USER MOD reduce.3.24.130724 H: found=0, std=0, add=749, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 750 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 215 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 218 THR OG1 : rot -24:sc= 0.239 USER MOD Set 2.1: A 191 HIS : no HD1:sc= -9.83! C(o=-18!,f=-21!) USER MOD Set 2.2: A 201 HIS : no HD1:sc= -7.99! C(o=-18!,f=-19!) USER MOD Single : A 141 HIS : no HD1:sc= 0 X(o=0,f=-0.00053) USER MOD Single : A 146 ASN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ -154:sc= -2.78! (180deg=-4.63!) USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 ASN : amide:sc= -0.59 X(o=-0.59,f=-0.19) USER MOD Single : A 156 MET CE :methyl -153:sc= -1.13 (180deg=-2.4!) USER MOD Single : A 157 MET CE :methyl -167:sc= -0.0119 (180deg=-0.117) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 163 GLN : amide:sc= -0.324 K(o=-0.32,f=-2.8!) USER MOD Single : A 170 ASN : amide:sc= -0.132 K(o=-0.13,f=-2.1!) USER MOD Single : A 172 ASN : amide:sc= 0 X(o=0,f=-0.068) USER MOD Single : A 173 ASN : amide:sc= -0.331 K(o=-0.33,f=-1.4!) USER MOD Single : A 174 ASN : amide:sc= -0.0363 K(o=-0.036,f=-1.9!) USER MOD Single : A 175 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 177 LYS NZ :NH3+ -137:sc= 1.2 (180deg=-1.36) USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 GLN : amide:sc=-0.00891 K(o=-0.0089,f=-1.2) USER MOD Single : A 182 MET CE :methyl -103:sc= -0.0697 (180deg=-0.895) USER MOD Single : A 183 THR OG1 : rot 180:sc= 0 USER MOD Single : A 184 SER OG : rot 180:sc= 0 USER MOD Single : A 185 TYR OH : rot 180:sc= 0 USER MOD Single : A 186 HIS : no HD1:sc= -0.0361 X(o=-0.036,f=-0.12) USER MOD Single : A 188 MET CE :methyl -151:sc= -0.405 (180deg=-1.4!) USER MOD Single : A 196 TYR OH : rot 165:sc= 0 USER MOD Single : A 199 MET CE :methyl -167:sc= -8.28! (180deg=-9.09!) USER MOD Single : A 202 ASN : amide:sc= 0.23 K(o=0.23,f=-4.3!) USER MOD Single : A 205 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 206 THR OG1 : rot 180:sc= 0 USER MOD Single : A 208 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 213 ASN : amide:sc= -1.04 K(o=-1,f=-5.1!) USER MOD Single : A 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 216 SER OG : rot 180:sc= -0.095 USER MOD Single : A 217 ASN : amide:sc= -0.085 X(o=-0.085,f=-0.085) USER MOD Single : A 223 GLN :FLIP amide:sc= -0.333 F(o=-2,f=-0.33) USER MOD Single : A 226 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 143 N ASP A 139 11.806 -4.054 11.101 1.00 0.00 N ATOM 144 CA ASP A 139 12.347 -3.970 9.749 1.00 0.00 C ATOM 145 C ASP A 139 11.243 -4.144 8.711 1.00 0.00 C ATOM 146 O ASP A 139 10.874 -5.267 8.364 1.00 0.00 O ATOM 147 CB ASP A 139 13.430 -5.030 9.544 1.00 0.00 C ATOM 148 CG ASP A 139 14.716 -4.692 10.272 1.00 0.00 C ATOM 149 OD1 ASP A 139 15.299 -3.627 9.982 1.00 0.00 O ATOM 150 OD2 ASP A 139 15.140 -5.494 11.130 1.00 0.00 O ATOM 0 HA ASP A 139 12.789 -2.982 9.621 1.00 0.00 H new ATOM 0 HB2 ASP A 139 13.061 -5.994 9.893 1.00 0.00 H new ATOM 0 HB3 ASP A 139 13.636 -5.134 8.479 1.00 0.00 H new ATOM 155 N LEU A 140 10.720 -3.027 8.218 1.00 0.00 N ATOM 156 CA LEU A 140 9.657 -3.056 7.219 1.00 0.00 C ATOM 157 C LEU A 140 10.080 -3.865 5.997 1.00 0.00 C ATOM 158 O LEU A 140 9.389 -4.798 5.588 1.00 0.00 O ATOM 159 CB LEU A 140 9.286 -1.632 6.800 1.00 0.00 C ATOM 160 CG LEU A 140 8.713 -0.737 7.898 1.00 0.00 C ATOM 161 CD1 LEU A 140 8.795 0.726 7.491 1.00 0.00 C ATOM 162 CD2 LEU A 140 7.275 -1.126 8.208 1.00 0.00 C ATOM 0 H LEU A 140 11.014 -2.090 8.493 1.00 0.00 H new ATOM 0 HA LEU A 140 8.786 -3.536 7.665 1.00 0.00 H new ATOM 0 HB2 LEU A 140 10.176 -1.151 6.394 1.00 0.00 H new ATOM 0 HB3 LEU A 140 8.558 -1.691 5.991 1.00 0.00 H new ATOM 0 HG LEU A 140 9.308 -0.876 8.800 1.00 0.00 H new ATOM 0 HD11 LEU A 140 8.382 1.348 8.285 1.00 0.00 H new ATOM 0 HD12 LEU A 140 9.837 0.998 7.321 1.00 0.00 H new ATOM 0 HD13 LEU A 140 8.225 0.881 6.575 1.00 0.00 H new ATOM 0 HD21 LEU A 140 6.884 -0.478 8.992 1.00 0.00 H new ATOM 0 HD22 LEU A 140 6.667 -1.017 7.310 1.00 0.00 H new ATOM 0 HD23 LEU A 140 7.243 -2.162 8.544 1.00 0.00 H new ATOM 174 N HIS A 141 11.221 -3.502 5.420 1.00 0.00 N ATOM 175 CA HIS A 141 11.738 -4.196 4.246 1.00 0.00 C ATOM 176 C HIS A 141 11.654 -5.708 4.428 1.00 0.00 C ATOM 177 O HIS A 141 11.255 -6.431 3.515 1.00 0.00 O ATOM 178 CB HIS A 141 13.186 -3.783 3.979 1.00 0.00 C ATOM 179 CG HIS A 141 13.754 -4.366 2.722 1.00 0.00 C ATOM 180 ND1 HIS A 141 14.965 -5.024 2.679 1.00 0.00 N ATOM 181 CD2 HIS A 141 13.268 -4.390 1.459 1.00 0.00 C ATOM 182 CE1 HIS A 141 15.201 -5.426 1.442 1.00 0.00 C ATOM 183 NE2 HIS A 141 14.186 -5.054 0.683 1.00 0.00 N ATOM 0 H HIS A 141 11.805 -2.732 5.746 1.00 0.00 H new ATOM 0 HA HIS A 141 11.124 -3.916 3.390 1.00 0.00 H new ATOM 0 HB2 HIS A 141 13.240 -2.696 3.922 1.00 0.00 H new ATOM 0 HB3 HIS A 141 13.804 -4.089 4.823 1.00 0.00 H new ATOM 0 HD2 HIS A 141 12.333 -3.966 1.124 1.00 0.00 H new ATOM 0 HE1 HIS A 141 16.075 -5.966 1.109 1.00 0.00 H new ATOM 0 HE2 HIS A 141 14.098 -5.231 -0.318 1.00 0.00 H new ATOM 192 N GLU A 142 12.032 -6.179 5.612 1.00 0.00 N ATOM 193 CA GLU A 142 12.000 -7.606 5.911 1.00 0.00 C ATOM 194 C GLU A 142 10.601 -8.175 5.699 1.00 0.00 C ATOM 195 O GLU A 142 10.434 -9.232 5.089 1.00 0.00 O ATOM 196 CB GLU A 142 12.452 -7.857 7.352 1.00 0.00 C ATOM 197 CG GLU A 142 13.951 -8.063 7.492 1.00 0.00 C ATOM 198 CD GLU A 142 14.409 -9.404 6.951 1.00 0.00 C ATOM 199 OE1 GLU A 142 14.011 -10.441 7.521 1.00 0.00 O ATOM 200 OE2 GLU A 142 15.165 -9.414 5.957 1.00 0.00 O ATOM 0 H GLU A 142 12.364 -5.594 6.379 1.00 0.00 H new ATOM 0 HA GLU A 142 12.685 -8.110 5.229 1.00 0.00 H new ATOM 0 HB2 GLU A 142 12.150 -7.012 7.971 1.00 0.00 H new ATOM 0 HB3 GLU A 142 11.935 -8.736 7.738 1.00 0.00 H new ATOM 0 HG2 GLU A 142 14.474 -7.265 6.965 1.00 0.00 H new ATOM 0 HG3 GLU A 142 14.228 -7.986 8.543 1.00 0.00 H new ATOM 207 N PHE A 143 9.597 -7.468 6.206 1.00 0.00 N ATOM 208 CA PHE A 143 8.211 -7.902 6.074 1.00 0.00 C ATOM 209 C PHE A 143 7.793 -7.947 4.607 1.00 0.00 C ATOM 210 O PHE A 143 7.440 -9.004 4.082 1.00 0.00 O ATOM 211 CB PHE A 143 7.284 -6.966 6.852 1.00 0.00 C ATOM 212 CG PHE A 143 5.852 -7.417 6.867 1.00 0.00 C ATOM 213 CD1 PHE A 143 5.056 -7.279 5.742 1.00 0.00 C ATOM 214 CD2 PHE A 143 5.301 -7.980 8.008 1.00 0.00 C ATOM 215 CE1 PHE A 143 3.738 -7.693 5.752 1.00 0.00 C ATOM 216 CE2 PHE A 143 3.983 -8.396 8.024 1.00 0.00 C ATOM 217 CZ PHE A 143 3.200 -8.252 6.895 1.00 0.00 C ATOM 0 H PHE A 143 9.717 -6.591 6.713 1.00 0.00 H new ATOM 0 HA PHE A 143 8.130 -8.907 6.488 1.00 0.00 H new ATOM 0 HB2 PHE A 143 7.642 -6.884 7.878 1.00 0.00 H new ATOM 0 HB3 PHE A 143 7.338 -5.969 6.415 1.00 0.00 H new ATOM 0 HD1 PHE A 143 5.471 -6.842 4.846 1.00 0.00 H new ATOM 0 HD2 PHE A 143 5.908 -8.095 8.894 1.00 0.00 H new ATOM 0 HE1 PHE A 143 3.129 -7.580 4.867 1.00 0.00 H new ATOM 0 HE2 PHE A 143 3.565 -8.833 8.919 1.00 0.00 H new ATOM 0 HZ PHE A 143 2.170 -8.576 6.906 1.00 0.00 H new ATOM 227 N LEU A 144 7.834 -6.793 3.951 1.00 0.00 N ATOM 228 CA LEU A 144 7.459 -6.698 2.545 1.00 0.00 C ATOM 229 C LEU A 144 7.929 -7.926 1.772 1.00 0.00 C ATOM 230 O LEU A 144 7.124 -8.647 1.183 1.00 0.00 O ATOM 231 CB LEU A 144 8.052 -5.432 1.923 1.00 0.00 C ATOM 232 CG LEU A 144 7.601 -4.107 2.538 1.00 0.00 C ATOM 233 CD1 LEU A 144 8.514 -2.975 2.095 1.00 0.00 C ATOM 234 CD2 LEU A 144 6.157 -3.809 2.162 1.00 0.00 C ATOM 0 H LEU A 144 8.123 -5.909 4.371 1.00 0.00 H new ATOM 0 HA LEU A 144 6.372 -6.649 2.487 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.138 -5.491 1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 144 7.802 -5.421 0.862 1.00 0.00 H new ATOM 0 HG LEU A 144 7.663 -4.192 3.623 1.00 0.00 H new ATOM 0 HD11 LEU A 144 8.178 -2.040 2.543 1.00 0.00 H new ATOM 0 HD12 LEU A 144 9.535 -3.184 2.415 1.00 0.00 H new ATOM 0 HD13 LEU A 144 8.485 -2.888 1.009 1.00 0.00 H new ATOM 0 HD21 LEU A 144 5.853 -2.862 2.608 1.00 0.00 H new ATOM 0 HD22 LEU A 144 6.069 -3.744 1.077 1.00 0.00 H new ATOM 0 HD23 LEU A 144 5.513 -4.607 2.530 1.00 0.00 H new ATOM 246 N VAL A 145 9.238 -8.160 1.781 1.00 0.00 N ATOM 247 CA VAL A 145 9.815 -9.303 1.084 1.00 0.00 C ATOM 248 C VAL A 145 9.159 -10.606 1.528 1.00 0.00 C ATOM 249 O VAL A 145 8.812 -11.450 0.703 1.00 0.00 O ATOM 250 CB VAL A 145 11.334 -9.398 1.323 1.00 0.00 C ATOM 251 CG1 VAL A 145 11.896 -10.660 0.689 1.00 0.00 C ATOM 252 CG2 VAL A 145 12.036 -8.161 0.784 1.00 0.00 C ATOM 0 H VAL A 145 9.918 -7.573 2.263 1.00 0.00 H new ATOM 0 HA VAL A 145 9.631 -9.151 0.020 1.00 0.00 H new ATOM 0 HB VAL A 145 11.513 -9.450 2.397 1.00 0.00 H new ATOM 0 HG11 VAL A 145 12.970 -10.710 0.868 1.00 0.00 H new ATOM 0 HG12 VAL A 145 11.414 -11.533 1.128 1.00 0.00 H new ATOM 0 HG13 VAL A 145 11.708 -10.643 -0.384 1.00 0.00 H new ATOM 0 HG21 VAL A 145 13.108 -8.245 0.961 1.00 0.00 H new ATOM 0 HG22 VAL A 145 11.851 -8.075 -0.287 1.00 0.00 H new ATOM 0 HG23 VAL A 145 11.653 -7.275 1.291 1.00 0.00 H new ATOM 262 N ASN A 146 8.992 -10.762 2.837 1.00 0.00 N ATOM 263 CA ASN A 146 8.378 -11.962 3.392 1.00 0.00 C ATOM 264 C ASN A 146 7.065 -12.279 2.682 1.00 0.00 C ATOM 265 O ASN A 146 6.728 -13.443 2.464 1.00 0.00 O ATOM 266 CB ASN A 146 8.131 -11.788 4.891 1.00 0.00 C ATOM 267 CG ASN A 146 7.917 -13.112 5.600 1.00 0.00 C ATOM 268 OD1 ASN A 146 8.748 -14.016 5.512 1.00 0.00 O ATOM 269 ND2 ASN A 146 6.799 -13.231 6.307 1.00 