A 46 -5.857 3.552 -1.556 1.00 1.00 C ATOM 738 CZ TYR A 46 -4.979 4.604 -1.841 1.00 1.00 C ATOM 739 OH TYR A 46 -4.634 4.879 -3.149 1.00 1.00 O ATOM 0 H TYR A 46 -7.063 3.647 4.489 1.00 1.00 H new ATOM 0 HA TYR A 46 -6.531 5.792 2.729 1.00 1.00 H new ATOM 0 HB2 TYR A 46 -5.168 3.726 2.870 1.00 1.00 H new ATOM 0 HB3 TYR A 46 -6.524 2.766 2.312 1.00 1.00 H new ATOM 0 HD1 TYR A 46 -4.397 5.699 1.327 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -6.888 2.465 -0.008 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -3.775 6.191 -1.022 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -6.263 2.954 -2.359 1.00 1.00 H new ATOM 0 HH TYR A 46 -5.086 4.247 -3.746 1.00 1.00 H new ATOM 749 N LEU A 47 -9.155 3.927 2.032 1.00 1.00 N ATOM 750 CA LEU A 47 -10.370 3.869 1.226 1.00 1.00 C ATOM 751 C LEU A 47 -11.218 5.115 1.434 1.00 1.00 C ATOM 752 O LEU A 47 -11.790 5.654 0.483 1.00 1.00 O ATOM 753 CB LEU A 47 -11.190 2.629 1.598 1.00 1.00 C ATOM 754 CG LEU A 47 -10.452 1.366 1.135 1.00 1.00 C ATOM 755 CD1 LEU A 47 -11.142 0.130 1.718 1.00 1.00 C ATOM 756 CD2 LEU A 47 -10.461 1.284 -0.406 1.00 1.00 C ATOM 0 H LEU A 47 -9.074 3.189 2.731 1.00 1.00 H new ATOM 0 HA LEU A 47 -10.078 3.813 0.177 1.00 1.00 H new ATOM 0 HB2 LEU A 47 -11.348 2.595 2.676 1.00 1.00 H new ATOM 0 HB3 LEU A 47 -12.174 2.678 1.133 1.00 1.00 H new ATOM 0 HG LEU A 47 -9.420 1.407 1.483 1.00 1.00 H new ATOM 0 HD11 LEU A 47 -10.618 -0.768 1.390 1.00 1.00 H new ATOM 0 HD12 LEU A 47 -11.124 0.183 2.807 1.00 1.00 H new ATOM 0 HD13 LEU A 47 -12.175 0.094 1.373 1.00 1.00 H new ATOM 0 HD21 LEU A 47 -9.935 0.384 -0.726 1.00 1.00 H new ATOM 0 HD22 LEU A 47 -11.490 1.248 -0.762 1.00 1.00 H new ATOM 0 HD23 LEU A 47 -9.964 2.161 -0.820 1.00 1.00 H new ATOM 768 N ILE A 48 -11.303 5.565 2.679 1.00 1.00 N ATOM 769 CA ILE A 48 -12.098 6.744 2.996 1.00 1.00 C ATOM 770 C ILE A 48 -11.572 7.959 2.235 1.00 1.00 C ATOM 771 O ILE A 48 -12.348 8.729 1.670 1.00 1.00 O ATOM 772 CB ILE A 48 -12.047 7.015 4.506 1.00 1.00 C ATOM 773 CG1 ILE A 48 -12.820 5.918 5.245 1.00 1.00 C ATOM 774 CG2 ILE A 48 -12.680 8.377 4.808 1.00 1.00 C ATOM 775 CD1 ILE A 48 -12.608 6.069 6.753 1.00 1.00 C ATOM 0 H ILE A 48 -10.836 5.137 3.479 1.00 1.00 H new ATOM 0 HA ILE A 48 -13.130 6.562 2.697 1.00 1.00 H new ATOM 0 HB ILE A 48 -11.009 7.019 4.838 1.00 1.00 H new ATOM 0 HG12 ILE A 48 -13.882 5.985 5.008 1.00 1.00 H new ATOM 0 HG13 ILE A 48 -12.481 4.936 4.916 1.00 1.00 H new ATOM 0 HG21 ILE A 48 -12.642 8.566 5.881 1.00 1.00 H new ATOM 0 HG22 ILE A 48 -12.131 9.158 4.282 1.00 1.00 H new ATOM 0 HG23 ILE A 48 -13.718 8.377 4.476 1.00 1.00 H new ATOM 0 HD11 ILE A 48 -13.158 5.288 7.278 1.00 1.00 H new ATOM 0 HD12 ILE A 48 -11.546 5.981 6.982 1.00 1.00 H new ATOM 0 HD13 ILE A 48 -12.969 7.046 7.075 1.00 1.00 H new ATOM 1413 N MET B 209 12.417 -10.739 3.977 1.00 1.00 N ATOM 1414 CA MET B 209 11.135 -10.102 4.271 1.00 1.00 C ATOM 1415 C MET B 209 10.362 -10.919 5.295 1.00 1.00 C ATOM 1416 O MET B 209 10.812 -11.982 5.721 1.00 1.00 O ATOM 1417 CB MET B 209 10.310 -9.973 2.992 1.00 1.00 C ATOM 1418 CG MET B 209 10.983 -8.972 2.052 1.00 1.00 C ATOM 1419 SD MET B 209 10.015 -8.825 0.529 1.00 1.00 S ATOM 1420 CE MET B 209 8.888 -7.529 1.099 1.00 1.00 C ATOM 0 HA MET B 209 11.326 -9.109 4.679 1.00 1.00 H new ATOM 0 HB2 MET B 209 10.221 -10.944 2.504 1.00 1.00 H new ATOM 0 HB3 MET B 209 9.299 -9.642 3.230 1.00 1.00 H new ATOM 0 HG2 MET B 209 11.065 -8.000 2.538 1.00 1.00 H new ATOM 0 HG3 MET B 209 11.997 -9.300 1.821 1.00 1.00 H new ATOM 0 HE1 MET B 209 8.189 -7.278 0.301 1.00 1.00 H new ATOM 0 HE2 MET B 209 8.334 -7.885 1.968 1.00 1.00 H new ATOM 0 HE3 MET B 209 9.461 -6.643 1.372 1.00 1.00 H new ATOM 1430 N GLY B 210 9.197 -10.414 5.694 1.00 1.00 N ATOM 1431 CA GLY B 210 8.360 -11.104 6.677 1.00 1.00 C ATOM 1432 C GLY B 210 7.067 -11.588 6.041 1.00 1.00 C ATOM 1433 O GLY B 210 6.833 -11.383 4.849 1.00 1.00 O ATOM 0 H GLY B 210 8.811 -9.533 5.354 1.00 1.00 H new ATOM 0 HA2 GLY B 210 8.905 -11.951 7.094 1.00 1.00 H new ATOM 0 HA3 GLY B 210 8.134 -10.432 7.505 1.00 1.00 H new ATOM 1437 N ARG B 211 6.227 -12.234 6.840 1.00 1.00 N ATOM 1438 CA ARG B 211 4.950 -12.749 6.344 1.00 1.00 C ATOM 1439 C ARG B 211 3.851 -12.519 7.370 1.00 1.00 C ATOM 1440 O ARG B 211 3.996 -12.871 8.540 1.00 1.00 O ATOM 1441 CB ARG B 211 5.069 -14.242 6.049 1.00 1.00 C ATOM 1442 CG ARG B 211 3.763 -14.748 5.431 1.00 1.00 C ATOM 1443 CD ARG B 211 3.889 -16.239 5.122 1.00 1.00 C ATOM 1444 NE ARG B 211 4.864 -16.454 4.060 1.00 1.00 N ATOM 1445 CZ ARG B 211 4.574 -16.174 2.792 1.00 1.00 C ATOM 1446 NH1 ARG B 211 3.397 -15.700 2.482 1.00 1.00 N ATOM 1447 NH2 ARG B 211 5.462 -16.375 1.858 1.00 1.00 N ATOM 0 H ARG B 211 6.402 -12.415 7.828 1.00 1.00 H new ATOM 0 HA ARG B 211 4.695 -12.218 5.427 1.00 1.00 H new ATOM 0 HB2 ARG B 211 5.900 -14.423 5.367 1.00 1.00 H new ATOM 0 HB3 ARG B 211 5.285 -14.789 6.967 1.00 1.00 H new ATOM 0 HG2 ARG B 211 2.933 -14.577 6.117 1.00 1.00 H new ATOM 0 HG3 ARG B 211 3.542 -14.194 4.519 1.00 1.00 H new ATOM 0 HD2 ARG B 211 4.193 -16.779 6.019 1.00 1.00 H new ATOM 0 HD3 ARG B 211 2.920 -16.639 4.822 1.00 1.00 H new ATOM 0 HE ARG B 211 5.785 -16.826 