0.00 N ATOM 0 H ASN A 146 9.274 -10.072 3.533 1.00 0.00 H new ATOM 0 HA ASN A 146 9.064 -12.795 3.239 1.00 0.00 H new ATOM 0 HB2 ASN A 146 8.981 -11.272 5.339 1.00 0.00 H new ATOM 0 HB3 ASN A 146 7.258 -11.153 5.041 1.00 0.00 H new ATOM 0 HD21 ASN A 146 6.601 -14.099 6.806 1.00 0.00 H new ATOM 0 HD22 ASN A 146 6.139 -12.455 6.351 1.00 0.00 H new ATOM 276 N THR A 147 6.326 -11.234 2.323 1.00 0.00 N ATOM 277 CA THR A 147 5.050 -11.399 1.638 1.00 0.00 C ATOM 278 C THR A 147 5.255 -11.764 0.172 1.00 0.00 C ATOM 279 O THR A 147 4.568 -12.635 -0.364 1.00 0.00 O ATOM 280 CB THR A 147 4.197 -10.119 1.722 1.00 0.00 C ATOM 281 OG1 THR A 147 4.123 -9.668 3.079 1.00 0.00 O ATOM 282 CG2 THR A 147 2.795 -10.367 1.187 1.00 0.00 C ATOM 0 H THR A 147 6.590 -10.264 2.495 1.00 0.00 H new ATOM 0 HA THR A 147 4.525 -12.211 2.141 1.00 0.00 H new ATOM 0 HB THR A 147 4.671 -9.352 1.110 1.00 0.00 H new ATOM 0 HG1 THR A 147 3.581 -8.853 3.124 1.00 0.00 H new ATOM 0 HG21 THR A 147 2.211 -9.449 1.257 1.00 0.00 H new ATOM 0 HG22 THR A 147 2.854 -10.682 0.145 1.00 0.00 H new ATOM 0 HG23 THR A 147 2.314 -11.148 1.775 1.00 0.00 H new ATOM 290 N LEU A 148 6.205 -11.094 -0.471 1.00 0.00 N ATOM 291 CA LEU A 148 6.502 -11.349 -1.877 1.00 0.00 C ATOM 292 C LEU A 148 6.858 -12.815 -2.101 1.00 0.00 C ATOM 293 O LEU A 148 6.101 -13.561 -2.722 1.00 0.00 O ATOM 294 CB LEU A 148 7.652 -10.456 -2.345 1.00 0.00 C ATOM 295 CG LEU A 148 7.285 -9.009 -2.680 1.00 0.00 C ATOM 296 CD1 LEU A 148 8.523 -8.127 -2.665 1.00 0.00 C ATOM 297 CD2 LEU A 148 6.591 -8.935 -4.032 1.00 0.00 C ATOM 0 H LEU A 148 6.782 -10.371 -0.042 1.00 0.00 H new ATOM 0 HA LEU A 148 5.610 -11.118 -2.459 1.00 0.00 H new ATOM 0 HB2 LEU A 148 8.417 -10.445 -1.568 1.00 0.00 H new ATOM 0 HB3 LEU A 148 8.101 -10.910 -3.228 1.00 0.00 H new ATOM 0 HG LEU A 148 6.595 -8.644 -1.919 1.00 0.00 H new ATOM 0 HD11 LEU A 148 8.242 -7.102 -2.906 1.00 0.00 H new ATOM 0 HD12 LEU A 148 8.978 -8.156 -1.675 1.00 0.00 H new ATOM 0 HD13 LEU A 148 9.238 -8.490 -3.404 1.00 0.00 H new ATOM 0 HD21 LEU A 148 6.337 -7.899 -4.254 1.00 0.00 H new ATOM 0 HD22 LEU A 148 7.257 -9.319 -4.804 1.00 0.00 H new ATOM 0 HD23 LEU A 148 5.681 -9.534 -4.007 1.00 0.00 H new ATOM 309 N LYS A 149 8.015 -13.223 -1.589 1.00 0.00 N ATOM 310 CA LYS A 149 8.471 -14.600 -1.730 1.00 0.00 C ATOM 311 C LYS A 149 7.375 -15.581 -1.326 1.00 0.00 C ATOM 312 O LYS A 149 6.858 -16.327 -2.158 1.00 0.00 O ATOM 313 CB LYS A 149 9.719 -14.835 -0.876 1.00 0.00 C ATOM 314 CG LYS A 149 11.013 -14.442 -1.569 1.00 0.00 C ATOM 315 CD LYS A 149 11.373 -12.991 -1.295 1.00 0.00 C ATOM 316 CE LYS A 149 12.163 -12.386 -2.445 1.00 0.00 C ATOM 317 NZ LYS A 149 12.020 -10.905 -2.497 1.00 0.00 N ATOM 0 H LYS A 149 8.654 -12.618 -1.072 1.00 0.00 H new ATOM 0 HA LYS A 149 8.717 -14.769 -2.778 1.00 0.00 H new ATOM 0 HB2 LYS A 149 9.627 -14.269 0.051 1.00 0.00 H new ATOM 0 HB3 LYS A 149 9.769 -15.889 -0.602 1.00 0.00 H new ATOM 0 HG2 LYS A 149 11.821 -15.089 -1.228 1.00 0.00 H new ATOM 0 HG3 LYS A 149 10.913 -14.597 -2.643 1.00 0.00 H new ATOM 0 HD2 LYS A 149 10.463 -12.413 -1.134 1.00 0.00 H new ATOM 0 HD3 LYS A 149 11.958 -12.927 -0.377 1.00 0.00 H new ATOM 0 HE2 LYS A 149 13.216 -12.646 -2.338 1.00 0.00 H new ATOM 0 HE3 LYS A 149 11.822 -12.817 -3.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 12.172 -10.576 -3.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 11.064 -10.637 -2.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 12.724 -10.466 -1.870 1.00 0.00 H new ATOM 331 N LYS A 150 7.023 -15.573 -0.045 1.00 0.00 N ATOM 332 CA LYS A 150 5.985 -16.459 0.469 1.00 0.00 C ATOM 333 C LYS A 150 4.746 -16.418 -0.419 1.00 0.00 C ATOM 334 O LYS A 150 4.200 -17.458 -0.787 1.00 0.00 O ATOM 335 CB LYS A 150 5.613 -16.066 1.900 1.00 0.00 C ATOM 336 CG LYS A 150 6.762 -16.197 2.885 1.00 0.00 C ATOM 337 CD LYS A 150 6.846 -17.601 3.460 1.00 0.00 C ATOM 338 CE LYS A 150 8.107 -17.789 4.289 1.00 0.00 C ATOM 339 NZ LYS A 150 9.287 -18.110 3.438 1.00 0.00 N ATOM 0 H LYS A 150 7.441 -14.962 0.657 1.00 0.00 H new ATOM 0 HA LYS A 150 6.377 -17.476 0.468 1.00 0.00 H new ATOM 0 HB2 LYS A 150 5.258 -15.036 1.904 1.00 0.00 H new ATOM 0 HB3 LYS A 150 4.785 -16.690 2.236 1.00 0.00 H new ATOM 0 HG2 LYS A 150 7.700 -15.950 2.387 1.00 0.00 H new ATOM 0 HG3 LYS A 150 6.632 -15.478 3.694 1.00 0.00 H new ATOM 0 HD2 LYS A 150 5.970 -17.795 4.079 1.00 0.00 H new ATOM 0 HD3 LYS A 150 6.831 -18.329 2.649 1.00 0.00 H new ATOM 0 HE2 LYS A 150 8.306 -16.881 4.859 1.00 0.00 H new ATOM 0 HE3 LYS A 150 7.951 -18.591 5.011 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 10.127 -18.231 4.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 9.108 -18.990 2.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 9.452 -17.334 2.766 1.00 0.00 H new ATOM 353 N ASN A 151 4.307 -15.211 -0.761 1.00 0.00 N ATOM 354 CA ASN A 151 3.132 -15.036 -1.607 1.00 0.00 C ATOM 355 C ASN A 151 3.527 -14.513 -2.985 1.00 0.00 C ATOM 356 O ASN A 151 3.466 -13.315 -3.262 1.00 0.00 O ATOM 357 CB ASN A 151 2.143 -14.073 -0.948 1.00 0.00 C ATOM 358 CG ASN A 151 1.929 -14.380 0.522 1.00 0.00 C ATOM 359 OD1 ASN A 151 0.883 -14.898 0.913 1.00 0.00 O ATOM 360 ND2 ASN A 151 2.922 -14.061 1.343 1.00 0.00 N ATOM 0 H ASN A 151 4.747 -14.340 -0.465 1.00 0.00 H new ATOM 0 HA ASN A 151 2.655 -16.008 -1.730 1.00 0.00 H new ATOM 0 HB2 ASN A 151 2.509 -13.052 -1.053 1.00 0.00 H new ATOM 0 HB3 ASN A 151 1.187 -14.124 -1.470 1.00 0.00 H new ATOM 0 HD21 ASN A 151 2.836 -14.244 2.343 1.00 0.00 H new ATOM 0 HD22 ASN A 151 3.771 -13.633 0.974 1.00 0.00 H new ATOM 367 N PRO A 152 3.943 -15.431 -3.870 1.00 0.00 N ATOM 368 CA PRO A 152 4.355 -15.087 -5.234 1.00 0.00 C ATOM 369 C PRO A 152 3.181 -14.642 -6.099 1.00 0.00 C ATOM 370 O PRO A 152 3.370 -14.141 -7.208 1.00 0.00 O ATOM 371 CB PRO A 152 4.946 -16.394 -5.766 1.00 0.00 C ATOM 372 CG PRO A 152 4.280 -17.463 -4.971 1.00 0.00 C ATOM 373 CD PRO A 152 4.042 -16.877 -3.607 1.00 0.00 C ATOM 0 HA PRO A 152 5.053 -14.250 -5.250 1.00 0.00 H new ATOM 0 HB2 PRO A 152 4.749 -16.512 -6.832 1.00 0.00 H new ATOM 0 HB3 PRO A 152 6.028 -16.421 -5.637 1.00 0.00 H new ATOM 0 HG2 PRO A 152 3.341 -17.767 -5.435 1.00 0.00 H new ATOM 0 HG3 PRO A 152 4.908 -18.352 -4.910 1.00 0.00 H new ATOM 0 HD2 PRO A 152 3.130 -17.267 -3.156 1.00 0.00 H new ATOM 0 HD3 PRO A 152 4.859 -17.106 -2.923 1.00 0.00 H new ATOM 381 N ARG A 153 1.969 -14.827 -5.585 1.00 0.00 N ATOM 382 CA ARG A 153 0.765 -14.444 -6.312 1.00 0.00 C ATOM 383 C ARG A 153 0.354 -13.015 -5.971 1.00 0.00 C ATOM 384 O ARG A 153 -0.092 -12.263 -6.837 1.00 0.00 O ATOM 385 CB ARG A 153 -0.380 -15.406 -5.986 1.00 0.00 C ATOM 386 CG ARG A 153 -1.580 -15.258 -6.906 1.00 0.00 C ATOM 387 CD ARG A 153 -2.864 -15.704 -6.224 1.00 0.00 C ATOM 388 NE ARG A 153 -3.069 -17.146 -6.333 1.00 0.00 N ATOM 389 CZ ARG A 153 -3.430 -17.754 -7.458 1.00 0.00 C ATOM 390 NH1 ARG A 153 -3.624 -17.048 -8.564 1.00 0.00 N ATOM 391 NH2 ARG A 153 -3.597 -19.070 -7.479 1.00 0.00 N ATOM 0 H ARG A 153 1.795 -15.240 -4.668 1.00 0.00 H new ATOM 0 HA ARG A 153 0.983 -14.496 -7.379 1.00 0.00 H new ATOM 0 HB2 ARG A 153 -0.011 -16.430 -6.046 1.00 0.00 H new ATOM 0 HB3 ARG A 153 -0.699 -15.242 -4.957 1.00 0.00 H new ATOM 0 HG2 ARG A 153 -1.675 -14.218 -7.218 1.00 0.00 H new ATOM 0 HG3 ARG A 153 -1.422 -15.848 -7.809 1.00 0.00 H new ATOM 0 HD2 ARG A 153 -2.833 -15.421 -5.172 1.00 0.00 H new ATOM 0 HD3 ARG A 153 -3.711 -15.183 -6.670 1.00 0.00 H new ATOM 0 HE ARG A 153 -2.927 -17.717 -5.500 1.00 0.00 H new ATOM 0 HH11 ARG A 153 -3.496 -16.036 -8.552 1.00 0.00 H new ATOM 0 HH12 ARG A 153 -3.901 -17.517 -9.426 1.00 0.00 H new ATOM 0 HH21 ARG A 153 -3.448 -19.617 -6.631 1.00 0.00 H new ATOM 0 HH22 ARG A 153 -3.874 -19.535 -8.343 1.00 0.00 H new ATOM 405 N ASP A 154 0.508 -12.647 -4.703 1.00 0.00 N ATOM 406 CA ASP A 154 0.155 -11.308 -4.248 1.00 0.00 C ATOM 407 C ASP A 154 1.050 -10.258 -4.899 1.00 0.00 C ATOM 408 O ASP A 154 0.716 -9.073 -4.924 1.00 0.00 O ATOM 409 CB ASP A 154 0.268 -11.218 -2.725 1.00 0.00 C ATOM 410 CG ASP A 154 -0.958 -11.764 -2.020 1.00 0.00 C ATOM 411 OD1 ASP A 154 -1.593 -12.692 -2.566 1.00 0.00 O ATOM 412 OD2 ASP A 154 -1.283 -11.265 -0.923 1.00 0.00 O ATOM 0 H ASP A 154 0.875 -13.258 -3.973 1.00 0.00 H new ATOM 0 HA ASP A 154 -0.876 -11.112 -4.541 1.00 0.00 H new ATOM 0 HB2 ASP A 154 1.149 -11.770 -2.396 1.00 0.00 H new ATOM 0 HB3 ASP A 154 0.417 -10.178 -2.436 1.00 0.00 H new ATOM 417 N ARG A 155 2.187 -10.701 -5.425 1.00 0.00 N ATOM 418 CA ARG A 155 3.131 -9.800 -6.074 1.00 0.00 C ATOM 419 C ARG A 155 2.420 -8.907 -7.087 1.00 0.00 C ATOM 420 O ARG A 155 2.695 -7.710 -7.175 1.00 0.00 O ATOM 421 CB ARG A 155 4.236 -10.598 -6.769 1.00 0.00 C ATOM 422 CG ARG A 155 3.793 -11.245 -8.071 1.00 0.00 C ATOM 423 CD ARG A 155 4.826 -12.238 -8.580 1.00 0.00 C ATOM 424 NE ARG A 155 4.296 -13.081 -9.647 1.00 0.00 N ATOM 425 CZ ARG A 155 5.059 -13.794 -10.468 1.00 0.00 C ATOM 426 NH1 ARG A 155 6.379 -13.765 -10.344 1.00 0.00 N ATOM 427 NH2 ARG A 155 4.503 -14.538 -11.416 1.00 0.00 N ATOM 0 H ARG A 155 2.477 -11.679 -5.414 1.00 0.00 H new ATOM 0 HA ARG A 155 3.577 -9.167 -5.307 1.00 0.00 H new ATOM 0 HB2 ARG A 155 5.079 -9.936 -6.970 1.00 0.00 H new ATOM 0 HB3 ARG A 155 4.594 -11.373 -6.091 1.00 0.00 H new ATOM 0 HG2 ARG A 155 2.841 -11.754 -7.920 1.00 0.00 H new ATOM 0 HG3 ARG A 155 3.626 -10.474 -8.823 1.00 0.00 H new ATOM 0 HD2 ARG A 155 5.699 -11.697 -8.945 1.00 0.00 H new ATOM 0 HD3 ARG A 155 5.162 -12.866 -7.755 1.00 0.00 H new ATOM 0 HE ARG A 155 3.284 -13.125 -9.769 1.00 0.00 H new ATOM 0 HH11 ARG A 155 6.811 -13.194 -9.617 1.00 0.00 H new ATOM 0 HH12 ARG A 155 6.963 -14.313 -10.976 1.00 0.00 H new ATOM 0 HH21 ARG A 155 3.488 -14.563 -11.515 1.00 0.00 H new ATOM 0 HH22 ARG A 155 5.091 -15.085 -12.045 1.00 0.00 H new ATOM 441 N MET A 156 1.506 -9.497 -7.850 1.00 0.00 N ATOM 442 CA MET A 156 0.756 -8.754 -8.856 1.00 0.00 C ATOM 443 C MET A 156 0.263 -7.424 -8.295 1.00 0.00 C ATOM 444 O MET A 156 0.717 -6.358 -8.710 1.00 0.00 O ATOM 445 CB MET A 156 -0.431 -9.583 -9.353 1.00 0.00 C ATOM 446 CG MET A 156 -0.104 -10.450 -10.558 1.00 0.00 C ATOM 447 SD MET A 156 1.366 -11.464 -10.307 1.00 0.00 S ATOM 448 CE MET A 156 0.627 -12.998 -9.750 1.00 0.00 C ATOM 0 H MET A 156 1.267 -10.487 -7.791 1.00 0.00 H new ATOM 0 HA MET A 156 1.423 -8.549 -9.693 1.00 0.00 H new ATOM 0 HB2 MET A 156 -0.784 -10.220 -8.542 1.00 0.00 H new ATOM 0 HB3 MET A 156 -1.250 -8.912 -9.610 1.00 0.00 H new ATOM 0 HG2 MET A 156 -0.954 -11.097 -10.776 1.00 0.00 H new ATOM 0 HG3 MET A 156 0.044 -9.813 -11.430 1.00 0.00 H new ATOM 0 HE1 MET A 156 1.336 -13.536 -9.120 1.00 0.00 H new ATOM 0 HE2 MET A 156 -0.275 -12.781 -9.178 1.00 0.00 H new ATOM 0 HE3 MET A 156 0.370 -13.612 -10.613 1.00 0.00 H new ATOM 458 N MET A 157 -0.669 -7.495 -7.350 1.00 0.00 N ATOM 459 CA MET A 157 -1.223 -6.296 -6.731 1.00 0.00 C ATOM 460 C MET A 157 -0.117 -5.435 -6.129 1.00 0.00 C ATOM 461 O MET A 157 0.132 -4.318 -6.584 1.00 0.00 O ATOM 462 CB MET A 157 -2.236 -6.675 -5.650 1.00 0.00 C ATOM 463 CG MET A 157 -2.640 -5.511 -4.760 1.00 0.00 C ATOM 464 SD MET A 157 -1.583 -5.348 -3.308 1.00 0.00 S ATOM 465 CE MET A 157 -2.807 -5.085 -2.027 1.00 0.00 C ATOM 0 H MET A 157 -1.056 -8.370 -6.996 1.00 0.00 H new ATOM 0 HA MET A 157 -1.729 -5.718 -7.505 1.00 0.00 H new ATOM 0 HB2 MET A 157 -3.127 -7.084 -6.126 1.00 0.00 H new ATOM 0 HB3 MET A 157 -1.814 -7.466 -5.030 1.00 0.00 H new ATOM 0 HG2 MET A 157 -2.603 -4.587 -5.337 1.00 0.00 H new ATOM 0 HG3 MET A 157 -3.673 -5.645 -4.439 1.00 0.00 H new ATOM 0 HE1 MET A 157 -2.314 -4.739 -1.118 1.00 0.00 H new ATOM 0 HE2 MET A 157 -3.525 -4.335 -2.358 1.00 0.00 H new ATOM 0 HE3 MET A 157 -3.328 -6.021 -1.824 1.00 0.00 H new ATOM 475 N LEU A 158 0.544 -5.961 -5.103 1.00 0.00 N ATOM 476 CA LEU A 158 1.624 -5.240 -4.438 1.00 0.00 C ATOM 477 C LEU A 158 2.386 -4.366 -5.429 1.00 0.00 C ATOM 478 O LEU A 158 2.817 -3.262 -5.095 1.00 0.00 O ATOM 479 CB LEU A 158 2.582 -6.225 -3.766 1.00 0.00 C ATOM 480 CG LEU A 158 2.111 -6.821 -2.439 1.00 0.00 C ATOM 481 CD1 LEU A 158 3.020 -7.963 -2.014 1.00 0.00 C ATOM 482 CD2 LEU A 158 2.059 -5.748 -1.361 1.00 0.00 C ATOM 0 H LEU A 158 0.351 -6.884 -4.714 1.00 0.00 H new ATOM 0 HA LEU A 158 1.184 -4.595 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.776 -7.043 -4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 158 3.532 -5.718 -3.597 1.00 0.00 H new ATOM 0 HG LEU A 158 1.105 -7.217 -2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 158 2.669 -8.374 -1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 158 3.006 -8.742 -2.776 1.00 0.00 H new ATOM 0 HD13 LEU A 158 4.038 -7.592 -1.893 1.00 0.00 H new ATOM 0 HD21 LEU A 158 1.722 -6.190 -0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 158 3.053 -5.321 -1.224 1.00 0.00 H new ATOM 0 HD23 LEU A 158 1.365 -4.963 -1.662 1.00 0.00 H new ATOM 494 N LEU A 159 2.548 -4.867 -6.649 1.00 0.00 N ATOM 495 CA LEU A 159 3.256 -4.131 -7.690 1.00 0.00 C ATOM 496 C LEU A 159 2.362 -3.058 -8.304 1.00 0.00 C ATOM 497 O LEU A 159 2.775 -1.911 -8.471 1.00 0.00 O ATOM 498 CB LEU A 159 3.743 -5.089 -8.778 1.00 0.00 C ATOM 499 CG LEU A 159 4.943 -5.965 -8.413 1.00 0.00 C ATOM 500 CD1 LEU A 159 5.049 -7.147 -9.364 1.00 0.00 C ATOM 501 CD2 LEU A 159 6.226 -5.147 -8.431 1.00 0.00 C ATOM 0 H LEU A 159 2.199 -5.780 -6.941 1.00 0.00 H new ATOM 0 HA LEU A 159 4.116 -3.642 -7.233 1.00 0.00 H new ATOM 0 HB2 LEU A 159 2.915 -5.740 -9.058 1.00 0.00 H new ATOM 0 HB3 LEU A 159 4.001 -4.504 -9.661 1.00 0.00 H new ATOM 0 HG LEU A 159 4.795 -6.349 -7.404 1.00 0.00 H new ATOM 0 HD11 LEU A 159 5.908 -7.759 -9.089 1.00 0.00 H new ATOM 0 HD12 LEU A 159 4.141 -7.747 -9.301 1.00 0.00 H new ATOM 0 HD13 LEU A 159 5.174 -6.783 -10.384 1.00 0.00 H new ATOM 0 HD21 LEU A 159 7.069 -5.786 -8.169 1.00 0.00 H new ATOM 0 HD22 LEU A 159 6.380 -4.734 -9.428 1.00 0.00 H new ATOM 0 HD23 LEU A 159 6.149 -4.334 -7.709 1.00 0.00 H new ATOM 513 N LYS A 160 1.133 -3.439 -8.636 1.00 0.00 N ATOM 514 CA LYS A 160 0.178 -2.511 -9.228 1.00 0.00 C ATOM 515 C LYS A 160 0.028 -1.261 -8.367 1.00 0.00 C ATOM 516 O LYS A 160 -0.033 -0.144 -8.881 1.00 0.00 O ATOM 517 CB LYS A 160 -1.183 -3.189 -9.401 1.00 0.00 C ATOM 518 CG LYS A 160 -2.128 -2.964 -8.233 1.00 0.00 C ATOM 519 CD LYS A 160 -3.484 -3.604 -8.482 1.00 0.00 C ATOM 520 CE LYS A 160 -4.401 -2.679 -9.267 1.00 0.00 C ATOM 521 NZ LYS A 160 -5.664 -3.359 -9.667 1.00 0.00 N ATOM 0 H LYS A 160 0.775 -4.385 -8.505 1.00 0.00 H new ATOM 0 HA LYS A 160 0.557 -2.214 -10.206 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -1.651 -2.818 -10.313 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -1.032 -4.260 -9.534 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -1.690 -3.378 -7.325 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -2.254 -1.894 -8.067 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -3.352 -4.537 -9.029 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -3.949 -3.856 -7.529 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -4.636 -1.802 -8.663 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -3.882 -2.323 -10.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -6.262 -2.695 -10.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -5.442 -4.181 -10.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -6.172 -3.676 -8.817 1.00 0.00 H new ATOM 535 N LEU A 161 -0.028 -1.456 -7.054 1.00 0.00 N ATOM 536 CA LEU A 161 -0.168 -0.343 -6.120 1.00 0.00 C ATOM 537 C LEU A 161 1.130 0.451 -6.021 1.00 0.00 C ATOM 538 O LEU A 161 1.147 1.660 -6.248 1.00 0.00 O ATOM 539 CB LEU A 161 -0.571 -0.860 -4.738 1.00 0.00 C ATOM 540 CG LEU A 161 -2.052 -1.191 -4.550 1.00 0.00 C ATOM 541 CD1 LEU A 161 -2.298 -1.769 -3.165 1.00 0.00 C ATOM 542 CD2 LEU A 161 -2.908 0.046 -4.774 1.00 0.00 C ATOM 0 H LEU A 161 0.021 -2.374 -6.612 1.00 0.00 H new ATOM 0 HA LEU A 161 -0.949 0.319 -6.495 1.00 0.00 H new ATOM 0 HB2 LEU A 161 0.011 -1.756 -4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -0.290 -0.112 -3.996 1.00 0.00 H new ATOM 0 HG LEU A 161 -2.334 -1.941 -5.289 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -3.357 -1.998 -3.049 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -1.714 -2.681 -3.042 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -2.000 -1.042 -2.409 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.959 -0.209 -4.636 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.625 0.819 -4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -2.755 0.416 -5.788 1.00 0.00 H new ATOM 554 N GLU A 162 2.215 -0.238 -5.682 1.00 0.00 N ATOM 555 CA GLU A 162 3.518 0.404 -5.555 1.00 0.00 C ATOM 556 C GLU A 162 3.801 1.303 -6.755 1.00 0.00 C ATOM 557 O GLU A 162 4.268 2.432 -6.601 1.00 0.00 O ATOM 558 CB GLU A 162 4.620 -0.649 -5.422 1.00 0.00 C ATOM 559 CG GLU A 162 6.024 -0.071 -5.469 1.00 0.00 C ATOM 560 CD GLU A 162 6.535 0.332 -4.100 1.00 0.00 C ATOM 561 OE1 GLU A 162 5.704 0.671 -3.231 1.00 0.00 O ATOM 562 OE2 GLU A 162 7.767 0.309 -3.896 1.00 0.00 O ATOM 0 H GLU A 162 2.218 -1.240 -5.491 1.00 0.00 H new ATOM 0 HA GLU A 162 3.504 1.020 -4.656 1.00 0.00 H new ATOM 0 HB2 GLU A 162 4.488 -1.184 -4.482 1.00 0.00 H new ATOM 0 HB3 GLU A 162 4.510 -1.380 -6.223 1.00 0.00 H new ATOM 0 HG2 GLU A 162 6.701 -0.806 -5.903 1.00 0.00 H new ATOM 0 HG3 GLU A 162 6.033 0.798 -6.126 1.00 0.00 H new ATOM 569 N GLN A 163 3.516 0.794 -7.949 1.00 0.00 N ATOM 570 CA GLN A 163 3.741 1.550 -9.175 1.00 0.00 C ATOM 571 C GLN A 163 2.831 2.773 -9.236 1.00 0.00 C ATOM 572 O GLN A 163 3.286 3.882 -9.512 1.00 0.00 O ATOM 573 CB GLN A 163 3.503 0.662 -10.398 1.00 0.00 C ATOM 574 CG GLN A 163 3.313 1.442 -11.689 1.00 0.00 C ATOM 575 CD GLN A 163 4.537 2.252 -12.067 1.00 0.00 C ATOM 576 OE1 GLN A 163 5.578 2.167 -11.415 1.00 0.00 O ATOM 577 NE2 GLN A 163 4.419 3.045 -13.126 1.00 0.00 N ATOM 0 H GLN A 163 3.129 -0.139 -8.093 1.00 0.00 H new ATOM 0 HA GLN A 163 4.777 1.890 -9.177 1.00 0.00 H new ATOM 0 HB2 GLN A 163 4.348 -0.016 -10.514 1.00 0.00 H new ATOM 0 HB3 GLN A 163 2.621 0.045 -10.223 1.00 0.00 H new ATOM 0 HG2 GLN A 163 3.077 0.749 -12.496 1.00 0.00 H new ATOM 0 HG3 GLN A 163 2.458 2.110 -11.583 1.00 0.00 H new ATOM 0 HE21 GLN A 163 3.538 3.085 -13.638 1.00 0.00 H new ATOM 0 HE22 GLN A 163 5.210 3.614 -13.428 1.00 0.00 H new ATOM 586 N GLU A 164 1.545 2.561 -8.975 1.00 0.00 N ATOM 587 CA GLU A 164 0.572 3.647 -9.001 1.00 0.00 C ATOM 588 C GLU A 164 1.029 4.808 -8.124 1.00 0.00 C ATOM 589 O GLU A 164 0.878 5.974 -8.490 1.00 0.00 O ATOM 590 CB GLU A 164 -0.796 3.147 -8.533 1.00 0.00 C ATOM 591 CG GLU A 164 -1.607 2.476 -9.628 1.00 0.00 C ATOM 592 CD GLU A 164 -2.993 2.072 -9.164 1.00 0.00 C ATOM 593 OE1 GLU A 164 -3.897 2.934 -9.178 1.00 0.00 O ATOM 594 OE2 GLU A 164 -3.174 0.896 -8.788 1.00 0.00 O ATOM 0 H GLU A 164 1.153 1.648 -8.743 