4.293 1.00 1.00 H new ATOM 0 HH11 ARG B 211 2.701 -15.545 3.212 1.00 1.00 H new ATOM 0 HH12 ARG B 211 3.174 -15.485 1.510 1.00 1.00 H new ATOM 0 HH21 ARG B 211 6.380 -16.747 2.099 1.00 1.00 H new ATOM 0 HH22 ARG B 211 5.238 -16.160 0.886 1.00 1.00 H new ATOM 1461 N ILE B 212 2.749 -11.923 6.926 1.00 1.00 N ATOM 1462 CA ILE B 212 1.621 -11.645 7.819 1.00 1.00 C ATOM 1463 C ILE B 212 0.309 -12.020 7.146 1.00 1.00 C ATOM 1464 O ILE B 212 0.182 -11.947 5.923 1.00 1.00 O ATOM 1465 CB ILE B 212 1.595 -10.164 8.186 1.00 1.00 C ATOM 1466 CG1 ILE B 212 2.911 -9.786 8.875 1.00 1.00 C ATOM 1467 CG2 ILE B 212 0.430 -9.894 9.139 1.00 1.00 C ATOM 1468 CD1 ILE B 212 2.988 -8.271 9.040 1.00 1.00 C ATOM 0 H ILE B 212 2.610 -11.624 5.961 1.00 1.00 H new ATOM 0 HA ILE B 212 1.743 -12.241 8.724 1.00 1.00 H new ATOM 0 HB ILE B 212 1.471 -9.569 7.281 1.00 1.00 H new ATOM 0 HG12 ILE B 212 2.975 -10.271 9.849 1.00 1.00 H new ATOM 0 HG13 ILE B 212 3.756 -10.141 8.286 1.00 1.00 H new ATOM 0 HG21 ILE B 212 0.412 -8.836 9.401 1.00 1.00 H new ATOM 0 HG22 ILE B 212 -0.508 -10.164 8.653 1.00 1.00 H new ATOM 0 HG23 ILE B 212 0.554 -10.490 10.043 1.00 1.00 H new ATOM 0 HD11 ILE B 212 3.925 -8.006 9.530 1.00 1.00 H new ATOM 0 HD12 ILE B 212 2.944 -7.796 8.060 1.00 1.00 H new ATOM 0 HD13 ILE B 212 2.151 -7.928 9.648 1.00 1.00 H new ATOM 1480 N LEU B 213 -0.668 -12.425 7.948 1.00 1.00 N ATOM 1481 CA LEU B 213 -1.975 -12.811 7.418 1.00 1.00 C ATOM 1482 C LEU B 213 -2.979 -11.696 7.635 1.00 1.00 C ATOM 1483 O LEU B 213 -3.144 -11.200 8.749 1.00 1.00 O ATOM 1484 CB LEU B 213 -2.466 -14.091 8.117 1.00 1.00 C ATOM 1485 CG LEU B 213 -1.840 -15.315 7.461 1.00 1.00 C ATOM 1486 CD1 LEU B 213 -0.320 -15.288 7.656 1.00 1.00 C ATOM 1487 CD2 LEU B 213 -2.416 -16.583 8.086 1.00 1.00 C ATOM 0 H LEU B 213 -0.584 -12.495 8.962 1.00 1.00 H new ATOM 0 HA LEU B 213 -1.878 -12.998 6.349 1.00 1.00 H new ATOM 0 HB2 LEU B 213 -2.204 -14.061 9.175 1.00 1.00 H new ATOM 0 HB3 LEU B 213 -3.553 -14.153 8.059 1.00 1.00 H new ATOM 0 HG LEU B 213 -2.064 -15.305 6.394 1.00 1.00 H new ATOM 0 HD11 LEU B 213 0.123 -16.166 7.185 1.00 1.00 H new ATOM 0 HD12 LEU B 213 0.089 -14.386 7.201 1.00 1.00 H new ATOM 0 HD13 LEU B 213 -0.090 -15.293 8.721 1.00 1.00 H new ATOM 0 HD21 LEU B 213 -1.967 -17.457 7.615 1.00 1.00 H new ATOM 0 HD22 LEU B 213 -2.198 -16.594 9.154 1.00 1.00 H new ATOM 0 HD23 LEU B 213 -3.495 -16.605 7.936 1.00 1.00 H new ATOM 1499 N LEU B 214 -3.659 -11.310 6.558 1.00 1.00 N ATOM 1500 CA LEU B 214 -4.660 -10.251 6.631 1.00 1.00 C ATOM 1501 C LEU B 214 -6.015 -10.762 6.171 1.00 1.00 C ATOM 1502 O LEU B 214 -6.120 -11.408 5.134 1.00 1.00 O ATOM 1503 CB LEU B 214 -4.237 -9.068 5.753 1.00 1.00 C ATOM 1504 CG LEU B 214 -5.318 -7.980 5.790 1.00 1.00 C ATOM 1505 CD1 LEU B 214 -5.568 -7.540 7.242 1.00 1.00 C ATOM 1506 CD2 LEU B 214 -4.863 -6.782 4.961 1.00 1.00 C ATOM 0 H LEU B 214 -3.535 -11.713 5.629 1.00 1.00 H new ATOM 0 HA LEU B 214 -4.739 -9.926 7.668 1.00 1.00 H new ATOM 0 HB2 LEU B 214 -3.288 -8.663 6.105 1.00 1.00 H new ATOM 0 HB3 LEU B 214 -4.080 -9.402 4.728 1.00 1.00 H new ATOM 0 HG LEU B 214 -6.244 -8.379 5.375 1.00 1.00 H new ATOM 0 HD11 LEU B 214 -6.337 -6.767 7.261 1.00 1.00 H new ATOM 0 HD12 LEU B 214 -5.900 -8.396 7.830 1.00 1.00 H new ATOM 0 HD13 LEU B 214 -4.645 -7.144 7.666 1.00 1.00 H new ATOM 0 HD21 LEU B 214 -5.631 -6.009 4.987 1.00 1.00 H new ATOM 0 HD22 LEU B 214 -3.935 -6.386 5.373 1.00 1.00 H new ATOM 0 HD23 LEU B 214 -4.698 -7.095 3.930 1.00 1.00 H new ATOM 1518 N ASP B 215 -7.054 -10.466 6.948 1.00 1.00 N ATOM 1519 CA ASP B 215 -8.411 -10.898 6.608 1.00 1.00 C ATOM 1520 C ASP B 215 -9.287 -9.700 6.274 1.00 1.00 C ATOM 1521 O ASP B 215 -9.369 -8.745 7.044 1.00 1.00 O ATOM 1522 CB ASP B 215 -9.018 -11.661 7.783 1.00 1.00 C ATOM 1523 CG ASP B 215 -8.318 -13.005 7.947 1.00 1.00 C ATOM 1524 OD1 ASP B 215 -7.290 -13.196 7.319 1.00 1.00 O ATOM 1525 OD2 ASP B 215 -8.824 -13.827 8.693 1.00 1.00 O ATOM 0 H ASP B 215 -6.985 -9.931 7.814 1.00 1.00 H new ATOM 0 HA ASP B 215 -8.359 -11.549 5.735 1.00 1.00 H new ATOM 0 HB2 ASP B 215 -8.919 -11.076 8.697 1.00 1.00 H new ATOM 0 HB3 ASP B 215 -10.084 -11.815 7.616 1.00 1.00 H new ATOM 1531 N LEU B 216 -9.951 -9.762 5.121 1.00 1.00 N ATOM 1532 CA LEU B 216 -10.839 -8.679 4.687 1.00 1.00 C ATOM 1533 C LEU B 216 -12.203 -9.229 4.308 1.00 1.00 C ATOM 1534 O LEU B 216 -12.310 -10.285 3.689 1.00 1.00 O ATOM 1535 CB LEU B 216 -10.227 -7.955 3.487 1.00 1.00 C ATOM 1536 CG LEU B 216 -8.893 -7.329 3.895 1.00 1.00 C ATOM 1537 CD1 LEU B 216 -8.130 -6.883 2.642 1.00 1.00 C ATOM 1538 CD2 LEU B 216 -9.129 -6.114 4.808 1.00 1.00 C ATOM 0 H LEU B 216 -9.893 -10.546 4.471 1.00 1.00 H new ATOM 0 HA LEU B 216 -10.959 -7.977 5.513 1.00 1.00 H new ATOM 0 HB2 LEU B 216 -10.076 -8.655 2.665 1.00 1.00 H new ATOM 0 HB3 LEU B 216 -10.908 -7.184 3.128 1.00 1.00 H new ATOM 0 HG LEU B 216 -8.308 -8.072 4.438 1.00 1.00 H new ATOM 0 HD11 LEU B 216 -7.179 -6.437 2.934 1.00 1.00 H new ATOM 0 HD12 LEU B 216 -7.944 -7.746 2.003 1.00 1.00 H new ATOM 0 HD13 LEU B 216 -8.723 -6.148 2.097 1.00 1.00 H new ATOM 0 HD21 LEU B 216 -8.170 -5.679 5.090 1.00 1.00 H new ATOM 0 HD22 LEU B 216 -9.723 -5.370 4.277 1.00 1.00 H new ATOM 0 HD23 LEU B 216 -9.662 -6.431 5.705 1.00 1.00 H new ATOM 1550 N SER B 217 -13.246 -8.501 4.682 1.00 1.00 N ATOM 1551 CA SER B 217 -14.610 -8.920 4.375 1.00 1.00 C ATOM 1552 C SER B 217 -14.848 -8.891 2.868 1.00 1.00 C ATOM 1553 O SER B 217 -14.176 -8.161 2.139 1.00 1.00 O ATOM 1554 CB SER B 217 -15.612 -7.997 5.072 1.00 1.00 C ATOM 1555 OG SER B 217 -15.717 -8.360 6.440 1.00 1.00 O ATOM 0 H SER B 217 -13.177 -7.622 5.195 1.00 1.00 H new ATOM 0 HA SER B 217 -14.749 -9.939 4.736 1.00 1.00 H new ATOM 0 HB2 SER B 217 -15.289 -6.960 4.984 1.00 1.00 H new ATOM 0 HB3 SER B 217 -16.587 -8.070 4.589 1.00 1.00 H new ATOM 0 HG SER B 217 -14.820 -8.445 6.826 1.00 1.00 H new ATOM 1561 N ASN B 218 -15.806 -9.689 2.411 1.00 1.00 N ATOM 1562 CA ASN B 218 -16.122 -9.748 0.988 1.00 1.00 C ATOM 1563 C ASN B 218 -16.506 -8.370 0.470 1.00 1.00 C ATOM 1564 O ASN B 218 -16.146 -7.994 -0.646 1.00 1.00 O ATOM 1565 CB ASN B 218 -17.275 -10.726 0.748 1.00 1.00 C ATOM 1566 CG ASN B 218 -16.809 -12.157 1.001 1.00 1.00 C ATOM 1567 OD1 ASN B 218 -15.539 -12.403 1.180 1.00 1.00 O flip ATOM 1568 ND2 ASN B 218 -17.626 -13.078 1.046 1.00 1.00 N flip ATOM 0 H ASN B 218 -16.373 -10.300 2.999 1.00 1.00 H new ATOM 0 HA ASN B 218 -15.238 -10.092 0.452 1.00 1.00 H new ATOM 0 HB2 ASN B 218 -18.110 -10.485 1.406 1.00 1.00 H new ATOM 0 HB3 ASN B 218 -17.638 -10.629 -0.275 1.00 1.00 H new ATOM 0 HD21 ASN B 218 -18.618 -12.887 0.906 1.00 1.00 H new ATOM 0 HD22 ASN B 218 -17.310 -14.032 1.223 1.00 1.00 H new ATOM 1575 N GLU B 219 -17.228 -7.615 1.288 1.00 1.00 N ATOM 1576 CA GLU B 219 -17.647 -6.272 0.901 1.00 1.00 C ATOM 1577 C GLU B 219 -16.431 -5.391 0.643 1.00 1.00 C ATOM 1578 O GLU B 219 -16.443 -4.555 -0.256 1.00 1.00 O ATOM 1579 CB GLU B 219 -18.504 -5.654 2.009 1.00 1.00 C ATOM 1580 CG GLU B 219 -19.823 -6.418 2.120 1.00 1.00 C ATOM 1581 CD GLU B 219 -20.668 -5.839 3.248 1.00 1.00 C ATOM 1582 OE1 GLU B 219 -20.261 -4.837 3.813 1.00 1.00 O ATOM 1583 OE2 GLU B 219 -21.710 -6.406 3.533 1.00 1.00 O ATOM 0 H GLU B 219 -17.534 -7.906 2.217 1.00 1.00 H new ATOM 0 HA GLU B 219 -18.234 -6.341 -0.015 1.00 1.00 H new ATOM 0 HB2 GLU B 219 -17.970 -5.689 2.959 1.00 1.00 H new ATOM 0 HB3 GLU B 219 -18.697 -4.604 1.791 1.00 1.00 H new ATOM 0 HG2 GLU B 219 -20.368 -6.357 1.178 1.00 1.00 H new ATOM 0 HG3 GLU B 219 -19.627 -7.474 2.307 1.00 1.00 H new ATOM 1591 N VAL B 220 -15.383 -5.585 1.435 1.00 1.00 N ATOM 1592 CA VAL B 220 -14.159 -4.804 1.275 1.00 1.00 C ATOM 1593 C VAL B 220 -13.453 -5.175 -0.028 1.00 1.00 C ATOM 1594 O VAL B 220 -12.936 -4.308 -0.730 1.00 1.00 O ATOM 1595 CB VAL B 220 -13.222 -5.055 2.463 1.00 1.00 C ATOM 1596 CG1 VAL B 220 -11.901 -4.314 2.237 1.00 1.00 C ATOM 1597 CG2 VAL B 220 -13.881 -4.546 3.746 1.00 1.00 C ATOM 0 H VAL B 220 -15.354 -6.271 2.190 1.00 1.00 H new ATOM 0 HA VAL B 220 -14.423 -3.747 1.240 1.00 1.00 H new ATOM 0 HB VAL B 220 -13.027 -6.124 2.554 1.00 1.00 H new ATOM 0 HG11 VAL B 220 -11.235 -4.492 3.081 1.00 1.00 H new ATOM 0 HG12 VAL B 220 -11.432 -4.677 1.322 1.00 1.00 H new ATOM 0 HG13 VAL B 220 -12.094 -3.245 2.147 1.00 1.00 H new ATOM 0 HG21 VAL B 220 -13.216 -4.724 4.592 1.00 1.00 H new ATOM 0 HG22 VAL B 220 -14.076 -3.477 3.656 1.00 1.00 H new ATOM 0 HG23 VAL B 220 -14.821 -5.074 3.906 1.00 1.00 H new ATOM 1607 N ILE B 221 -13.420 -6.466 -0.333 1.00 1.00 N ATOM 1608 CA ILE B 221 -12.758 -6.935 -1.546 1.00 1.00 C ATOM 1609 C ILE B 221 -13.322 -6.207 -2.761 1.00 1.00 C ATOM 1610 O ILE B 221 -12.582 -5.849 -3.676 1.00 1.00 O ATOM 1611 CB ILE B 221 -12.968 -8.446 -1.700 1.00 1.00 C ATOM 1612 CG1 ILE B 221 -12.236 -9.180 -0.571 1.00 1.00 C ATOM 1613 CG2 ILE B 221 -12.413 -8.907 -3.052 1.00 1.00 C ATOM 1614 CD1 ILE B 221 -12.561 -10.680 -0.627 1.00 1.00 C ATOM 0 H ILE B 221 -13.839 -7.202 0.236 1.00 1.00 H new ATOM 0 HA ILE B 221 -11.690 -6.728 -1.472 1.00 1.00 H new ATOM 0 HB ILE B 221 -14.033 -8.670 -1.651 1.00 1.00 H new ATOM 0 HG12 ILE B 221 -11.161 -9.028 -0.664 1.00 1.00 H new ATOM 0 HG13 ILE B 221 -12.534 -8.770 0.394 1.00 1.00 H new ATOM 0 HG21 ILE B 221 -12.563 -9.981 -3.160 1.00 1.00 H new ATOM 0 HG22 ILE B 221 -12.933 -8.386 -3.856 1.00 1.00 H new ATOM 0 HG23 ILE B 221 -11.348 -8.683 -3.104 1.00 1.00 H new ATOM 0 HD11 ILE B 221 -12.038 -11.196 0.178 1.00 1.00 H new ATOM 0 HD12 ILE B 221 -13.635 -10.824 -0.512 1.00 1.00 H new ATOM 0 HD13 ILE B 221 -12.241 -11.086 -1.587 1.00 1.00 H new ATOM 1626 N LYS B 222 -14.635 -5.992 -2.766 1.00 1.00 N ATOM 1627 CA LYS B 222 -15.277 -5.289 -3.869 1.00 1.00 C ATOM 1628 C LYS B 222 -14.787 -3.847 -3.932 1.00 1.00 C ATOM 1629 O LYS B 222 -14.589 -3.293 -5.013 1.00 1.00 O ATOM 1630 CB LYS B 222 -16.798 -5.318 -3.690 1.00 1.00 C ATOM 1631 CG LYS B 222 -17.306 -6.748 -3.889 1.00 1.00 C ATOM 1632 CD LYS B 222 -18.819 -6.784 -3.674 1.00 1.00 C ATOM 1633 CE LYS B 222 -19.328 -8.212 -3.876 1.00 1.00 C ATOM 1634 NZ LYS B 222 -20.797 -8.253 -3.630 1.00 1.00 N ATOM 0 H LYS B 222 -15.269 -6.292 -2.025 1.00 1.00 H new ATOM 0 HA LYS B 222 -15.018 -5.788 -4.803 1.00 1.00 H new ATOM 0 HB2 LYS B 222 -17.065 -4.961 -2.696 1.00 1.00 H new ATOM 0 HB3 LYS B 222 -17.273 -4.649 -4.407 1.00 1.00 H new