1.00 0.00 H new ATOM 0 HA GLU A 164 0.489 4.002 -10.028 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -0.655 2.442 -7.714 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -1.364 3.988 -8.136 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -1.696 3.154 -10.477 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -1.074 1.593 -9.980 1.00 0.00 H new ATOM 601 N ILE A 165 1.589 4.481 -6.964 1.00 0.00 N ATOM 602 CA ILE A 165 2.068 5.496 -6.034 1.00 0.00 C ATOM 603 C ILE A 165 3.231 6.282 -6.630 1.00 0.00 C ATOM 604 O ILE A 165 3.204 7.513 -6.678 1.00 0.00 O ATOM 605 CB ILE A 165 2.516 4.871 -4.700 1.00 0.00 C ATOM 606 CG1 ILE A 165 1.373 4.065 -4.080 1.00 0.00 C ATOM 607 CG2 ILE A 165 2.990 5.953 -3.741 1.00 0.00 C ATOM 608 CD1 ILE A 165 1.756 3.361 -2.797 1.00 0.00 C ATOM 0 H ILE A 165 1.722 3.521 -6.646 1.00 0.00 H new ATOM 0 HA ILE A 165 1.233 6.172 -5.847 1.00 0.00 H new ATOM 0 HB ILE A 165 3.349 4.195 -4.894 1.00 0.00 H new ATOM 0 HG12 ILE A 165 0.534 4.732 -3.882 1.00 0.00 H new ATOM 0 HG13 ILE A 165 1.028 3.325 -4.802 1.00 0.00 H new ATOM 0 HG21 ILE A 165 3.303 5.496 -2.803 1.00 0.00 H new ATOM 0 HG22 ILE A 165 3.831 6.488 -4.183 1.00 0.00 H new ATOM 0 HG23 ILE A 165 2.176 6.652 -3.550 1.00 0.00 H new ATOM 0 HD11 ILE A 165 0.897 2.810 -2.414 1.00 0.00 H new ATOM 0 HD12 ILE A 165 2.574 2.668 -2.993 1.00 0.00 H new ATOM 0 HD13 ILE A 165 2.073 4.097 -2.059 1.00 0.00 H new ATOM 620 N LEU A 166 4.251 5.564 -7.086 1.00 0.00 N ATOM 621 CA LEU A 166 5.425 6.193 -7.682 1.00 0.00 C ATOM 622 C LEU A 166 5.016 7.257 -8.696 1.00 0.00 C ATOM 623 O LEU A 166 5.434 8.410 -8.602 1.00 0.00 O ATOM 624 CB LEU A 166 6.306 5.140 -8.356 1.00 0.00 C ATOM 625 CG LEU A 166 7.099 4.229 -7.420 1.00 0.00 C ATOM 626 CD1 LEU A 166 7.792 3.128 -8.207 1.00 0.00 C ATOM 627 CD2 LEU A 166 8.113 5.036 -6.622 1.00 0.00 C ATOM 0 H LEU A 166 4.289 4.545 -7.055 1.00 0.00 H new ATOM 0 HA LEU A 166 5.992 6.675 -6.886 1.00 0.00 H new ATOM 0 HB2 LEU A 166 5.673 4.516 -8.987 1.00 0.00 H new ATOM 0 HB3 LEU A 166 7.009 5.651 -9.014 1.00 0.00 H new ATOM 0 HG LEU A 166 6.403 3.765 -6.721 1.00 0.00 H new ATOM 0 HD11 LEU A 166 8.352 2.489 -7.524 1.00 0.00 H new ATOM 0 HD12 LEU A 166 7.046 2.532 -8.732 1.00 0.00 H new ATOM 0 HD13 LEU A 166 8.476 3.573 -8.930 1.00 0.00 H new ATOM 0 HD21 LEU A 166 8.668 4.371 -5.961 1.00 0.00 H new ATOM 0 HD22 LEU A 166 8.805 5.529 -7.305 1.00 0.00 H new ATOM 0 HD23 LEU A 166 7.593 5.787 -6.027 1.00 0.00 H new ATOM 639 N GLU A 167 4.196 6.860 -9.664 1.00 0.00 N ATOM 640 CA GLU A 167 3.730 7.780 -10.695 1.00 0.00 C ATOM 641 C GLU A 167 2.955 8.941 -10.078 1.00 0.00 C ATOM 642 O GLU A 167 3.031 10.074 -10.553 1.00 0.00 O ATOM 643 CB GLU A 167 2.848 7.044 -11.706 1.00 0.00 C ATOM 644 CG GLU A 167 3.635 6.292 -12.766 1.00 0.00 C ATOM 645 CD GLU A 167 4.000 7.165 -13.950 1.00 0.00 C ATOM 646 OE1 GLU A 167 3.144 7.343 -14.842 1.00 0.00 O ATOM 647 OE2 GLU A 167 5.141 7.671 -13.986 1.00 0.00 O ATOM 0 H GLU A 167 3.841 5.908 -9.756 1.00 0.00 H new ATOM 0 HA GLU A 167 4.603 8.181 -11.210 1.00 0.00 H new ATOM 0 HB2 GLU A 167 2.208 6.341 -11.173 1.00 0.00 H new ATOM 0 HB3 GLU A 167 2.192 7.764 -12.195 1.00 0.00 H new ATOM 0 HG2 GLU A 167 4.545 5.891 -12.321 1.00 0.00 H new ATOM 0 HG3 GLU A 167 3.049 5.441 -13.114 1.00 0.00 H new ATOM 654 N PHE A 168 2.210 8.650 -9.017 1.00 0.00 N ATOM 655 CA PHE A 168 1.420 9.668 -8.335 1.00 0.00 C ATOM 656 C PHE A 168 2.322 10.723 -7.701 1.00 0.00 C ATOM 657 O PHE A 168 2.076 11.923 -7.827 1.00 0.00 O ATOM 658 CB PHE A 168 0.536 9.026 -7.264 1.00 0.00 C ATOM 659 CG PHE A 168 0.061 9.995 -6.219 1.00 0.00 C ATOM 660 CD1 PHE A 168 -0.977 10.871 -6.489 1.00 0.00 C ATOM 661 CD2 PHE A 168 0.654 10.029 -4.967 1.00 0.00 C ATOM 662 CE1 PHE A 168 -1.417 11.764 -5.529 1.00 0.00 C ATOM 663 CE2 PHE A 168 0.218 10.919 -4.003 1.00 0.00 C ATOM 664 CZ PHE A 168 -0.818 11.788 -4.285 1.00 0.00 C ATOM 0 H PHE A 168 2.137 7.717 -8.611 1.00 0.00 H new ATOM 0 HA PHE A 168 0.786 10.155 -9.075 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -0.329 8.569 -7.744 1.00 0.00 H new ATOM 0 HB3 PHE A 168 1.092 8.224 -6.778 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -1.448 10.857 -7.461 1.00 0.00 H new ATOM 0 HD2 PHE A 168 1.466 9.353 -4.742 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -2.228 12.442 -5.752 1.00 0.00 H new ATOM 0 HE2 PHE A 168 0.687 10.935 -3.030 1.00 0.00 H new ATOM 0 HZ PHE A 168 -1.159 12.485 -3.534 1.00 0.00 H new ATOM 674 N ILE A 169 3.367 10.266 -7.020 1.00 0.00 N ATOM 675 CA ILE A 169 4.307 11.169 -6.367 1.00 0.00 C ATOM 676 C ILE A 169 4.936 12.128 -7.371 1.00 0.00 C ATOM 677 O ILE A 169 4.985 13.336 -7.145 1.00 0.00 O ATOM 678 CB ILE A 169 5.424 10.393 -5.645 1.00 0.00 C ATOM 679 CG1 ILE A 169 4.828 9.465 -4.585 1.00 0.00 C ATOM 680 CG2 ILE A 169 6.417 11.358 -5.013 1.00 0.00 C ATOM 681 CD1 ILE A 169 5.815 8.456 -4.041 1.00 0.00 C ATOM 0 H ILE A 169 3.584 9.276 -6.906 1.00 0.00 H new ATOM 0 HA ILE A 169 3.738 11.739 -5.632 1.00 0.00 H new ATOM 0 HB ILE A 169 5.954 9.784 -6.377 1.00 0.00 H new ATOM 0 HG12 ILE A 169 4.445 10.067 -3.761 1.00 0.00 H new ATOM 0 HG13 ILE A 169 3.978 8.935 -5.015 1.00 0.00 H new ATOM 0 HG21 ILE A 169 7.200 10.794 -4.507 1.00 0.00 H new ATOM 0 HG22 ILE A 169 6.862 11.982 -5.788 1.00 0.00 H new ATOM 0 HG23 ILE A 169 5.901 11.990 -4.291 1.00 0.00 H new ATOM 0 HD11 ILE A 169 5.323 7.832 -3.295 1.00 0.00 H new ATOM 0 HD12 ILE A 169 6.180 7.829 -4.854 1.00 0.00 H new ATOM 0 HD13 ILE A 169 6.654 8.979 -3.581 1.00 0.00 H new ATOM 693 N ASN A 170 5.416 11.580 -8.483 1.00 0.00 N ATOM 694 CA ASN A 170 6.042 12.388 -9.524 1.00 0.00 C ATOM 695 C ASN A 170 5.065 13.424 -10.071 1.00 0.00 C ATOM 696 O ASN A 170 5.442 14.561 -10.351 1.00 0.00 O ATOM 697 CB ASN A 170 6.543 11.493 -10.660 1.00 0.00 C ATOM 698 CG ASN A 170 7.964 11.013 -10.435 1.00 0.00 C ATOM 699 OD1 ASN A 170 8.741 11.651 -9.725 1.00 0.00 O ATOM 700 ND2 ASN A 170 8.309 9.883 -11.041 1.00 0.00 N ATOM 0 H ASN A 170 5.384 10.581 -8.686 1.00 0.00 H new ATOM 0 HA ASN A 170 6.889 12.912 -9.082 1.00 0.00 H new ATOM 0 HB2 ASN A 170 5.883 10.631 -10.758 1.00 0.00 H new ATOM 0 HB3 ASN A 170 6.493 12.042 -11.600 1.00 0.00 H new ATOM 0 HD21 ASN A 170 9.252 9.510 -10.927 1.00 0.00 H new ATOM 0 HD22 ASN A 170 7.631 9.388 -11.620 1.00 0.00 H new ATOM 707 N ASP A 171 3.807 13.022 -10.218 1.00 0.00 N ATOM 708 CA ASP A 171 2.774 13.916 -10.729 1.00 0.00 C ATOM 709 C ASP A 171 2.522 15.066 -9.759 1.00 0.00 C ATOM 710 O ASP A 171 1.928 14.877 -8.698 1.00 0.00 O ATOM 711 CB ASP A 171 1.476 13.143 -10.973 1.00 0.00 C ATOM 712 CG ASP A 171 0.500 13.911 -11.841 1.00 0.00 C ATOM 713 OD1 ASP A 171 0.958 14.691 -12.702 1.00 0.00 O ATOM 714 OD2 ASP A 171 -0.723 13.734 -11.660 1.00 0.00 O ATOM 0 H ASP A 171 3.478 12.084 -9.991 1.00 0.00 H new ATOM 0 HA ASP A 171 3.123 14.332 -11.674 1.00 0.00 H new ATOM 0 HB2 ASP A 171 1.708 12.190 -11.448 1.00 0.00 H new ATOM 0 HB3 ASP A 171 1.006 12.916 -10.016 1.00 0.00 H new ATOM 719 N ASN A 172 2.978 16.257 -10.130 1.00 0.00 N ATOM 720 CA ASN A 172 2.804 17.438 -9.292 1.00 0.00 C ATOM 721 C ASN A 172 1.362 17.934 -9.344 1.00 0.00 C ATOM 722 O ASN A 172 0.785 18.303 -8.323 1.00 0.00 O ATOM 723 CB ASN A 172 3.754 18.551 -9.738 1.00 0.00 C ATOM 724 CG ASN A 172 5.200 18.094 -9.781 1.00 0.00 C ATOM 725 OD1 ASN A 172 5.659 17.544 -10.782 1.00 0.00 O ATOM 726 ND2 ASN A 172 5.924 18.321 -8.692 1.00 0.00 N ATOM 0 H ASN A 172 3.471 16.431 -11.006 1.00 0.00 H new ATOM 0 HA ASN A 172 3.038 17.161 -8.264 1.00 0.00 H new ATOM 0 HB2 ASN A 172 3.458 18.904 -10.726 1.00 0.00 H new ATOM 0 HB3 ASN A 172 3.663 19.397 -9.057 1.00 0.00 H new ATOM 0 HD21 ASN A 172 6.903 18.036 -8.662 1.00 0.00 H new ATOM 0 HD22 ASN A 172 5.501 18.780 -7.885 1.00 0.00 H new ATOM 733 N ASN A 173 0.786 17.937 -10.542 1.00 0.00 N ATOM 734 CA ASN A 173 -0.588 18.387 -10.729 1.00 0.00 C ATOM 735 C ASN A 173 -1.502 17.805 -9.654 1.00 0.00 C ATOM 736 O ASN A 173 -2.293 18.521 -9.043 1.00 0.00 O ATOM 737 CB ASN A 173 -1.095 17.987 -12.116 1.00 0.00 C ATOM 738 CG ASN A 173 -2.402 18.668 -12.473 1.00 0.00 C ATOM 739 OD1 ASN A 173 -3.097 19.197 -11.605 1.00 0.00 O ATOM 740 ND2 ASN A 173 -2.742 18.658 -13.756 1.00 0.00 N ATOM 0 H ASN A 173 1.250 17.633 -11.398 1.00 0.00 H new ATOM 0 HA ASN A 173 -0.602 19.474 -10.644 1.00 0.00 H new ATOM 0 HB2 ASN A 173 -0.341 18.240 -12.862 1.00 0.00 H new ATOM 0 HB3 ASN A 173 -1.230 16.906 -12.153 1.00 0.00 H new ATOM 0 HD21 ASN A 173 -3.610 19.101 -14.057 1.00 0.00 H new ATOM 0 HD22 ASN A 173 -2.135 18.208 -14.441 1.00 0.00 H new ATOM 747 N ASN A 174 -1.385 16.500 -9.429 1.00 0.00 N ATOM 748 CA ASN A 174 -2.200 15.821 -8.429 1.00 0.00 C ATOM 749 C ASN A 174 -1.523 15.856 -7.061 1.00 0.00 C ATOM 750 O ASN A 174 -0.370 15.450 -6.918 1.00 0.00 O ATOM 751 CB ASN A 174 -2.455 14.371 -8.847 1.00 0.00 C ATOM 752 CG ASN A 174 -3.411 14.268 -10.019 1.00 0.00 C ATOM 753 OD1 ASN A 174 -3.622 15.236 -10.750 1.00 0.00 O ATOM 754 ND2 ASN A 174 -3.996 13.089 -10.203 1.00 0.00 N ATOM 0 H ASN A 174 -0.734 15.892 -9.926 1.00 0.00 H new ATOM 0 HA ASN A 174 -3.153 16.344 -8.357 1.00 0.00 H new ATOM 0 HB2 ASN A 174 -1.508 13.900 -9.111 1.00 0.00 H new ATOM 0 HB3 ASN A 174 -2.861 13.818 -8.000 1.00 0.00 H new ATOM 0 HD21 ASN A 174 -4.650 12.959 -10.975 1.00 0.00 H new ATOM 0 HD22 ASN A 174 -3.791 12.314 -9.572 1.00 0.00 H new ATOM 761 N GLN A 175 -2.250 16.343 -6.061 1.00 0.00 N ATOM 762 CA GLN A 175 -1.719 16.431 -4.705 1.00 0.00 C ATOM 763 C GLN A 175 -2.189 15.253 -3.859 1.00 0.00 C ATOM 764 O GLN A 175 -1.418 14.683 -3.087 1.00 0.00 O ATOM 765 CB GLN A 175 -2.148 17.746 -4.051 1.00 0.00 C ATOM 766 CG GLN A 175 -1.356 18.951 -4.532 1.00 0.00 C ATOM 767 CD GLN A 175 -1.526 20.159 -3.631 1.00 0.00 C ATOM 768 OE1 GLN A 175 -2.355 21.031 -3.892 1.00 0.00 O ATOM 769 NE2 GLN A 175 -0.740 20.216 -2.563 1.00 0.00 N ATOM 0 H GLN A 175 -3.207 16.682 -6.163 1.00 0.00 H new ATOM 0 HA GLN A 175 -0.631 16.401 -4.765 1.00 0.00 H new ATOM 0 HB2 GLN A 175 -3.206 17.914 -4.251 1.00 0.00 H new ATOM 0 HB3 GLN A 175 -2.038 17.657 -2.970 1.00 0.00 H new ATOM 0 HG2 GLN A 175 -0.299 18.689 -4.586 1.00 0.00 H new ATOM 0 HG3 GLN A 175 -1.672 19.209 -5.543 1.00 0.00 H new ATOM 0 HE21 GLN A 175 -0.067 19.471 -2.385 1.00 0.00 H new ATOM 0 HE22 GLN A 175 -0.809 21.005 -1.920 1.00 0.00 H new ATOM 778 N PHE A 176 -3.459 14.892 -4.009 1.00 0.00 N ATOM 779 CA PHE A 176 -4.033 13.781 -3.258 1.00 0.00 C ATOM 780 C PHE A 176 -4.529 12.687 -4.199 1.00 0.00 C ATOM 781 O PHE A 176 -4.795 12.936 -5.375 1.00 0.00 O ATOM 782 CB PHE A 176 -5.183 14.274 -2.378 1.00 0.00 C ATOM 783 CG PHE A 176 -4.733 14.821 -1.053 1.00 0.00 C ATOM 784 CD1 PHE A 176 -4.561 13.982 0.036 1.00 0.00 C ATOM 785 CD2 PHE A 176 -4.482 16.174 -0.898 1.00 0.00 C ATOM 786 CE1 PHE A 176 -4.147 14.482 1.256 1.00 0.00 C ATOM 787 CE2 PHE A 176 -4.067 16.680 0.320 1.00 0.00 C ATOM 788 CZ PHE A 176 -3.900 15.833 1.398 1.00 0.00 C ATOM 0 H PHE A 176 -4.111 15.353 -4.644 1.00 0.00 H new ATOM 0 HA PHE A 176 -3.253 13.362 -2.623 1.00 0.00 H new ATOM 0 HB2 PHE A 176 -5.733 15.048 -2.913 1.00 0.00 H new ATOM 0 HB3 PHE A 176 -5.876 13.451 -2.206 1.00 0.00 H new ATOM 0 HD1 PHE A 176 -4.753 12.924 -0.070 1.00 0.00 H new ATOM 0 HD2 PHE A 176 -4.612 16.841 -1.737 1.00 0.00 H new ATOM 0 HE1 PHE A 176 -4.017 13.817 2.097 1.00 0.00 H new ATOM 0 HE2 PHE A 176 -3.874 17.737 0.428 1.00 0.00 H new ATOM 0 HZ PHE A 176 -3.577 16.227 2.350 1.00 0.00 H new ATOM 798 N LYS A 177 -4.652 11.474 -3.672 1.00 0.00 N ATOM 799 CA LYS A 177 -5.117 10.340 -4.462 1.00 0.00 C ATOM 800 C LYS A 177 -6.003 9.421 -3.627 1.00 0.00 C ATOM 801 O LYS A 177 -5.773 9.238 -2.431 1.00 0.00 O ATOM 802 CB LYS A 177 -3.925 9.553 -5.014 1.00 0.00 C ATOM 803 CG LYS A 177 -4.302 8.559 -6.099 1.00 0.00 C ATOM 804 CD LYS A 177 -4.693 7.214 -5.511 1.00 0.00 C ATOM 805 CE LYS A 177 -3.473 6.435 -5.042 1.00 0.00 C ATOM 806 NZ LYS A 177 -2.872 5.630 -6.141 1.00 0.00 N ATOM 0 H LYS A 177 -4.436 11.251 -2.700 1.00 0.00 H new ATOM 0 HA LYS A 177 -5.706 10.727 -5.294 1.00 0.00 H new ATOM 0 HB2 LYS A 177 -3.192 10.253 -5.414 1.00 0.00 H new ATOM 0 HB3 LYS A 177 -3.443 9.019 -4.195 1.00 0.00 H new ATOM 0 HG2 LYS A 177 -5.131 8.956 -6.685 1.00 0.00 H new ATOM 0 HG3 LYS A 177 -3.462 8.428 -6.782 1.00 0.00 H new ATOM 0 HD2 LYS A 177 -5.373 7.366 -4.673 1.00 0.00 H new ATOM 0 HD3 LYS A 177 -5.233 6.632 -6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 177 -2.728 7.128 -4.651 1.00 0.00 H new ATOM 0 HE3 LYS A 177 -3.757 5.775 -4.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 177 -2.621 4.686 -5.783 1.00 0.00 H new ATOM 0 HZ2 LYS A 177 -3.558 5.535 -6.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 177 -2.016 6.106 -6.492 1.00 0.00 H new ATOM 820 N LYS A 178 -7.016 8.844 -4.264 1.00 0.00 N ATOM 821 CA LYS A 178 -7.936 7.942 -3.581 1.00 0.00 C ATOM 822 C LYS A 178 -7.781 6.515 -4.097 1.00 0.00 C ATOM 823 O LYS A 178 -7.783 6.277 -5.305 1.00 0.00 O ATOM 824 CB LYS A 178 -9.380 8.412 -3.772 1.00 0.00 C ATOM 825 CG LYS A 178 -9.692 9.719 -3.066 1.00 0.00 C ATOM 826 CD LYS A 178 -11.176 10.044 -3.124 1.00 0.00 C ATOM 827 CE LYS A 178 -11.612 10.876 -1.928 1.00 0.00 C ATOM 828 NZ LYS A 178 -11.481 12.336 -2.192 1.00 0.00 N ATOM 0 H LYS A 178 -7.221 8.985 -5.253 1.00 0.00 H new ATOM 0 HA LYS A 178 -7.695 7.953 -2.518 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -9.577 8.528 -4.838 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -10.056 7.640 -3.405 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -9.373 9.657 -2.026 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -9.123 10.527 -3.526 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -11.395 10.585 -4.044 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -11.751 9.119 -3.154 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.648 10.643 -1.681 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -11.010 10.608 -1.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -11.788 12.869 -1.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -10.488 12.563 -2.403 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -12.076 12.597 -3.005 1.00 0.00 H new ATOM 842 N PHE A 179 -7.650 5.568 -3.174 1.00 0.00 N ATOM 843 CA PHE A 179 -7.495 4.164 -3.536 1.00 0.00 C ATOM 844 C PHE A 179 -8.848 3.459 -3.573 1.00 0.00 C ATOM 845 O PHE A 179 -9.814 3.883 -2.937 1.00 0.00 O ATOM 846 CB PHE A 179 -6.567 3.459 -2.545 1.00 0.00 C ATOM 847 CG PHE A 179 -5.109 3.665 -2.839 1.00 0.00 C ATOM 848 CD1 PHE A 179 -4.557 3.213 -4.027 1.00 0.00 C ATOM 849 CD2 PHE A 179 -4.289 4.310 -1.927 1.00 0.00 C ATOM 850 CE1 PHE A 179 -3.215 3.401 -4.299 1.00 0.00 C ATOM 851 CE2 PHE A 179 -2.947 4.502 -2.194 1.00 0.00 C ATOM 852 CZ PHE A 179 -2.409 4.047 -3.382 1.00 0.00 C ATOM 0 H PHE A 179 -7.648 5.747 -2.170 1.00 0.00 H new ATOM 0 HA PHE A 179 -7.054 4.118 -4.532 1.00 0.00 H new ATOM 0 HB2 PHE A 179 -6.781 3.820 -1.539 1.00 0.00 H new ATOM 0 HB3 PHE A 179 -6.784 2.391 -2.553 1.00 0.00 H new ATOM 0 HD1 PHE A 179 -5.182 2.708 -4.748 1.00 0.00 H new ATOM 0 HD2 PHE A 179 -4.704 4.667 -0.996 1.00 0.00 H new ATOM 0 HE1 PHE A 179 -2.797 3.043 -5.228 1.00 0.00 H new ATOM 0 HE2 PHE A 179 -2.319 5.007 -1.475 1.00 0.00 H new ATOM 0 HZ PHE A 179 -1.360 4.196 -3.593 1.00 0.00 H new ATOM 862 N PRO A 180 -8.921 2.358 -4.335 1.00 0.00 N ATOM 863 CA PRO A 180 -10.150 1.571 -4.473 1.00 0.00 C ATOM 864 C PRO A 180 -10.509 0.827 -3.192 1.00 0.00 C ATOM 865 O PRO A 180 -9.828 0.958 -2.176 1.00 0.00 O ATOM 866 CB PRO A 180 -9.813 0.581 -5.591 1.00 0.00 C ATOM 867 CG PRO A 180 -8.330 0.452 -5.548 1.00 0.00 C ATOM 868 CD PRO A 180 -7.809 1.796 -5.120 1.00 0.00 C ATOM 0 HA PRO A 180 -11.015 2.199 -4.688 1.00 0.00 H new ATOM 0 HB2 PRO A 180 -10.299 -0.381 -5.428 1.00 0.00 H new ATOM 0 HB3 PRO A 180 -10.151 0.948 -6.560 1.00 0.00 H new ATOM 0 HG2 PRO A 180 -8.026 -0.325 -4.847 1.00 0.00 H new ATOM 0 HG3 PRO A 180 -7.934 0.173 -6.525 1.00 0.00 H new ATOM 0 HD2 PRO A 180 -6.902 1.704 -4.523 1.00 0.00 H new ATOM 0 HD3 PRO A 180 -7.564 2.424 -5.977 1.00 0.00 H new ATOM 876 N GLN A 181 -11.583 0.045 -3.248 1.00 0.00 N ATOM 877 CA GLN A 181 -12.032 -0.719 -2.091 1.00 0.00 C ATOM 878 C GLN A 181 -11.227 -2.006 -1.943 1.00 0.00 C ATOM 879 O GLN A 181 -11.028 -2.740 -2.911 1.00 0.00 O ATOM 880 CB GLN A 181 -13.521 -1.047 -2.216 1.00 0.00 C ATOM 881 CG GLN A 181 -14.431 0.136 -1.926 1.00 0.00 C ATOM 882 CD GLN A 181 -15.875 -0.276 -1.721 1.00 0.00 C ATOM 883 OE1 GLN A 181 -16.218 -1.454 -1.826 1.00 0.00 O ATOM 884 NE2 GLN A 181 -16.732 0.696 -1.428 1.00 0.00 N ATOM 0 H GLN A 181 -12.158 -0.076 -4.082 1.00 0.00 H new ATOM 0 HA GLN A 181 -11.875 -0.109 -1.201 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -13.721 -1.410 -3.224 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -13.765 -1.859 -1.531 1.00 0.00 H new ATOM 0 HG2 GLN A 181 -14.075 0.654 -1.035 1.00 0.00 H new ATOM 0 HG3 GLN A 181 -14.373 0.845 -2.752 1.00 0.00 H new ATOM 0 HE21 GLN A 181 -16.404 1.659 -1.351 1.00 0.00 H new ATOM 0 HE22 GLN A 181 -17.718 0.479 -1.280 1.00 0.00 H new ATOM 893 N MET A 182 -10.766 -2.273 -0.726 1.00 0.00 N ATOM 894 CA MET A 182 -9.982 -3.473 -0.452 1.00 0.00 C ATOM 895 C MET A 182 -10.493 -4.182 0.798 1.00 0.00 C ATOM 896 O MET A 182 -11.333 -3.651 1.527 1.00 0.00 O ATOM 897 CB MET A 182 -8.505 -3.115 -0.282 1.00 0.00 C ATOM 898 CG MET A 182 -7.723 -3.126 -1.585 1.00 0.00 C ATOM 899 SD MET A 182 -8.152 -1.746 -2.664 1.00 0.00 S ATOM 900 CE MET A 182 -6.973 -0.512 -2.121 1.00 0.00 C ATOM 0 H MET A 182 -10.921 -1.676 0.086 1.00 0.00 H new ATOM 0 HA MET A 182 -10.089 -4.149 -1.301 1.00 0.00 H new ATOM 0 HB2 MET A 182 -8.429 -2.126 0.169 1.00 0.00 H new ATOM 0 HB3 MET A 182 -8.047 -3.819 0.413 1.00 0.00 H new ATOM 0 HG2 MET A 182 -6.656 -3.092 -1.364 1.00 0.00 H new ATOM 0 HG3 MET A 182 -7.910 -4.063 -2.109 1.00 0.00 H new ATOM 0 HE1 MET A 182 -7.476 0.216 -1.484 1.00 0.00 H new ATOM 0 HE2 MET A 182 -6.174 -0.995 -1.559 1.00 0.00 H new ATOM 0 HE3 MET A 182 -6.551 -0.005 -2.989 1.00 0.00 H new ATOM 910 N THR A 183 -9.981 -5.384 1.042 1.00 0.00 N ATOM 911 CA THR A 183 -10.386 -6.166 2.204 1.00 0.00 C ATOM 912 C THR A 183 -9.521 -5.840 3.415 1.00 0.00 C ATOM 913 O THR A 183 -8.565 -5.070 3.319 1.00 0.00 O ATOM 914 CB THR A 183 -10.303 -7.678 1.920 1.00 0.00 C ATOM 915 OG1 THR A 183 -9.003 -8.011 1.420 1.00 0.00 O ATOM 916 CG2 THR A 183 -11.362 -8.099 0.912 1.00 0.00 C ATOM 0 H THR A 183 -9.285 -5.838 0.450 1.00 0.00 H new ATOM 0 HA THR A 183 -11.421 -5.900 2.419 1.00 0.00 H new ATOM 0 HB THR A 183 -10.481 -8.211 2.854 1.00 0.00 H new ATOM 0 HG1 THR A 183 -8.957 -8.974 1.243 1.00 0.00 H new ATOM 0 HG21 THR A 183 -11.283 -9.170 0.728 1.00 0.00 H new ATOM 0 HG22 THR A 183 -12.352 -7.870 1.307 1.00 0.00 H new ATOM 0 HG23 THR A 183 -11.211 -7.558 -0.022 1.00 0.00 H new ATOM 