ATOM 0 HG2 LYS B 222 -17.062 -7.096 -4.893 1.00 1.00 H new ATOM 0 HG3 LYS B 222 -16.812 -7.422 -3.189 1.00 1.00 H new ATOM 0 HD2 LYS B 222 -19.063 -6.438 -2.669 1.00 1.00 H new ATOM 0 HD3 LYS B 222 -19.313 -6.108 -4.372 1.00 1.00 H new ATOM 0 HE2 LYS B 222 -19.108 -8.548 -4.889 1.00 1.00 H new ATOM 0 HE3 LYS B 222 -18.815 -8.892 -3.196 1.00 1.00 H new ATOM 0 HZ1 LYS B 222 -21.145 -9.223 -3.767 1.00 1.00 H new ATOM 0 HZ2 LYS B 222 -20.994 -7.949 -2.655 1.00 1.00 H new ATOM 0 HZ3 LYS B 222 -21.278 -7.615 -4.296 1.00 1.00 H new ATOM 1648 N GLN B 223 -14.584 -3.240 -2.759 1.00 1.00 N ATOM 1649 CA GLN B 223 -14.102 -1.864 -2.700 1.00 1.00 C ATOM 1650 C GLN B 223 -12.698 -1.780 -3.288 1.00 1.00 C ATOM 1651 O GLN B 223 -12.412 -0.928 -4.123 1.00 1.00 O ATOM 1652 CB GLN B 223 -14.095 -1.382 -1.246 1.00 1.00 C ATOM 1653 CG GLN B 223 -15.516 -1.374 -0.702 1.00 1.00 C ATOM 1654 CD GLN B 223 -15.515 -0.973 0.766 1.00 1.00 C ATOM 1655 OE1 GLN B 223 -15.981 -1.731 1.616 1.00 1.00 O ATOM 1656 NE2 GLN B 223 -15.015 0.180 1.117 1.00 1.00 N ATOM 0 H GLN B 223 -14.744 -3.676 -1.851 1.00 1.00 H new ATOM 0 HA GLN B 223 -14.765 -1.225 -3.283 1.00 1.00 H new ATOM 0 HB2 GLN B 223 -13.467 -2.034 -0.639 1.00 1.00 H new ATOM 0 HB3 GLN B 223 -13.667 -0.381 -1.186 1.00 1.00 H new ATOM 0 HG2 GLN B 223 -16.129 -0.679 -1.276 1.00 1.00 H new ATOM 0 HG3 GLN B 223 -15.962 -2.362 -0.816 1.00 1.00 H new ATOM 0 HE21 GLN B 223 -14.630 0.805 0.409 1.00 1.00 H new ATOM 0 HE22 GLN B 223 -15.009 0.456 2.099 1.00 1.00 H new ATOM 1665 N LEU B 224 -11.825 -2.682 -2.849 1.00 1.00 N ATOM 1666 CA LEU B 224 -10.454 -2.713 -3.350 1.00 1.00 C ATOM 1667 C LEU B 224 -10.437 -3.050 -4.831 1.00 1.00 C ATOM 1668 O LEU B 224 -9.581 -2.573 -5.576 1.00 1.00 O ATOM 1669 CB LEU B 224 -9.637 -3.753 -2.570 1.00 1.00 C ATOM 1670 CG LEU B 224 -9.190 -3.156 -1.219 1.00 1.00 C ATOM 1671 CD1 LEU B 224 -8.884 -4.284 -0.234 1.00 1.00 C ATOM 1672 CD2 LEU B 224 -7.928 -2.300 -1.420 1.00 1.00 C ATOM 0 H LEU B 224 -12.040 -3.396 -2.153 1.00 1.00 H new ATOM 0 HA LEU B 224 -10.010 -1.727 -3.211 1.00 1.00 H new ATOM 0 HB2 LEU B 224 -10.235 -4.649 -2.403 1.00 1.00 H new ATOM 0 HB3 LEU B 224 -8.766 -4.056 -3.151 1.00 1.00 H new ATOM 0 HG LEU B 224 -9.992 -2.533 -0.822 1.00 1.00 H new ATOM 0 HD11 LEU B 224 -8.569 -3.859 0.719 1.00 1.00 H new ATOM 0 HD12 LEU B 224 -9.779 -4.888 -0.084 1.00 1.00 H new ATOM 0 HD13 LEU B 224 -8.086 -4.910 -0.634 1.00 1.00 H new ATOM 0 HD21 LEU B 224 -7.617 -1.881 -0.463 1.00 1.00 H new ATOM 0 HD22 LEU B 224 -7.127 -2.921 -1.822 1.00 1.00 H new ATOM 0 HD23 LEU B 224 -8.145 -1.491 -2.117 1.00 1.00 H new ATOM 1684 N ASP B 225 -11.379 -3.886 -5.251 1.00 1.00 N ATOM 1685 CA ASP B 225 -11.459 -4.290 -6.646 1.00 1.00 C ATOM 1686 C ASP B 225 -11.650 -3.073 -7.541 1.00 1.00 C ATOM 1687 O ASP B 225 -11.059 -2.982 -8.616 1.00 1.00 O ATOM 1688 CB ASP B 225 -12.629 -5.259 -6.836 1.00 1.00 C ATOM 1689 CG ASP B 225 -12.291 -6.617 -6.232 1.00 1.00 C ATOM 1690 OD1 ASP B 225 -11.139 -6.819 -5.888 1.00 1.00 O ATOM 1691 OD2 ASP B 225 -13.189 -7.435 -6.127 1.00 1.00 O ATOM 0 H ASP B 225 -12.093 -4.294 -4.648 1.00 1.00 H new ATOM 0 HA ASP B 225 -10.528 -4.785 -6.922 1.00 1.00 H new ATOM 0 HB2 ASP B 225 -13.525 -4.856 -6.364 1.00 1.00 H new ATOM 0 HB3 ASP B 225 -12.850 -5.370 -7.898 1.00 1.00 H new ATOM 1697 N ASP B 226 -12.476 -2.135 -7.090 1.00 1.00 N ATOM 1698 CA ASP B 226 -12.732 -0.921 -7.858 1.00 1.00 C ATOM 1699 C ASP B 226 -11.466 -0.076 -7.967 1.00 1.00 C ATOM 1700 O ASP B 226 -11.185 0.513 -9.010 1.00 1.00 O ATOM 1701 CB ASP B 226 -13.841 -0.105 -7.194 1.00 1.00 C ATOM 1702 CG ASP B 226 -14.346 0.967 -8.152 1.00 1.00 C ATOM 1703 OD1 ASP B 226 -15.454 1.436 -7.953 1.00 1.00 O ATOM 1704 OD2 ASP B 226 -13.616 1.304 -9.071 1.00 1.00 O ATOM 0 H ASP B 226 -12.977 -2.190 -6.203 1.00 1.00 H new ATOM 0 HA ASP B 226 -13.047 -1.209 -8.861 1.00 1.00 H new ATOM 0 HB2 ASP B 226 -14.662 -0.761 -6.904 1.00 1.00 H new ATOM 0 HB3 ASP B 226 -13.466 0.359 -6.282 1.00 1.00 H new ATOM 1710 N LEU B 227 -10.704 -0.023 -6.883 1.00 1.00 N ATOM 1711 CA LEU B 227 -9.466 0.746 -6.867 1.00 1.00 C ATOM 1712 C LEU B 227 -8.389 0.053 -7.682 1.00 1.00 C ATOM 1713 O LEU B 227 -7.500 0.708 -8.233 1.00 1.00 O ATOM 1714 CB LEU B 227 -8.984 0.937 -5.417 1.00 1.00 C ATOM 1715 CG LEU B 227 -9.733 2.111 -4.761 1.00 1.00 C ATOM 1716 CD1 LEU B 227 -11.108 1.644 -4.291 1.00 1.00 C ATOM 1717 CD2 LEU B 227 -8.929 2.621 -3.568 1.00 1.00 C ATOM 0 H LEU B 227 -10.919 -0.500 -6.008 1.00 1.00 H new ATOM 0 HA LEU B 227 -9.662 1.721 -7.313 1.00 1.00 H new ATOM 0 HB2 LEU B 227 -9.152 0.024 -4.846 1.00 1.00 H new ATOM 0 HB3 LEU B 227 -7.911 1.128 -5.404 1.00 1.00 H new ATOM 0 HG LEU B 227 -9.856 2.915 -5.487 1.00 1.00 H new ATOM 0 HD11 LEU B 227 -11.636 2.477 -3.827 1.00 1.00 H new ATOM 0 HD12 LEU B 227 -11.681 1.282 -5.145 1.00 1.00 H new ATOM 0 HD13 LEU B 227 -10.990 0.839 -3.565 1.00 1.00 H new ATOM 0 HD21 LEU B 227 -9.457 3.453 -3.102 1.00 1.00 H new ATOM 0 HD22 LEU B 227 -8.805 1.817 -2.842 1.00 1.00 H new ATOM 0 HD23 LEU B 227 -7.949 2.958 -3.907 1.00 1.00 H new ATOM 1729 N GLU B 228 -8.456 -1.266 -7.742 1.00 1.00 N ATOM 1730 CA GLU B 228 -7.469 -2.034 -8.485 