924 N SER A 184 -9.862 -6.430 4.557 1.00 0.00 N ATOM 925 CA SER A 184 -9.118 -6.199 5.789 1.00 0.00 C ATOM 926 C SER A 184 -7.627 -6.444 5.577 1.00 0.00 C ATOM 927 O SER A 184 -6.787 -5.668 6.035 1.00 0.00 O ATOM 928 CB SER A 184 -9.642 -7.106 6.904 1.00 0.00 C ATOM 929 OG SER A 184 -9.610 -8.467 6.511 1.00 0.00 O ATOM 0 H SER A 184 -10.649 -7.072 4.654 1.00 0.00 H new ATOM 0 HA SER A 184 -9.260 -5.158 6.080 1.00 0.00 H new ATOM 0 HB2 SER A 184 -9.039 -6.969 7.802 1.00 0.00 H new ATOM 0 HB3 SER A 184 -10.663 -6.822 7.159 1.00 0.00 H new ATOM 0 HG SER A 184 -9.948 -9.026 7.241 1.00 0.00 H new ATOM 935 N TYR A 185 -7.306 -7.528 4.880 1.00 0.00 N ATOM 936 CA TYR A 185 -5.916 -7.879 4.609 1.00 0.00 C ATOM 937 C TYR A 185 -5.292 -6.901 3.618 1.00 0.00 C ATOM 938 O TYR A 185 -4.307 -6.229 3.927 1.00 0.00 O ATOM 939 CB TYR A 185 -5.825 -9.304 4.063 1.00 0.00 C ATOM 940 CG TYR A 185 -4.496 -9.973 4.334 1.00 0.00 C ATOM 941 CD1 TYR A 185 -3.445 -9.864 3.433 1.00 0.00 C ATOM 942 CD2 TYR A 185 -4.293 -10.713 5.492 1.00 0.00 C ATOM 943 CE1 TYR A 185 -2.229 -10.473 3.676 1.00 0.00 C ATOM 944 CE2 TYR A 185 -3.080 -11.325 5.745 1.00 0.00 C ATOM 945 CZ TYR A 185 -2.052 -11.203 4.833 1.00 0.00 C ATOM 946 OH TYR A 185 -0.842 -11.811 5.080 1.00 0.00 O ATOM 0 H TYR A 185 -7.989 -8.179 4.492 1.00 0.00 H new ATOM 0 HA TYR A 185 -5.363 -7.821 5.547 1.00 0.00 H new ATOM 0 HB2 TYR A 185 -6.621 -9.904 4.504 1.00 0.00 H new ATOM 0 HB3 TYR A 185 -5.999 -9.284 2.987 1.00 0.00 H new ATOM 0 HD1 TYR A 185 -3.581 -9.293 2.526 1.00 0.00 H new ATOM 0 HD2 TYR A 185 -5.097 -10.812 6.207 1.00 0.00 H new ATOM 0 HE1 TYR A 185 -1.422 -10.378 2.965 1.00 0.00 H new ATOM 0 HE2 TYR A 185 -2.938 -11.895 6.651 1.00 0.00 H new ATOM 0 HH TYR A 185 -0.883 -12.284 5.937 1.00 0.00 H new ATOM 956 N HIS A 186 -5.872 -6.828 2.424 1.00 0.00 N ATOM 957 CA HIS A 186 -5.374 -5.932 1.386 1.00 0.00 C ATOM 958 C HIS A 186 -5.093 -4.544 1.955 1.00 0.00 C ATOM 959 O HIS A 186 -4.063 -3.939 1.659 1.00 0.00 O ATOM 960 CB HIS A 186 -6.383 -5.833 0.242 1.00 0.00 C ATOM 961 CG HIS A 186 -6.244 -6.922 -0.776 1.00 0.00 C ATOM 962 ND1 HIS A 186 -6.728 -6.817 -2.063 1.00 0.00 N ATOM 963 CD2 HIS A 186 -5.668 -8.145 -0.692 1.00 0.00 C ATOM 964 CE1 HIS A 186 -6.458 -7.928 -2.725 1.00 0.00 C ATOM 965 NE2 HIS A 186 -5.815 -8.750 -1.916 1.00 0.00 N ATOM 0 H HIS A 186 -6.687 -7.378 2.151 1.00 0.00 H new ATOM 0 HA HIS A 186 -4.440 -6.343 1.002 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -7.391 -5.860 0.655 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -6.266 -4.868 -0.252 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -5.183 -8.566 0.176 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.719 -8.130 -3.753 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -5.482 -9.683 -2.160 1.00 0.00 H new ATOM 974 N ARG A 187 -6.017 -4.047 2.771 1.00 0.00 N ATOM 975 CA ARG A 187 -5.869 -2.730 3.379 1.00 0.00 C ATOM 976 C ARG A 187 -4.571 -2.642 4.176 1.00 0.00 C ATOM 977 O ARG A 187 -3.881 -1.624 4.145 1.00 0.00 O ATOM 978 CB ARG A 187 -7.061 -2.429 4.289 1.00 0.00 C ATOM 979 CG ARG A 187 -7.300 -0.944 4.508 1.00 0.00 C ATOM 980 CD ARG A 187 -8.276 -0.699 5.648 1.00 0.00 C ATOM 981 NE ARG A 187 -7.742 -1.147 6.932 1.00 0.00 N ATOM 982 CZ ARG A 187 -8.496 -1.374 8.002 1.00 0.00 C ATOM 983 NH1 ARG A 187 -9.808 -1.197 7.943 1.00 0.00 N ATOM 984 NH2 ARG A 187 -7.936 -1.780 9.135 1.00 0.00 N ATOM 0 H ARG A 187 -6.875 -4.536 3.026 1.00 0.00 H new ATOM 0 HA ARG A 187 -5.835 -1.990 2.580 1.00 0.00 H new ATOM 0 HB2 ARG A 187 -7.958 -2.873 3.857 1.00 0.00 H new ATOM 0 HB3 ARG A 187 -6.901 -2.909 5.254 1.00 0.00 H new ATOM 0 HG2 ARG A 187 -6.353 -0.450 4.726 1.00 0.00 H new ATOM 0 HG3 ARG A 187 -7.689 -0.498 3.593 1.00 0.00 H new ATOM 0 HD2 ARG A 187 -8.509 0.364 5.703 1.00 0.00 H new ATOM 0 HD3 ARG A 187 -9.211 -1.220 5.443 1.00 0.00 H new ATOM 0 HE ARG A 187 -6.736 -1.293 7.011 1.00 0.00 H new ATOM 0 HH11 ARG A 187 -10.242 -0.886 7.074 1.00 0.00 H new ATOM 0 HH12 ARG A 187 -10.384 -1.372 8.766 1.00 0.00 H new ATOM 0 HH21 ARG A 187 -6.927 -1.918 9.184 1.00 0.00 H new ATOM 0 HH22 ARG A 187 -8.515 -1.954 9.956 1.00 0.00 H new ATOM 998 N MET A 188 -4.247 -3.715 4.890 1.00 0.00 N ATOM 999 CA MET A 188 -3.032 -3.758 5.695 1.00 0.00 C ATOM 1000 C MET A 188 -1.791 -3.677 4.811 1.00 0.00 C ATOM 1001 O MET A 188 -0.863 -2.918 5.094 1.00 0.00 O ATOM 1002 CB MET A 188 -2.994 -5.039 6.531 1.00 0.00 C ATOM 1003 CG MET A 188 -1.855 -5.074 7.537 1.00 0.00 C ATOM 1004 SD MET A 188 -0.287 -5.566 6.795 1.00 0.00 S ATOM 1005 CE MET A 188 -0.700 -7.196 6.180 1.00 0.00 C ATOM 0 H MET A 188 -4.808 -4.566 4.928 1.00 0.00 H new ATOM 0 HA MET A 188 -3.038 -2.897 6.363 1.00 0.00 H new ATOM 0 HB2 MET A 188 -3.940 -5.145 7.062 1.00 0.00 H new ATOM 0 HB3 MET A 188 -2.905 -5.896 5.864 1.00 0.00 H new ATOM 0 HG2 MET A 188 -1.745 -4.089 7.990 1.00 0.00 H new ATOM 0 HG3 MET A 188 -2.106 -5.767 8.340 1.00 0.00 H new ATOM 0 HE1 MET A 188 0.194 -7.819 6.172 1.00 0.00 H new ATOM 0 HE2 MET A 188 -1.452 -7.649 6.826 1.00 0.00 H new ATOM 0 HE3 MET A 188 -1.094 -7.114 5.167 1.00 0.00 H new ATOM 1015 N LEU A 189 -1.781 -4.463 3.740 1.00 0.00 N ATOM 1016 CA LEU A 189 -0.653 -4.481 2.815 1.00 0.00 C ATOM 1017 C LEU A 189 -0.343 -3.076 2.308 1.00 0.00 C ATOM 1018 O LEU A 189 0.807 -2.634 2.335 1.00 0.00 O ATOM 1019 CB LEU A 189 -0.951 -5.407 1.634 1.00 0.00 C ATOM 1020 CG LEU A 189 -1.123 -6.888 1.970 1.00 0.00 C ATOM 1021 CD1 LEU A 189 -1.703 -7.641 0.783 1.00 0.00 C ATOM 1022 CD2 LEU A 189 0.206 -7.497 2.392 1.00 0.00 C ATOM 0 H LEU A 189 -2.541 -5.096 3.491 1.00 0.00 H new ATOM 0 HA LEU A 189 0.219 -4.855 3.351 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -1.860 -5.058 1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -0.142 -5.311 0.910 1.00 0.00 H new ATOM 0 HG LEU A 189 -1.820 -6.973 2.804 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -1.818 -8.694 1.041 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -2.676 -7.222 0.526 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -1.031 -7.548 -0.070 1.00 0.00 H new ATOM 0 HD21 LEU A 189 0.064 -8.552 2.627 1.00 0.00 H new ATOM 0 HD22 LEU A 189 0.925 -7.400 1.579 1.00 0.00 H new ATOM 0 HD23 LEU A 189 0.582 -6.976 3.273 1.00 0.00 H new ATOM 1034 N LEU A 190 -1.375 -2.377 1.849 1.00 0.00 N ATOM 1035 CA LEU A 190 -1.214 -1.020 1.338 1.00 0.00 C ATOM 1036 C LEU A 190 -0.639 -0.099 2.410 1.00 0.00 C ATOM 1037 O LEU A 190 0.346 0.602 2.178 1.00 0.00 O ATOM 1038 CB LEU A 190 -2.557 -0.475 0.849 1.00 0.00 C ATOM 1039 CG LEU A 190 -2.629 1.037 0.630 1.00 0.00 C ATOM 1040 CD1 LEU A 190 -1.773 1.446 -0.559 1.00 0.00 C ATOM 1041 CD2 LEU A 190 -4.071 1.479 0.429 1.00 0.00 C ATOM 0 H LEU A 190 -2.332 -2.727 1.820 1.00 0.00 H new ATOM 0 HA LEU A 190 -0.516 -1.054 0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 190 -2.807 -0.970 -0.089 1.00 0.00 H new ATOM 0 HB3 LEU A 190 -3.324 -0.754 1.571 1.00 0.00 H new ATOM 0 HG LEU A 190 -2.239 1.532 1.519 1.00 0.00 H new ATOM 0 HD11 LEU A 190 -1.837 2.525 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 190 -0.736 1.165 -0.375 1.00 0.00 H new ATOM 0 HD13 LEU A 190 -2.132 0.942 -1.456 1.00 0.00 H new ATOM 0 HD21 LEU A 190 -4.103 2.558 0.275 1.00 0.00 H new ATOM 0 HD22 LEU A 190 -4.488 0.975 -0.443 1.00 0.00 H new ATOM 0 HD23 LEU A 190 -4.657 1.221 1.311 1.00 0.00 H new ATOM 1053 N HIS A 191 -1.260 -0.108 3.585 1.00 0.00 N ATOM 1054 CA HIS A 191 -0.808 0.724 4.695 1.00 0.00 C ATOM 1055 C HIS A 191 0.684 0.531 4.946 1.00 0.00 C ATOM 1056 O HIS A 191 1.385 1.468 5.329 1.00 0.00 O ATOM 1057 CB HIS A 191 -1.598 0.395 5.962 1.00 0.00 C ATOM 1058 CG HIS A 191 -3.024 0.851 5.915 1.00 0.00 C ATOM 1059 ND1 HIS A 191 -3.400 2.099 5.466 1.00 0.00 N ATOM 1060 CD2 HIS A 191 -4.168 0.217 6.263 1.00 0.00 C ATOM 1061 CE1 HIS A 191 -4.714 2.215 5.542 1.00 0.00 C ATOM 1062 NE2 HIS A 191 -5.204 1.086 6.021 1.00 0.00 N ATOM 0 H HIS A 191 -2.077 -0.682 3.793 1.00 0.00 H new ATOM 0 HA HIS A 191 -0.981 1.767 4.429 1.00 0.00 H new ATOM 0 HB2 HIS A 191 -1.575 -0.683 6.125 1.00 0.00 H new ATOM 0 HB3 HIS A 191 -1.105 0.857 6.818 1.00 0.00 H new ATOM 0 HD2 HIS A 191 -4.251 -0.785 6.657 1.00 0.00 H new ATOM 0 HE1 HIS A 191 -5.289 3.085 5.260 1.00 0.00 H new ATOM 0 HE2 HIS A 191 -6.192 0.891 6.185 1.00 0.00 H new ATOM 1071 N ARG A 192 1.163 -0.689 4.730 1.00 0.00 N ATOM 1072 CA ARG A 192 2.571 -1.005 4.935 1.00 0.00 C ATOM 1073 C ARG A 192 3.441 -0.313 3.890 1.00 0.00 C ATOM 1074 O ARG A 192 4.426 0.346 4.225 1.00 0.00 O ATOM 1075 CB ARG A 192 2.790 -2.518 4.875 1.00 0.00 C ATOM 1076 CG ARG A 192 2.645 -3.208 6.221 1.00 0.00 C ATOM 1077 CD ARG A 192 3.939 -3.153 7.018 1.00 0.00 C ATOM 1078 NE ARG A 192 3.773 -3.683 8.369 1.00 0.00 N ATOM 1079 CZ ARG A 192 3.217 -3.000 9.363 1.00 0.00 C ATOM 1080 NH1 ARG A 192 2.775 -1.766 9.159 1.00 0.00 N ATOM 1081 NH2 ARG A 192 3.101 -3.551 10.565 1.00 0.00 N ATOM 0 H ARG A 192 0.596 -1.476 4.413 1.00 0.00 H new ATOM 0 HA ARG A 192 2.859 -0.642 5.921 1.00 0.00 H new ATOM 0 HB2 ARG A 192 2.076 -2.952 4.175 1.00 0.00 H new ATOM 0 HB3 ARG A 192 3.786 -2.717 4.480 1.00 0.00 H new ATOM 0 HG2 ARG A 192 1.846 -2.733 6.790 1.00 0.00 H new ATOM 0 HG3 ARG A 192 2.354 -4.247 6.069 1.00 0.00 H new ATOM 0 HD2 ARG A 192 4.710 -3.722 6.498 1.00 0.00 H new ATOM 0 HD3 ARG A 192 4.287 -2.122 7.074 1.00 0.00 H new ATOM 0 HE ARG A 192 4.102 -4.629 8.559 1.00 0.00 H new ATOM 0 HH11 ARG