1.00 1.00 C ATOM 1731 C GLU B 228 -7.622 -1.810 -9.985 1.00 1.00 C ATOM 1732 O GLU B 228 -6.635 -1.664 -10.708 1.00 1.00 O ATOM 1733 CB GLU B 228 -7.623 -3.529 -8.165 1.00 1.00 C ATOM 1734 CG GLU B 228 -6.322 -4.266 -8.490 1.00 1.00 C ATOM 1735 CD GLU B 228 -6.108 -4.299 -10.001 1.00 1.00 C ATOM 1736 OE1 GLU B 228 -5.024 -3.945 -10.435 1.00 1.00 O ATOM 1737 OE2 GLU B 228 -7.032 -4.675 -10.702 1.00 1.00 O ATOM 0 H GLU B 228 -9.178 -1.826 -7.289 1.00 1.00 H new ATOM 0 HA GLU B 228 -6.476 -1.697 -8.186 1.00 1.00 H new ATOM 0 HB2 GLU B 228 -7.873 -3.661 -7.112 1.00 1.00 H new ATOM 0 HB3 GLU B 228 -8.445 -3.951 -8.743 1.00 1.00 H new ATOM 0 HG2 GLU B 228 -5.481 -3.769 -8.006 1.00 1.00 H new ATOM 0 HG3 GLU B 228 -6.361 -5.282 -8.097 1.00 1.00 H new ATOM 1745 N VAL B 229 -8.866 -1.790 -10.444 1.00 1.00 N ATOM 1746 CA VAL B 229 -9.140 -1.582 -11.859 1.00 1.00 C ATOM 1747 C VAL B 229 -8.809 -0.152 -12.271 1.00 1.00 C ATOM 1748 O VAL B 229 -8.133 0.077 -13.275 1.00 1.00 O ATOM 1749 CB VAL B 229 -10.615 -1.872 -12.158 1.00 1.00 C ATOM 1750 CG1 VAL B 229 -10.918 -1.540 -13.620 1.00 1.00 C ATOM 1751 CG2 VAL B 229 -10.905 -3.352 -11.900 1.00 1.00 C ATOM 0 H VAL B 229 -9.695 -1.914 -9.863 1.00 1.00 H new ATOM 0 HA VAL B 229 -8.512 -2.265 -12.430 1.00 1.00 H new ATOM 0 HB VAL B 229 -11.243 -1.259 -11.511 1.00 1.00 H new ATOM 0 HG11 VAL B 229 -11.967 -1.747 -13.830 1.00 1.00 H new ATOM 0 HG12 VAL B 229 -10.712 -0.485 -13.804 1.00 1.00 H new ATOM 0 HG13 VAL B 229 -10.291 -2.151 -14.269 1.00 1.00 H new ATOM 0 HG21 VAL B 229 -11.954 -3.560 -12.112 1.00 1.00 H new ATOM 0 HG22 VAL B 229 -10.276 -3.964 -12.546 1.00 1.00 H new ATOM 0 HG23 VAL B 229 -10.692 -3.588 -10.857 1.00 1.00 H new ATOM 1761 N GLN B 230 -9.288 0.809 -11.487 1.00 1.00 N ATOM 1762 CA GLN B 230 -9.038 2.215 -11.780 1.00 1.00 C ATOM 1763 C GLN B 230 -7.542 2.501 -11.810 1.00 1.00 C ATOM 1764 O GLN B 230 -7.045 3.163 -12.721 1.00 1.00 O ATOM 1765 CB GLN B 230 -9.708 3.095 -10.722 1.00 1.00 C ATOM 1766 CG GLN B 230 -11.229 3.004 -10.863 1.00 1.00 C ATOM 1767 CD GLN B 230 -11.671 3.642 -12.175 1.00 1.00 C ATOM 1768 OE1 GLN B 230 -11.201 4.723 -12.531 1.00 1.00 O ATOM 1769 NE2 GLN B 230 -12.553 3.035 -12.921 1.00 1.00 N ATOM 0 H GLN B 230 -9.847 0.641 -10.650 1.00 1.00 H new ATOM 0 HA GLN B 230 -9.457 2.442 -12.760 1.00 1.00 H new ATOM 0 HB2 GLN B 230 -9.406 2.775 -9.725 1.00 1.00 H new ATOM 0 HB3 GLN B 230 -9.384 4.129 -10.837 1.00 1.00 H new ATOM 0 HG2 GLN B 230 -11.543 1.961 -10.833 1.00 1.00 H new ATOM 0 HG3 GLN B 230 -11.711 3.507 -10.024 1.00 1.00 H new ATOM 0 HE21 GLN B 230 -12.942 2.140 -12.625 1.00 1.00 H new ATOM 0 HE22 GLN B 230 -12.854 3.456 -13.800 1.00 1.00 H new ATOM 1778 N ARG B 231 -6.829 1.993 -10.813 1.00 1.00 N ATOM 1779 CA ARG B 231 -5.388 2.192 -10.740 1.00 1.00 C ATOM 1780 C ARG B 231 -4.661 1.257 -11.695 1.00 1.00 C ATOM 1781 O ARG B 231 -3.551 1.554 -12.140 1.00 1.00 O ATOM 1782 CB ARG B 231 -4.902 1.947 -9.308 1.00 1.00 C ATOM 1783 CG ARG B 231 -5.563 2.954 -8.355 1.00 1.00 C ATOM 1784 CD ARG B 231 -4.842 4.303 -8.441 1.00 1.00 C ATOM 1785 NE ARG B 231 -5.368 5.221 -7.442 1.00 1.00 N ATOM 1786 CZ ARG B 231 -5.338 6.536 -7.636 1.00 1.00 C ATOM 1787 NH1 ARG B 231 -4.828 7.023 -8.737 1.00 1.00 N ATOM 1788 NH2 ARG B 231 -5.812 7.340 -6.727 1.00 1.00 N ATOM 0 H ARG B 231 -7.222 1.444 -10.049 1.00 1.00 H new ATOM 0 HA ARG B 231 -5.169 3.220 -11.030 1.00 1.00 H new ATOM 0 HB2 ARG B 231 -5.144 0.929 -9.001 1.00 1.00 H new ATOM 0 HB3 ARG B 231 -3.817 2.045 -9.260 1.00 1.00 H new ATOM 0 HG2 ARG B 231 -6.615 3.077 -8.614 1.00 1.00 H new ATOM 0 HG3 ARG B 231 -5.528 2.578 -7.333 1.00 1.00 H new ATOM 0 HD2 ARG B 231 -3.772 4.162 -8.288 1.00 1.00 H new ATOM 0 HD3 ARG B 231 -4.968 4.728 -9.437 1.00 1.00 H new ATOM 0 HE ARG B 231 -5.766 4.850 -6.579 1.00 1.00 H new ATOM 0 HH11 ARG B 231 -4.453 6.394 -9.447 1.00 1.00 H new ATOM 0 HH12 ARG B 231 -4.805 8.032 -8.886 1.00 1.00 H new ATOM 0 HH21 ARG B 231 -6.206 6.961 -5.866 1.00 1.00 H new ATOM 0 HH22 ARG B 231 -5.789 8.349 -6.876 1.00 1.00 H new ATOM 1802 N ASN B 232 -5.287 0.125 -11.994 1.00 1.00 N ATOM 1803 CA ASN B 232 -4.685 -0.852 -12.891 1.00 1.00 C ATOM 1804 C ASN B 232 -3.346 -1.318 -12.344 1.00 1.00 C ATOM 1805 O ASN B 232 -2.367 -1.442 -13.084 1.00 1.00 O ATOM 1806 CB ASN B 232 -4.484 -0.240 -14.277 1.00 1.00 C ATOM 1807 CG ASN B 232 -4.135 -1.330 -15.283 1.00 1.00 C ATOM 1808 OD1 ASN B 232 -4.656 -2.440 -15.202 1.00 1.00 O ATOM 1809 ND2 ASN B 232 -3.275 -1.077 -16.232 1.00 1.00 N ATOM 0 H ASN B 232 -6.204 -0.137 -11.632 1.00 1.00 H new ATOM 0 HA ASN B 232 -5.356 -1.708 -12.968 1.00 1.00 H new ATOM 0 HB2 ASN B 232 -5.391 0.278 -14.590 1.00 1.00 H new ATOM 0 HB3 ASN B 232 -3.688 0.503 -14.243 1.00 1.00 H new ATOM 0 HD21 ASN B 232 -3.034 -1.801 -16.908 1.00 1.00 H new ATOM 0 HD22 ASN B 232 -2.844 -0.155 -16.297 1.00 1.00 H new ATOM 1816 N LEU B 233 -3.304 -1.571 -11.036 1.00 1.00 N ATOM 1817 CA LEU B 233 -2.069 -2.017 -10.398 1.00 1.00 C ATOM 1818 C LEU B 233 -2.345 -3.119 -9.387 1.00 1.00 C ATOM 1819 O LEU B 233 -3.434 -3.205 -8.839 1.00 1.00 O ATOM 1820 CB LEU B 233 -1.393 -0.830 -9.689 1.00 1.00 C ATOM 1821 CG LEU B 233 -0.657 0.035 -10.731 1.00 1.00 C ATOM 1822 CD1 LEU B 233 -0.495 1.455 -10.190 1.00 1.00 C ATOM 1823 CD2 LEU B 233 0.730 -0.559 -11.026 1.00 1.00 C ATOM 0 H LEU B 233 -4.100 -1.476 -10.406 1.00 1.00 H new ATOM 0 HA LEU B 233 -1.409 -2.412 -11.170 1.00 1.00 H new ATOM 0 HB2 LEU B 233 -2.139 -0.232 -9.165 1.00 1.00 H new ATOM 0 HB3 LEU B 233 -0.690 -1.192 -8.939 1.00 1.00 H new ATOM 0 HG LEU B 233 -1.240 0.055 -11.652 1.00 1.00 H new ATOM 0 HD11 LEU B 233 0.025 2.068 -10.926 1.00 1.00 H new ATOM 0 HD12 LEU B 233 -1.478 1.883 -9.991 1.00 1.00 H new ATOM 0 HD13 LEU B 233 0.083 1.429 -9.266 1.00 1.00 H new ATOM 0 HD21 LEU B 233 1.241 0.060 -11.763 1.00 1.00 H new ATOM 0 HD22 LEU B 233 1.316 -0.588 -10.107 1.00 1.00 H new ATOM 0 HD23 LEU B 233 0.617 -1.570 -11.417 1.00 1.00 H new ATOM 1835 N PRO B 234 -1.377 -3.956 -9.129 1.00 1.00 N ATOM 1836 CA PRO B 234 -1.520 -5.083 -8.160 1.00 1.00 C ATOM 1837 C PRO B 234 -1.858 -4.597 -6.752 1.00 1.00 C ATOM 1838 O PRO B 234 -1.384 -3.551 -6.317 1.00 1.00 O ATOM 1839 CB PRO B 234 -0.138 -5.774 -8.193 1.00 1.00 C ATOM 1840 CG PRO B 234 0.796 -4.757 -8.768 1.00 1.00 C ATOM 1841 CD PRO B 234 -0.029 -3.926 -9.727 1.00 1.00 C ATOM 0 HA PRO B 234 -2.339 -5.750 -8.428 1.00 1.00 H new ATOM 0 HB2 PRO B 234 0.175 -6.076 -7.194 1.00 1.00 H new ATOM 0 HB3 PRO B 234 -0.163 -6.676 -8.805 1.00 1.00 H new ATOM 0 HG2 PRO B 234 1.226 -4.135 -7.983 1.00 1.00 H new ATOM 0 HG3 PRO B 234 1.627 -5.238 -9.284 1.00 1.00 H new ATOM 0 HD2 PRO B 234 0.353 -2.908 -9.808 1.00 1.00 H new ATOM 0 HD3 PRO B 234 -0.025 -4.349 -10.732 1.00 1.00 H new ATOM 1849 N ARG B 235 -2.676 -5.372 -6.045 1.00 1.00 N ATOM 1850 CA ARG B 235 -3.068 -5.012 -4.693 1.00 1.00 C ATOM 1851 C ARG B 235 -1.842 -4.874 -3.804 1.00 1.00 C ATOM 1852 O ARG B 235 -1.721 -3.917 -3.039 1.00 1.00 O ATOM 1853 CB ARG B 235 -4.001 -6.083 -4.127 1.00 1.00 C ATOM 1854 CG ARG B 235 -3.251 -7.410 -4.003 1.00 1.00 C ATOM 1855 CD ARG B 235 -4.251 -8.547 -3.801 1.00 1.00 C ATOM 1856 NE ARG B 235 -3.550 -9.821 -3.697 1.00 1.00 N ATOM 1857 CZ ARG B 235 -4.184 -10.971 -3.896 1.00 1.00 C ATOM 1858 NH1 ARG B 235 -5.456 -10.974 -4.189 1.00 1.00 N ATOM 1859 NH2 ARG B 235 -3.536 -12.100 -3.800 1.00 1.00 N ATOM 0 H ARG B 235 -3.076 -6.246 -6.386 1.00 1.00 H new ATOM 0 HA ARG B 235 -3.588 -4.055 -4.720 1.00 1.00 H new ATOM 0 HB2 ARG B 235 -4.375 -5.774 -3.151 1.00 1.00 H new ATOM 0 HB3 ARG B 235 -4.868 -6.204 -4.777 1.00 1.00 H new ATOM 0 HG2 ARG B 235 -2.658 -7.589 -4.900 1.00 1.00 H new ATOM 0 HG3 ARG B 235 -2.556 -7.370 -3.164 1.00 1.00 H new ATOM 0 HD2 ARG B 235 -4.836 -8.371 -2.898 1.00 1.00 H new ATOM 0 HD3 ARG B 235 -4.953 -8.577 -4.635 1.00 1.00 H new ATOM 0 HE ARG B 235 -2.556 -9.829 -3.468 1.00 1.00 H new ATOM 0 HH11 ARG B 235 -5.964 -10.093 -4.265 1.00 1.00 H new ATOM 0 HH12 ARG B 235 -5.942 -11.858 -4.342 1.00 1.00 H new ATOM 0 HH21 ARG B 235 -2.542 -12.100 -3.572 1.00 1.00 H new ATOM 0 HH22 ARG B 235 -4.024 -12.983 -3.953 1.00 1.00 H new ATOM 1873 N ALA B 236 -0.930 -5.832 -3.906 1.00 1.00 N ATOM 1874 CA ALA B 236 0.282 -5.807 -3.090 1.00 1.00 C ATOM 1875 C ALA B 236 0.894 -4.413 -3.104 1.00 1.00 C ATOM 1876 O ALA B 236 1.300 -3.893 -2.065 1.00 1.00 O ATOM 1877 CB ALA B 236 1.299 -6.807 -3.651 1.00 1.00 C ATOM 0 H ALA B 236 -1.002 -6.629 -4.538 1.00 1.00 H new ATOM 0 HA ALA B 236 0.023 -6.077 -2.066 1.00 1.00 H new ATOM 0 HB1 ALA B 236 2.203 -6.788 -3.042 1.00 1.00 H new ATOM 0 HB2 ALA B 236 0.871 -7.809 -3.634 1.00 1.00 H new ATOM 0 HB3 ALA B 236 1.548 -6.536 -4.677 1.00 1.00 H new ATOM 1883 N ASP B 237 0.936 -3.798 -4.284 1.00 1.00 N ATOM 1884 CA ASP B 237 1.488 -2.451 -4.404 1.00 1.00 C ATOM 1885 C ASP B 237 0.626 -1.451 -3.633 1.00 1.00 C ATOM 1886 O ASP B 237 1.148 -0.543 -2.985 1.00 1.00 O ATOM 1887 CB ASP B 237 1.545 -2.048 -5.887 1.00 1.00 C ATOM 1888 CG ASP B 237 2.826 -2.574 -6.523 1.00 1.00 C ATOM 1889 OD1 ASP B 237 3.136 -2.146 -7.622 1.00 1.00 O ATOM 1890 OD2 ASP B 237 3.476 -3.398 -5.902 1.00 1.00 O ATOM 0 H ASP B 237 0.600 -4.203 -5.158 1.00 1.00 H new ATOM 0 HA ASP B 237 2.494 -2.444 -3.984 1.00 1.00 H new ATOM 0 HB2 ASP B 237 0.678 -2.446 -6.414 1.00 1.00 H new ATOM 0 HB3 ASP B 237 1.503 -0.963 -5.979 1.00 1.00 H new ATOM 1896 N LEU B 238 -0.687 -1.624 -3.705 1.00 1.00 N ATOM 1897 CA LEU B 238 -1.601 -0.735 -3.004 1.00 1.00 C ATOM 1898 C LEU B 238 -1.428 -0.863 -1.500 1.00 1.00 C ATOM 1899 O LEU B 238 -1.460 0.135 -0.777 1.00 1.00 O ATOM 1900 CB LEU B 238 -3.049 -1.059 -3.395 1.00 1.00 C ATOM 1901 CG LEU B 238 -3.294 -0.652 -4.855 1.00 1.00 C ATOM 1902 CD1 LEU B 238 -4.689 -1.113 -5.287 1.00 1.00 C ATOM 1903 CD2 LEU B 238 -3.190 0.882 -5.000 1.00 1.00 C ATOM 0 H LEU B 238 -1.140 -2.367 -4.238 1.00 1.00 H new ATOM 0 HA LEU B 238 -1.373 0.291 -3.291 1.00 1.00 H new ATOM 0 HB2 LEU B 238 -3.241 -2.124 -3.267 1.00 1.00 H new ATOM 0 HB3 LEU B 238 -3.740 -0.530 -2.739 1.00 1.00 H new ATOM 0 HG LEU B 238 -2.541 -1.122 -5.488 1.00 1.00 H new ATOM 0 HD11 LEU B 238 -4.863 -0.824 -6.324 1.00 1.00 H new ATOM 0 HD12 LEU B 238 -4.758 -2.197 -5.196 1.00 1.00 H new ATOM 0 HD13 LEU B 238 -5.440 -0.647 -4.649 1.00 1.00 H new ATOM 0 HD21 LEU B 238 -3.365 1.162 -6.039 1.00 1.00 H new ATOM 0 HD22 LEU B 238 -3.936 