A 192 2.862 -1.339 8.237 1.00 0.00 H new ATOM 0 HH12 ARG A 192 2.348 -1.244 9.924 1.00 0.00 H new ATOM 0 HH21 ARG A 192 3.439 -4.500 10.726 1.00 0.00 H new ATOM 0 HH22 ARG A 192 2.674 -3.026 11.328 1.00 0.00 H new ATOM 1095 N VAL A 193 3.072 -0.467 2.623 1.00 0.00 N ATOM 1096 CA VAL A 193 3.818 0.144 1.529 1.00 0.00 C ATOM 1097 C VAL A 193 3.958 1.648 1.732 1.00 0.00 C ATOM 1098 O VAL A 193 5.067 2.180 1.755 1.00 0.00 O ATOM 1099 CB VAL A 193 3.139 -0.119 0.171 1.00 0.00 C ATOM 1100 CG1 VAL A 193 3.917 0.548 -0.953 1.00 0.00 C ATOM 1101 CG2 VAL A 193 3.004 -1.614 -0.076 1.00 0.00 C ATOM 0 H VAL A 193 2.260 -1.010 2.328 1.00 0.00 H new ATOM 0 HA VAL A 193 4.808 -0.313 1.527 1.00 0.00 H new ATOM 0 HB VAL A 193 2.139 0.314 0.194 1.00 0.00 H new ATOM 0 HG11 VAL A 193 3.423 0.351 -1.904 1.00 0.00 H new ATOM 0 HG12 VAL A 193 3.956 1.623 -0.780 1.00 0.00 H new ATOM 0 HG13 VAL A 193 4.930 0.148 -0.981 1.00 0.00 H new ATOM 0 HG21 VAL A 193 2.522 -1.782 -1.039 1.00 0.00 H new ATOM 0 HG22 VAL A 193 3.993 -2.073 -0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 193 2.400 -2.060 0.714 1.00 0.00 H new ATOM 1111 N ALA A 194 2.826 2.328 1.879 1.00 0.00 N ATOM 1112 CA ALA A 194 2.823 3.771 2.083 1.00 0.00 C ATOM 1113 C ALA A 194 3.729 4.164 3.245 1.00 0.00 C ATOM 1114 O ALA A 194 4.545 5.078 3.127 1.00 0.00 O ATOM 1115 CB ALA A 194 1.405 4.267 2.327 1.00 0.00 C ATOM 0 H ALA A 194 1.899 1.903 1.861 1.00 0.00 H new ATOM 0 HA ALA A 194 3.211 4.241 1.179 1.00 0.00 H new ATOM 0 HB1 ALA A 194 1.418 5.346 2.478 1.00 0.00 H new ATOM 0 HB2 ALA A 194 0.783 4.029 1.464 1.00 0.00 H new ATOM 0 HB3 ALA A 194 0.997 3.782 3.214 1.00 0.00 H new ATOM 1121 N ALA A 195 3.580 3.467 4.367 1.00 0.00 N ATOM 1122 CA ALA A 195 4.387 3.742 5.549 1.00 0.00 C ATOM 1123 C ALA A 195 5.875 3.613 5.241 1.00 0.00 C ATOM 1124 O ALA A 195 6.689 4.402 5.721 1.00 0.00 O ATOM 1125 CB ALA A 195 3.997 2.806 6.684 1.00 0.00 C ATOM 0 H ALA A 195 2.908 2.708 4.482 1.00 0.00 H new ATOM 0 HA ALA A 195 4.195 4.770 5.858 1.00 0.00 H new ATOM 0 HB1 ALA A 195 4.608 3.023 7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 195 2.945 2.951 6.930 1.00 0.00 H new ATOM 0 HB3 ALA A 195 4.158 1.773 6.376 1.00 0.00 H new ATOM 1131 N TYR A 196 6.223 2.613 4.439 1.00 0.00 N ATOM 1132 CA TYR A 196 7.614 2.378 4.070 1.00 0.00 C ATOM 1133 C TYR A 196 8.172 3.553 3.272 1.00 0.00 C ATOM 1134 O TYR A 196 9.286 4.014 3.520 1.00 0.00 O ATOM 1135 CB TYR A 196 7.737 1.090 3.255 1.00 0.00 C ATOM 1136 CG TYR A 196 9.165 0.712 2.932 1.00 0.00 C ATOM 1137 CD1 TYR A 196 9.784 1.178 1.779 1.00 0.00 C ATOM 1138 CD2 TYR A 196 9.895 -0.111 3.781 1.00 0.00 C ATOM 1139 CE1 TYR A 196 11.088 0.834 1.480 1.00 0.00 C ATOM 1140 CE2 TYR A 196 11.200 -0.459 3.490 1.00 0.00 C ATOM 1141 CZ TYR A 196 11.792 0.015 2.338 1.00 0.00 C ATOM 1142 OH TYR A 196 13.092 -0.328 2.045 1.00 0.00 O ATOM 0 H TYR A 196 5.561 1.952 4.032 1.00 0.00 H new ATOM 0 HA TYR A 196 8.194 2.277 4.987 1.00 0.00 H new ATOM 0 HB2 TYR A 196 7.270 0.274 3.807 1.00 0.00 H new ATOM 0 HB3 TYR A 196 7.181 1.204 2.325 1.00 0.00 H new ATOM 0 HD1 TYR A 196 9.236 1.820 1.105 1.00 0.00 H new ATOM 0 HD2 TYR A 196 9.434 -0.485 4.684 1.00 0.00 H new ATOM 0 HE1 TYR A 196 11.554 1.204 0.579 1.00 0.00 H new ATOM 0 HE2 TYR A 196 11.754 -1.099 4.161 1.00 0.00 H new ATOM 0 HH TYR A 196 13.520 -0.700 2.844 1.00 0.00 H new ATOM 1152 N PHE A 197 7.387 4.034 2.313 1.00 0.00 N ATOM 1153 CA PHE A 197 7.801 5.155 1.478 1.00 0.00 C ATOM 1154 C PHE A 197 7.708 6.470 2.247 1.00 0.00 C ATOM 1155 O PHE A 197 8.181 7.507 1.784 1.00 0.00 O ATOM 1156 CB PHE A 197 6.935 5.226 0.218 1.00 0.00 C ATOM 1157 CG PHE A 197 7.457 4.393 -0.917 1.00 0.00 C ATOM 1158 CD1 PHE A 197 7.374 3.010 -0.874 1.00 0.00 C ATOM 1159 CD2 PHE A 197 8.032 4.991 -2.026 1.00 0.00 C ATOM 1160 CE1 PHE A 197 7.855 2.241 -1.917 1.00 0.00 C ATOM 1161 CE2 PHE A 197 8.515 4.227 -3.072 1.00 0.00 C ATOM 1162 CZ PHE A 197 8.425 2.850 -3.017 1.00 0.00 C ATOM 0 H PHE A 197 6.461 3.665 2.095 1.00 0.00 H new ATOM 0 HA PHE A 197 8.840 4.996 1.189 1.00 0.00 H new ATOM 0 HB2 PHE A 197 5.924 4.899 0.463 1.00 0.00 H new ATOM 0 HB3 PHE A 197 6.865 6.264 -0.106 1.00 0.00 H new ATOM 0 HD1 PHE A 197 6.929 2.528 -0.016 1.00 0.00 H new ATOM 0 HD2 PHE A 197 8.104 6.068 -2.074 1.00 0.00 H new ATOM 0 HE1 PHE A 197 7.785 1.164 -1.871 1.00 0.00 H new ATOM 0 HE2 PHE A 197 8.962 4.706 -3.931 1.00 0.00 H new ATOM 0 HZ PHE A 197 8.800 2.250 -3.833 1.00 0.00 H new ATOM 1172 N GLY A 198 7.095 6.418 3.425 1.00 0.00 N ATOM 1173 CA GLY A 198 6.951 7.610 4.240 1.00 0.00 C ATOM 1174 C GLY A 198 5.775 8.466 3.812 1.00 0.00 C ATOM 1175 O GLY A 198 5.910 9.677 3.643 1.00 0.00 O ATOM 0 H GLY A 198 6.695 5.571 3.830 1.00 0.00 H new ATOM 0 HA2 GLY A 198 6.825 7.320 5.283 1.00 0.00 H new ATOM 0 HA3 GLY A 198 7.866 8.199 4.181 1.00 0.00 H new ATOM 1179 N MET A 199 4.619 7.834 3.635 1.00 0.00 N ATOM 1180 CA MET A 199 3.415 8.547 3.223 1.00 0.00 C ATOM 1181 C MET A 199 2.477 8.758 4.407 1.00 0.00 C ATOM 1182 O MET A 199 2.688 8.202 5.486 1.00 0.00 O ATOM 1183 CB MET A 199 2.693 7.775 2.117 1.00 0.00 C ATOM 1184 CG MET A 199 3.394 7.846 0.770 1.00 0.00 C ATOM 1185 SD MET A 199 2.248 7.724 -0.616 1.00 0.00 S ATOM 1186 CE MET A 199 3.310 8.204 -1.977 1.00 0.00 C ATOM 0 H MET A 199 4.491 6.831 3.770 1.00 0.00 H new ATOM 0 HA MET A 199 3.713 9.523 2.840 1.00 0.00 H new ATOM 0 HB2 MET A 199 2.601 6.731 2.415 1.00 0.00 H new ATOM 0 HB3 MET A 199 1.681 8.167 2.012 1.00 0.00 H new ATOM 0 HG2 MET A 199 3.944 8.784 0.700 1.00 0.00 H new ATOM 0 HG3 MET A 199 4.126 7.041 0.703 1.00 0.00 H new ATOM 0 HE1 MET A 199 2.703 8.402 -2.860 1.00 0.00 H new ATOM 0 HE2 MET A 199 3.862 9.104 -1.707 1.00 0.00 H new ATOM 0 HE3 MET A 199 4.012 7.398 -2.192 1.00 0.00 H new ATOM 1196 N ASP A 200 1.442 9.564 4.200 1.00 0.00 N ATOM 1197 CA ASP A 200 0.471 9.848 5.250 1.00 0.00 C ATOM 1198 C ASP A 200 -0.951 9.595 4.758 1.00 0.00 C ATOM 1199 O ASP A 200 -1.585 10.478 4.180 1.00 0.00 O ATOM 1200 CB ASP A 200 0.610 11.295 5.725 1.00 0.00 C ATOM 1201 CG ASP A 200 0.154 11.480 7.159 1.00 0.00 C ATOM 1202 OD1 ASP A 200 0.578 10.685 8.024 1.00 0.00 O ATOM 1203 OD2 ASP A 200 -0.627 12.420 7.417 1.00 0.00 O ATOM 0 H ASP A 200 1.254 10.033 3.314 1.00 0.00 H new ATOM 0 HA ASP A 200 0.671 9.179 6.087 1.00 0.00 H new ATOM 0 HB2 ASP A 200 1.651 11.605 5.635 1.00 0.00 H new ATOM 0 HB3 ASP A 200 0.026 11.946 5.074 1.00 0.00 H new ATOM 1208 N HIS A 201 -1.446 8.384 4.991 1.00 0.00 N ATOM 1209 CA HIS A 201 -2.793 8.014 4.571 1.00 0.00 C ATOM 1210 C HIS A 201 -3.804 8.300 5.677 1.00 0.00 C ATOM 1211 O HIS A 201 -3.431 8.549 6.823 1.00 0.00 O ATOM 1212 CB HIS A 201 -2.843 6.535 4.187 1.00 0.00 C ATOM 1213 CG HIS A 201 -3.116 5.625 5.345 1.00 0.00 C ATOM 1214 ND1 HIS A 201 -4.378 5.425 5.863 1.00 0.00 N ATOM 1215 CD2 HIS A 201 -2.281 4.858 6.084 1.00 0.00 C ATOM 1216 CE1 HIS A 201 -4.307 4.575 6.872 1.00 0.00 C ATOM 1217 NE2 HIS A 201 -3.046 4.216 7.027 1.00 0.00 N ATOM 0 H HIS A 201 -0.935 7.642 5.468 1.00 0.00 H new ATOM 0 HA HIS A 201 -3.054 8.616 3.700 1.00 0.00 H new ATOM 0 HB2 HIS A 201 -3.615 6.390 3.432 1.00 0.00 H new ATOM 0 HB3 HIS A 201 -1.894 6.254 3.731 1.00 0.00 H new ATOM 0 HD2 HIS A 201 -1.212 4.768 5.956 1.00 0.00 H new ATOM 0 HE1 HIS A 201 -5.139 4.232 7.469 1.00 0.00 H new ATOM 0 HE2 HIS A 201 -2.697 3.567 7.732 1.00 0.00 H new ATOM 1226 N ASN A 202 -5.085 8.262 5.326 1.00 0.00 N ATOM 1227 CA ASN A 202 -6.150 8.518 6.289 1.00 0.00 C ATOM 1228 C ASN A 202 -7.437 7.808 5.879 1.00 0.00 C ATOM 1229 O ASN A 202 -7.598 7.410 4.725 1.00 0.00 O ATOM 1230 CB ASN A 202 -6.402 10.022 6.414 1.00 0.00 C ATOM 1231 CG ASN A 202 -6.900 10.412 7.793 1.00 0.00 C ATOM 1232 OD1 ASN A 202 -7.169 9.554 8.633 1.00 0.00 O ATOM 1233 ND2 ASN A 202 -7.026 11.712 8.030 1.00 0.00 N ATOM 0 H ASN A 202 -5.411 8.056 4.382 1.00 0.00 H new ATOM 0 HA ASN A 202 -5.833 8.128 7.256 1.00 0.00 H new ATOM 0 HB2 ASN A 202 -5.480 10.561 6.198 1.00 0.00 H new ATOM 0 HB3 ASN A 202 -7.134 10.329 5.666 1.00 0.00 H new ATOM 0 HD21 ASN A 202 -7.358 12.035 8.939 1.00 0.00 H new ATOM 0 HD22 ASN A 202 -6.791 12.388 7.303 1.00 0.00 H new ATOM 1240 N VAL A 203 -8.350 7.652 6.832 1.00 0.00 N ATOM 1241 CA VAL A 203 -9.623 6.992 6.571 1.00 0.00 C ATOM 1242 C VAL A 203 -10.657 7.981 6.044 1.00 0.00 C ATOM 1243 O VAL A 203 -10.618 9.167 6.369 1.00 0.00 O ATOM 1244 CB VAL A 203 -10.176 6.316 7.840 1.00 0.00 C ATOM 1245 CG1 VAL A 203 -9.267 5.177 8.277 1.00 0.00 C ATOM 1246 CG2 VAL A 203 -10.342 7.335 8.957 1.00 0.00 C ATOM 0 H VAL A 203 -8.231 7.974 7.793 1.00 0.00 H new ATOM 0 HA VAL A 203 -9.435 6.230 5.815 1.00 0.00 H new ATOM 0 HB VAL A 203 -11.157 5.899 7.611 1.00 0.00 H new ATOM 0 HG11 VAL A 203 -9.673 4.711 9.175 1.00 0.00 H new ATOM 0 HG12 VAL A 203 -9.204 4.436 7.480 1.00 0.00 H new ATOM 0 HG13 VAL A 203 -8.272 5.567 8.489 1.00 0.00 H new ATOM 0 HG21 VAL A 203 -10.734 6.840 9.846 1.00 0.00 H new ATOM 0 HG22 VAL A 203 -9.375 7.783 9.187 1.00 0.00 H new ATOM 0 HG23 VAL A 203 -11.036 8.113 8.639 1.00 0.00 H new ATOM 1256 N ASP A 204 -11.581 7.483 5.229 1.00 0.00 N ATOM 1257 CA ASP A 204 -12.628 8.323 4.657 1.00 0.00 C ATOM 1258 C ASP A 204 -13.725 8.596 5.682 1.00 0.00 C ATOM 1259 O ASP A 204 -13.766 7.972 6.741 1.00 0.00 O ATOM 1260 CB ASP A 204 -13.225 7.656 3.417 1.00 0.00 C ATOM 1261 CG ASP A 204 -13.837 8.659 2.459 1.00 0.00 C ATOM 1262 OD1 ASP A 204 -13.210 9.712 2.223 1.00 