1.359 -4.365 1.00 1.00 H new ATOM 0 HD23 LEU B 238 -2.195 1.209 -4.699 1.00 1.00 H new ATOM 1915 N LEU B 239 -1.251 -2.092 -1.035 1.00 1.00 N ATOM 1916 CA LEU B 239 -1.078 -2.331 0.392 1.00 1.00 C ATOM 1917 C LEU B 239 0.170 -1.627 0.900 1.00 1.00 C ATOM 1918 O LEU B 239 0.130 -0.941 1.922 1.00 1.00 O ATOM 1919 CB LEU B 239 -0.958 -3.841 0.646 1.00 1.00 C ATOM 1920 CG LEU B 239 -2.258 -4.540 0.233 1.00 1.00 C ATOM 1921 CD1 LEU B 239 -2.105 -6.052 0.419 1.00 1.00 C ATOM 1922 CD2 LEU B 239 -3.426 -4.029 1.098 1.00 1.00 C ATOM 0 H LEU B 239 -1.223 -2.930 -1.616 1.00 1.00 H new ATOM 0 HA LEU B 239 -1.943 -1.936 0.924 1.00 1.00 H new ATOM 0 HB2 LEU B 239 -0.119 -4.249 0.082 1.00 1.00 H new ATOM 0 HB3 LEU B 239 -0.753 -4.027 1.700 1.00 1.00 H new ATOM 0 HG LEU B 239 -2.467 -4.320 -0.814 1.00 1.00 H new ATOM 0 HD11 LEU B 239 -3.029 -6.550 0.126 1.00 1.00 H new ATOM 0 HD12 LEU B 239 -1.285 -6.414 -0.201 1.00 1.00 H new ATOM 0 HD13 LEU B 239 -1.892 -6.270 1.465 1.00 1.00 H new ATOM 0 HD21 LEU B 239 -4.347 -4.530 0.799 1.00 1.00 H new ATOM 0 HD22 LEU B 239 -3.222 -4.241 2.147 1.00 1.00 H new ATOM 0 HD23 LEU B 239 -3.537 -2.953 0.961 1.00 1.00 H new ATOM 1934 N ARG B 240 1.274 -1.800 0.185 1.00 1.00 N ATOM 1935 CA ARG B 240 2.532 -1.173 0.578 1.00 1.00 C ATOM 1936 C ARG B 240 2.373 0.342 0.626 1.00 1.00 C ATOM 1937 O ARG B 240 2.834 0.996 1.561 1.00 1.00 O ATOM 1938 CB ARG B 240 3.634 -1.541 -0.417 1.00 1.00 C ATOM 1939 CG ARG B 240 4.968 -0.975 0.066 1.00 1.00 C ATOM 1940 CD ARG B 240 6.088 -1.455 -0.858 1.00 1.00 C ATOM 1941 NE ARG B 240 5.948 -0.856 -2.180 1.00 1.00 N ATOM 1942 CZ ARG B 240 6.592 -1.352 -3.231 1.00 1.00 C ATOM 1943 NH1 ARG B 240 7.366 -2.394 -3.091 1.00 1.00 N ATOM 1944 NH2 ARG B 240 6.452 -0.797 -4.403 1.00 1.00 N ATOM 0 H ARG B 240 1.326 -2.364 -0.663 1.00 1.00 H new ATOM 0 HA ARG B 240 2.806 -1.534 1.569 1.00 1.00 H new ATOM 0 HB2 ARG B 240 3.701 -2.624 -0.517 1.00 1.00 H new ATOM 0 HB3 ARG B 240 3.395 -1.144 -1.404 1.00 1.00 H new ATOM 0 HG2 ARG B 240 4.931 0.114 0.076 1.00 1.00 H new ATOM 0 HG3 ARG B 240 5.163 -1.296 1.089 1.00 1.00 H new ATOM 0 HD2 ARG B 240 7.057 -1.192 -0.433 1.00 1.00 H new ATOM 0 HD3 ARG B 240 6.060 -2.542 -0.939 1.00 1.00 H new ATOM 0 HE ARG B 240 5.345 -0.042 -2.300 1.00 1.00 H new ATOM 0 HH11 ARG B 240 7.477 -2.828 -2.174 1.00 1.00 H new ATOM 0 HH12 ARG B 240 7.860 -2.774 -3.898 1.00 1.00 H new ATOM 0 HH21 ARG B 240 5.848 0.018 -4.513 1.00 1.00 H new ATOM 0 HH22 ARG B 240 6.946 -1.178 -5.210 1.00 1.00 H new ATOM 1958 N GLU B 241 1.706 0.894 -0.383 1.00 1.00 N ATOM 1959 CA GLU B 241 1.482 2.333 -0.441 1.00 1.00 C ATOM 1960 C GLU B 241 0.572 2.782 0.698 1.00 1.00 C ATOM 1961 O GLU B 241 0.771 3.847 1.283 1.00 1.00 O ATOM 1962 CB GLU B 241 0.850 2.712 -1.783 1.00 1.00 C ATOM 1963 CG GLU B 241 1.867 2.500 -2.907 1.00 1.00 C ATOM 1964 CD GLU B 241 2.983 3.532 -2.800 1.00 1.00 C ATOM 1965 OE1 GLU B 241 2.845 4.447 -2.005 1.00 1.00 O ATOM 1966 OE2 GLU B 241 3.965 3.391 -3.511 1.00 1.00 O ATOM 0 H GLU B 241 1.314 0.371 -1.166 1.00 1.00 H new ATOM 0 HA GLU B 241 2.445 2.834 -0.340 1.00 1.00 H new ATOM 0 HB2 GLU B 241 -0.038 2.105 -1.963 1.00 1.00 H new ATOM 0 HB3 GLU B 241 0.526 3.753 -1.763 1.00 1.00 H new ATOM 0 HG2 GLU B 241 2.283 1.494 -2.847 1.00 1.00 H new ATOM 0 HG3 GLU B 241 1.374 2.584 -3.876 1.00 1.00 H new ATOM 1974 N ALA B 242 -0.426 1.963 1.009 1.00 1.00 N ATOM 1975 CA ALA B 242 -1.358 2.288 2.082 1.00 1.00 C ATOM 1976 C ALA B 242 -0.621 2.398 3.412 1.00 1.00 C ATOM 1977 O ALA B 242 -0.822 3.354 4.162 1.00 1.00 O ATOM 1978 CB ALA B 242 -2.434 1.200 2.183 1.00 1.00 C ATOM 0 H ALA B 242 -0.610 1.077 0.538 1.00 1.00 H new ATOM 0 HA ALA B 242 -1.827 3.246 1.857 1.00 1.00 H new ATOM 0 HB1 ALA B 242 -3.128 1.448 2.986 1.00 1.00 H new ATOM 0 HB2 ALA B 242 -2.978 1.137 1.240 1.00 1.00 H new ATOM 0 HB3 ALA B 242 -1.962 0.240 2.394 1.00 1.00 H new ATOM 1984 N VAL B 243 0.234 1.417 3.699 1.00 1.00 N ATOM 1985 CA VAL B 243 0.990 1.426 4.946 1.00 1.00 C ATOM 1986 C VAL B 243 1.929 2.632 4.988 1.00 1.00 C ATOM 1987 O VAL B 243 1.901 3.415 5.934 1.00 1.00 O ATOM 1988 CB VAL B 243 1.806 0.136 5.063 1.00 1.00 C ATOM 1989 CG1 VAL B 243 2.673 0.191 6.322 1.00 1.00 C ATOM 1990 CG2 VAL B 243 0.856 -1.061 5.149 1.00 1.00 C ATOM 0 H VAL B 243 0.418 0.617 3.093 1.00 1.00 H new ATOM 0 HA VAL B 243 0.292 1.493 5.780 1.00 1.00 H new ATOM 0 HB VAL B 243 2.446 0.031 4.187 1.00 1.00 H new ATOM 0 HG11 VAL B 243 3.254 -0.728 6.404 1.00 1.00 H new ATOM 0 HG12 VAL B 243 3.350 1.043 6.261 1.00 1.00 H new ATOM 0 HG13 VAL B 243 2.035 0.297 7.199 1.00 1.00 H new ATOM 0 HG21 VAL B 243 1.436 -1.980 5.232 1.00 1.00 H new ATOM 0 HG22 VAL B 243 0.216 -0.955 6.025 1.00 1.00 H new ATOM 0 HG23 VAL B 243 0.239 -1.101 4.251 1.00 1.00 H new ATOM 2000 N ASP B 244 2.753 2.773 3.953 1.00 1.00 N ATOM 2001 CA ASP B 244 3.694 3.886 3.889 1.00 1.00 C ATOM 2002 C ASP B 244 2.964 5.193 4.165 1.00 1.00 C ATOM 2003 O ASP B 244 3.398 5.996 4.988 1.00 1.00 O ATOM 2004 CB ASP B 244 4.338 3.939 2.505 1.00 1.00 C ATOM 2005 CG ASP B 244 5.441 4.988 2.482 1.00 1.00 C ATOM 2006 OD1 ASP B 244 5.517 5.758 3.426 1.00 1.00 O ATOM 2007 OD2 ASP B 244 6.196 5.005 1.525 1.00 1.00 O ATOM 0 H ASP B 244 2.788 2.138 3.156 1.00 1.00 H new ATOM 0 HA ASP B 244 4.470 3.742 4.641 1.00 1.00 H new ATOM 0 HB2 ASP B 244 4.749 2.962 2.249 1.00 1.00 H new ATOM 0 HB3 ASP B 244 3.585 4.175 1.753 1.00 1.00 H new ATOM 2013 N GLN B 245 1.839 5.397 3.486 1.00 1.00 N ATOM 2014 CA GLN B 245 1.050 6.607 3.682 1.00 1.00 C ATOM 2015 C GLN B 245 0.529 6.680 5.111 1.00 1.00 C ATOM 2016 O GLN B 245 0.534 7.742 5.733 1.00 1.00 O ATOM 2017 CB GLN B 245 -0.130 6.619 2.706 1.00 1.00 C ATOM 2018 CG GLN B 245 0.375 6.919 1.293 1.00 1.00 C ATOM 2019 CD GLN B 245 -0.780 6.847 0.300 1.00 1.00 C ATOM 2020 OE1 GLN B 245 -1.699 6.048 0.472 1.00 1.00 O ATOM 2021 NE2 GLN B 245 -0.786 7.640 -0.737 1.00 1.00 N ATOM 0 H GLN B 245 1.456 4.746 2.801 1.00 1.00 H new ATOM 0 HA GLN B 245 1.688 7.471 3.496 1.00 1.00 H new ATOM 0 HB2 GLN B 245 -0.640 5.656 2.724 1.00 1.00 H new ATOM 0 HB3 GLN B 245 -0.859 7.371 3.010 1.00 1.00 H new ATOM 0 HG2 GLN B 245 0.830 7.909 1.263 1.00 1.00 H new ATOM 0 HG3 GLN B 245 1.149 6.204 1.015 1.00 1.00 H new ATOM 0 HE21 GLN B 245 -0.023 8.302 -0.877 1.00 1.00 H new ATOM 0 HE22 GLN B 245 -1.554 7.598 -1.407 1.00 1.00 H new ATOM 2030 N TYR B 246 0.081 5.542 5.630 1.00 1.00 N ATOM 2031 CA TYR B 246 -0.441 5.489 6.992 1.00 1.00 C ATOM 2032 C TYR B 246 0.630 5.908 7.990 1.00 1.00 C ATOM 2033 O TYR B 246 0.380 6.720 8.875 1.00 1.00 O ATOM 2034 CB TYR B 246 -0.908 4.068 7.314 1.00 1.00 C ATOM 2035 CG TYR B 246 -1.358 3.997 8.757 1.00 1.00 C ATOM 2036 CD1 TYR B 246 -2.528 4.652 9.157 1.00 1.00 C ATOM 2037 CD2 TYR B 246 -0.601 3.280 9.693 1.00 1.00 C ATOM 2038 CE1 TYR B 246 -2.942 4.589 10.493 1.00 1.00 C ATOM 2039 CE2 TYR B 246 -1.016 3.217 11.028 1.00 1.00 C ATOM 2040 CZ TYR B 246 -2.186 3.871 11.429 1.00 1.00 C ATOM 2041 OH TYR B 246 -2.594 3.810 12.744 1.00 1.00 O ATOM 0 H TYR B 246 0.068 4.651 5.134 1.00 1.00 H new ATOM 0 HA TYR B 246 -1.283 6.177 7.067 1.00 1.00 H new ATOM 0 HB2 TYR B 246 -1.727 3.785 6.653 1.00 1.00 H new ATOM 0 HB3 TYR B 246 -0.098 3.360 7.140 1.00 1.00 H new ATOM 0 HD1 TYR B 246 -3.111 5.206 8.436 1.00 1.00 H new ATOM 0 HD2 TYR B 246 0.303 2.776 9.384 1.00 1.00 H new ATOM 0 HE1 TYR B 246 -3.845 5.094 10.802 1.00 1.00 H new ATOM 0 HE2 TYR B 246 -0.433 2.663 11.749 1.00 1.00 H new ATOM 0 HH TYR B 246 -1.958 3.271 13.259 1.00 1.00 H new ATOM 2051 N LEU B 247 1.819 5.345 7.847 1.00 1.00 N ATOM 2052 CA LEU B 247 2.915 5.664 8.755 1.00 1.00 C ATOM 2053 C LEU B 247 3.254 7.144 8.686 1.00 1.00 C ATOM 2054 O LEU B 247 3.468 7.786 9.718 1.00 1.00 O ATOM 2055 CB LEU B 247 4.155 4.840 8.383 1.00 1.00 C ATOM 2056 CG LEU B 247 3.884 3.352 8.645 1.00 1.00 C ATOM 2057 CD1 LEU B 247 5.066 2.520 8.138 1.00 1.00 C ATOM 2058 CD2 LEU B 247 3.694 3.109 10.157 1.00 1.00 C ATOM 0 H LEU B 247 2.051 4.670 7.118 1.00 1.00 H new ATOM 0 HA LEU B 247 2.603 5.421 9.771 1.00 1.00 H new ATOM 0 HB2 LEU B 247 4.405 4.995 7.333 1.00 1.00 H new ATOM 0 HB3 LEU B 247 5.013 5.172 8.968 1.00 1.00 H new ATOM 0 HG LEU B 247 2.976 3.056 8.119 1.00 1.00 H new ATOM 0 HD11 LEU B 247 4.874 1.463 8.324 1.00 1.00 H new ATOM 0 HD12 LEU B 247 5.193 2.683 7.068 1.00 1.00 H new ATOM 0 HD13 LEU B 247 5.974 2.821 8.661 1.00 1.00 H new ATOM 0 HD21 LEU B 247 3.502 2.051 10.334 1.00 1.00 H new ATOM 0 HD22 LEU B 247 4.597 3.408 10.690 1.00 1.00 H new ATOM 0 HD23 LEU B 247 2.849 3.696 10.516 1.00 1.00 H new ATOM 2070 N ILE B 248 3.297 7.683 7.476 1.00 1.00 N ATOM 2071 CA ILE B 248 3.604 9.094 7.296 1.00 1.00 C ATOM 2072 C ILE B 248 2.504 9.965 7.902 1.00 1.00 C ATOM 2073 O ILE B 248 2.783 10.905 8.648 1.00 1.00 O ATOM 2074 CB ILE B 248 3.742 9.408 5.805 1.00 1.00 C ATOM 2075 CG1 ILE B 248 4.966 8.680 5.245 1.00 1.00 C ATOM 2076 CG2 ILE B 248 3.915 10.918 5.609 1.00 1.00 C ATOM 2077 CD1 ILE B 248 4.931 8.725 3.716 1.00 1.00 C ATOM 0 H ILE B 248 3.125 7.170 6.611 1.00 1.00 H new ATOM 0 HA ILE B 248 4.544 9.311 7.804 1.00 1.00 H new ATOM 0 HB ILE B 248 2.846 9.076 5.281 1.00 1.00 H new ATOM 0 HG12 ILE B 248 5.880 9.147 5.612 1.00 1.00 H new ATOM 0 HG13 ILE B 248 4.976 7.646 5.589 1.00 1.00 H new ATOM 0 HG21 ILE B 248 4.013 11.138 4.546 1.00 1.00 H new ATOM 0 HG22 ILE B 248 3.045 11.439 6.009 1.00 1.00 H new ATOM 0 HG23 ILE B 248 4.810 11.253 6.133 1.00 1.00 H new ATOM 0 HD11 ILE B 248 5.803 8.207 3.317 1.00 1.00 H new ATOM 0 HD12 ILE B 248 4.024 8.238 3.358 1.00 1.00 H new ATOM 0 HD13 ILE B 248 4.942 9.763 3.382 1.00 1.00 H new ATOM 2089 N ASN B 249 1.255 9.646 7.574 1.00 1.00 N ATOM 2090 CA ASN B 249 0.126 10.405 8.092 1.00 1.00 C ATOM 2091 C ASN B 249 0.014 10.232 9.612 1.00 1.00 C ATOM 2092 O ASN B 249 -0.227 11.201 10.329 1.00 1.00 O ATOM 2093 CB ASN B 249 -1.170 9.939 7.423 1.00 1.00 C ATOM 2094 CG ASN B 249 -2.343 10.786 7.905 1.00 1.00 C ATOM 2095 OD1 ASN B 249 -2.267 12.016 7.895 1.00 1.00 O ATOM 2096 ND2 ASN B 249 -3.429 10.201 8.329 1.00 1.00 N ATOM 0 H ASN B 249 1.003 8.874 6.957 1.00 1.00 H new ATOM 0 HA ASN B 249 0.288 11.460 7.869 1.00 1.00 H new ATOM 0 HB2 ASN B 249 -1.077 10.016 6.340 1.00 1.00 H new ATOM 0 HB3 ASN B 249 -1.350 8.889 7.654 1.00 1.00 H new ATOM 0 HD21 ASN B 249 -4.217 10.762 8.653 1.00 1.00 H new ATOM 0 HD22 ASN B 249 -3.490 9.183 8.337 1.00 1.00 H new