0.00 O ATOM 1263 OD2 ASP A 204 -14.944 8.390 1.946 1.00 0.00 O ATOM 0 H ASP A 204 -11.626 6.503 4.950 1.00 0.00 H new ATOM 0 HA ASP A 204 -12.181 9.274 4.368 1.00 0.00 H new ATOM 0 HB2 ASP A 204 -12.448 7.093 2.901 1.00 0.00 H new ATOM 0 HB3 ASP A 204 -13.987 6.940 3.724 1.00 0.00 H new ATOM 1268 N GLN A 205 -14.610 9.534 5.357 1.00 0.00 N ATOM 1269 CA GLN A 205 -15.706 9.891 6.250 1.00 0.00 C ATOM 1270 C GLN A 205 -16.488 8.652 6.675 1.00 0.00 C ATOM 1271 O GLN A 205 -17.242 8.683 7.648 1.00 0.00 O ATOM 1272 CB GLN A 205 -16.641 10.891 5.569 1.00 0.00 C ATOM 1273 CG GLN A 205 -17.261 10.366 4.284 1.00 0.00 C ATOM 1274 CD GLN A 205 -18.417 11.220 3.802 1.00 0.00 C ATOM 1275 OE1 GLN A 205 -18.460 12.425 4.052 1.00 0.00 O ATOM 1276 NE2 GLN A 205 -19.362 10.600 3.106 1.00 0.00 N ATOM 0 H GLN A 205 -14.589 10.059 4.483 1.00 0.00 H new ATOM 0 HA GLN A 205 -15.280 10.352 7.141 1.00 0.00 H new ATOM 0 HB2 GLN A 205 -17.437 11.162 6.263 1.00 0.00 H new ATOM 0 HB3 GLN A 205 -16.086 11.803 5.349 1.00 0.00 H new ATOM 0 HG2 GLN A 205 -16.497 10.324 3.508 1.00 0.00 H new ATOM 0 HG3 GLN A 205 -17.610 9.346 4.444 1.00 0.00 H new ATOM 0 HE21 GLN A 205 -19.286 9.600 2.922 1.00 0.00 H new ATOM 0 HE22 GLN A 205 -20.164 11.124 2.755 1.00 0.00 H new ATOM 1285 N THR A 206 -16.303 7.561 5.938 1.00 0.00 N ATOM 1286 CA THR A 206 -16.992 6.312 6.237 1.00 0.00 C ATOM 1287 C THR A 206 -16.009 5.231 6.670 1.00 0.00 C ATOM 1288 O THR A 206 -16.338 4.367 7.482 1.00 0.00 O ATOM 1289 CB THR A 206 -17.790 5.805 5.020 1.00 0.00 C ATOM 1290 OG1 THR A 206 -16.909 5.588 3.912 1.00 0.00 O ATOM 1291 CG2 THR A 206 -18.870 6.803 4.628 1.00 0.00 C ATOM 0 H THR A 206 -15.682 7.517 5.130 1.00 0.00 H new ATOM 0 HA THR A 206 -17.682 6.521 7.055 1.00 0.00 H new ATOM 0 HB THR A 206 -18.268 4.864 5.293 1.00 0.00 H new ATOM 0 HG1 THR A 206 -17.424 5.264 3.143 1.00 0.00 H new ATOM 0 HG21 THR A 206 -19.420 6.424 3.767 1.00 0.00 H new ATOM 0 HG22 THR A 206 -19.556 6.944 5.463 1.00 0.00 H new ATOM 0 HG23 THR A 206 -18.409 7.757 4.373 1.00 0.00 H new ATOM 1299 N GLY A 207 -14.798 5.286 6.124 1.00 0.00 N ATOM 1300 CA GLY A 207 -13.784 4.306 6.467 1.00 0.00 C ATOM 1301 C GLY A 207 -13.761 3.134 5.506 1.00 0.00 C ATOM 1302 O GLY A 207 -13.338 2.035 5.865 1.00 0.00 O ATOM 0 H GLY A 207 -14.501 5.992 5.450 1.00 0.00 H new ATOM 0 HA2 GLY A 207 -12.806 4.787 6.472 1.00 0.00 H new ATOM 0 HA3 GLY A 207 -13.964 3.940 7.478 1.00 0.00 H new ATOM 1306 N LYS A 208 -14.218 3.367 4.281 1.00 0.00 N ATOM 1307 CA LYS A 208 -14.250 2.323 3.263 1.00 0.00 C ATOM 1308 C LYS A 208 -12.946 2.295 2.472 1.00 0.00 C ATOM 1309 O LYS A 208 -12.223 1.299 2.485 1.00 0.00 O ATOM 1310 CB LYS A 208 -15.430 2.542 2.314 1.00 0.00 C ATOM 1311 CG LYS A 208 -16.743 1.987 2.838 1.00 0.00 C ATOM 1312 CD LYS A 208 -16.725 0.469 2.893 1.00 0.00 C ATOM 1313 CE LYS A 208 -18.072 -0.090 3.326 1.00 0.00 C ATOM 1314 NZ LYS A 208 -18.001 -1.549 3.613 1.00 0.00 N ATOM 0 H LYS A 208 -14.572 4.271 3.968 1.00 0.00 H new ATOM 0 HA LYS A 208 -14.370 1.364 3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 208 -15.544 3.610 2.130 1.00 0.00 H new ATOM 0 HB3 LYS A 208 -15.205 2.076 1.355 1.00 0.00 H new ATOM 0 HG2 LYS A 208 -16.936 2.386 3.834 1.00 0.00 H new ATOM 0 HG3 LYS A 208 -17.561 2.319 2.198 1.00 0.00 H new ATOM 0 HD2 LYS A 208 -16.463 0.072 1.912 1.00 0.00 H new ATOM 0 HD3 LYS A 208 -15.953 0.138 3.587 1.00 0.00 H new ATOM 0 HE2 LYS A 208 -18.416 0.439 4.215 1.00 0.00 H new ATOM 0 HE3 LYS A 208 -18.809 0.091 2.543 1.00 0.00 H new ATOM 0 HZ1 LYS A 208 -18.939 -1.891 3.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 208 -17.698 -2.057 2.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 208 -17.317 -1.720 4.378 1.00 0.00 H new ATOM 1328 N ALA A 209 -12.651 3.394 1.786 1.00 0.00 N ATOM 1329 CA ALA A 209 -11.433 3.496 0.992 1.00 0.00 C ATOM 1330 C ALA A 209 -10.372 4.315 1.719 1.00 0.00 C ATOM 1331 O ALA A 209 -10.682 5.089 2.625 1.00 0.00 O ATOM 1332 CB ALA A 209 -11.738 4.110 -0.366 1.00 0.00 C ATOM 0 H ALA A 209 -13.239 4.227 1.764 1.00 0.00 H new ATOM 0 HA ALA A 209 -11.040 2.490 0.843 1.00 0.00 H new ATOM 0 HB1 ALA A 209 -10.819 4.180 -0.948 1.00 0.00 H new ATOM 0 HB2 ALA A 209 -12.456 3.484 -0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 209 -12.157 5.107 -0.229 1.00 0.00 H new ATOM 1338 N VAL A 210 -9.117 4.139 1.317 1.00 0.00 N ATOM 1339 CA VAL A 210 -8.009 4.862 1.929 1.00 0.00 C ATOM 1340 C VAL A 210 -7.492 5.960 1.006 1.00 0.00 C ATOM 1341 O VAL A 210 -7.354 5.756 -0.200 1.00 0.00 O ATOM 1342 CB VAL A 210 -6.848 3.915 2.283 1.00 0.00 C ATOM 1343 CG1 VAL A 210 -5.694 4.690 2.901 1.00 0.00 C ATOM 1344 CG2 VAL A 210 -7.324 2.815 3.220 1.00 0.00 C ATOM 0 H VAL A 210 -8.843 3.501 0.570 1.00 0.00 H new ATOM 0 HA VAL A 210 -8.393 5.312 2.845 1.00 0.00 H new ATOM 0 HB VAL A 210 -6.490 3.449 1.365 1.00 0.00 H new ATOM 0 HG11 VAL A 210 -4.883 4.003 3.144 1.00 0.00 H new ATOM 0 HG12 VAL A 210 -5.336 5.437 2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 210 -6.034 5.186 3.810 1.00 0.00 H new ATOM 0 HG21 VAL A 210 -6.490 2.155 3.460 1.00 0.00 H new ATOM 0 HG22 VAL A 210 -7.710 3.260 4.137 1.00 0.00 H new ATOM 0 HG23 VAL A 210 -8.114 2.241 2.735 1.00 0.00 H new ATOM 1354 N ILE A 211 -7.206 7.123 1.582 1.00 0.00 N ATOM 1355 CA ILE A 211 -6.702 8.253 0.810 1.00 0.00 C ATOM 1356 C ILE A 211 -5.275 8.604 1.218 1.00 0.00 C ATOM 1357 O ILE A 211 -4.966 8.705 2.405 1.00 0.00 O ATOM 1358 CB ILE A 211 -7.594 9.496 0.985 1.00 0.00 C ATOM 1359 CG1 ILE A 211 -9.063 9.133 0.757 1.00 0.00 C ATOM 1360 CG2 ILE A 211 -7.161 10.597 0.028 1.00 0.00 C ATOM 1361 CD1 ILE A 211 -9.759 8.621 1.999 1.00 0.00 C ATOM 0 H ILE A 211 -7.314 7.308 2.579 1.00 0.00 H new ATOM 0 HA ILE A 211 -6.714 7.951 -0.237 1.00 0.00 H new ATOM 0 HB ILE A 211 -7.484 9.863 2.005 1.00 0.00 H new ATOM 0 HG12 ILE A 211 -9.593 10.012 0.389 1.00 0.00 H new ATOM 0 HG13 ILE A 211 -9.124 8.374 -0.023 1.00 0.00 H new ATOM 0 HG21 ILE A 211 -7.801 11.469 0.163 1.00 0.00 H new ATOM 0 HG22 ILE A 211 -6.126 10.871 0.233 1.00 0.00 H new ATOM 0 HG23 ILE A 211 -7.246 10.241 -0.999 1.00 0.00 H new ATOM 0 HD11 ILE A 211 -10.796 8.384 1.763 1.00 0.00 H new ATOM 0 HD12 ILE A 211 -9.253 7.724 2.356 1.00 0.00 H new ATOM 0 HD13 ILE A 211 -9.729 9.386 2.774 1.00 0.00 H new ATOM 1373 N ILE A 212 -4.411 8.789 0.226 1.00 0.00 N ATOM 1374 CA ILE A 212 -3.018 9.132 0.481 1.00 0.00 C ATOM 1375 C ILE A 212 -2.667 10.490 -0.116 1.00 0.00 C ATOM 1376 O ILE A 212 -3.494 11.123 -0.772 1.00 0.00 O ATOM 1377 CB ILE A 212 -2.062 8.069 -0.094 1.00 0.00 C ATOM 1378 CG1 ILE A 212 -2.189 8.009 -1.617 1.00 0.00 C ATOM 1379 CG2 ILE A 212 -2.352 6.708 0.522 1.00 0.00 C ATOM 1380 CD1 ILE A 212 -1.044 7.286 -2.291 1.00 0.00 C ATOM 0 H ILE A 212 -4.651 8.707 -0.762 1.00 0.00 H new ATOM 0 HA ILE A 212 -2.897 9.172 1.563 1.00 0.00 H new ATOM 0 HB ILE A 212 -1.038 8.348 0.155 1.00 0.00 H new ATOM 0 HG12 ILE A 212 -3.124 7.513 -1.876 1.00 0.00 H new ATOM 0 HG13 ILE A 212 -2.248 9.024 -2.009 1.00 0.00 H new ATOM 0 HG21 ILE A 212 -1.669 5.967 0.106 1.00 0.00 H new ATOM 0 HG22 ILE A 212 -2.216 6.761 1.602 1.00 0.00 H new ATOM 0 HG23 ILE A 212 -3.379 6.419 0.300 1.00 0.00 H new ATOM 0 HD11 ILE A 212 -1.201 7.282 -3.370 1.00 0.00 H new ATOM 0 HD12 ILE A 212 -0.107 7.795 -2.062 1.00 0.00 H new ATOM 0 HD13 ILE A 212 -0.998 6.259 -1.928 1.00 0.00 H new ATOM 1392 N ASN A 213 -1.435 10.932 0.115 1.00 0.00 N ATOM 1393 CA ASN A 213 -0.974 12.216 -0.402 1.00 0.00 C ATOM 1394 C ASN A 213 0.497 12.145 -0.800 1.00 0.00 C ATOM 1395 O ASN A 213 1.147 11.113 -0.637 1.00 0.00 O ATOM 1396 CB ASN A 213 -1.179 13.313 0.645 1.00 0.00 C ATOM 1397 CG ASN A 213 0.003 13.442 1.586 1.00 0.00 C ATOM 1398 OD1 ASN A 213 0.744 14.425 1.538 1.00 0.00 O ATOM 1399 ND2 ASN A 213 0.186 12.448 2.447 1.00 0.00 N ATOM 0 H ASN A 213 -0.738 10.420 0.656 1.00 0.00 H new ATOM 0 HA ASN A 213 -1.561 12.455 -1.289 1.00 0.00 H new ATOM 0 HB2 ASN A 213 -1.345 14.265 0.142 1.00 0.00 H new ATOM 0 HB3 ASN A 213 -2.078 13.097 1.223 1.00 0.00 H new ATOM 0 HD21 ASN A 213 0.965 12.479 3.104 1.00 0.00 H new ATOM 0 HD22 ASN A 213 -0.453 11.653 2.451 1.00 0.00 H new ATOM 1406 N LYS A 214 1.016 13.251 -1.322 1.00 0.00 N ATOM 1407 CA LYS A 214 2.411 13.318 -1.743 1.00 0.00 C ATOM 1408 C LYS A 214 3.146 14.438 -1.014 1.00 0.00 C ATOM 1409 O LYS A 214 2.662 15.569 -0.943 1.00 0.00 O ATOM 1410 CB LYS A 214 2.499 13.534 -3.255 1.00 0.00 C ATOM 1411 CG LYS A 214 2.027 14.907 -3.702 1.00 0.00 C ATOM 1412 CD LYS A 214 3.168 15.910 -3.721 1.00 0.00 C ATOM 1413 CE LYS A 214 4.014 15.769 -4.976 1.00 0.00 C ATOM 1414 NZ LYS A 214 5.423 16.192 -4.747 1.00 0.00 N ATOM 0 H LYS A 214 0.491 14.114 -1.464 1.00 0.00 H new ATOM 0 HA LYS A 214 2.887 12.371 -1.490 1.00 0.00 H new ATOM 0 HB2 LYS A 214 3.532 13.392 -3.574 1.00 0.00 H new ATOM 0 HB3 LYS A 214 1.903 12.773 -3.758 1.00 0.00 H new ATOM 0 HG2 LYS A 214 1.588 14.836 -4.697 1.00 0.00 H new ATOM 0 HG3 LYS A 214 1.243 15.259 -3.032 1.00 0.00 H new ATOM 0 HD2 LYS A 214 2.766 16.921 -3.664 1.00 0.00 H new ATOM 0 HD3 LYS A 214 3.795 15.766 -2.841 1.00 0.00 H new ATOM 0 HE2 LYS A 214 3.996 14.732 -5.311 1.00 0.00 H new ATOM 0 HE3 LYS A 214 3.580 16.370 -5.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 214 5.966 16.081 -5.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 214 5.443 17.189 -4.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 214 5.846 15.602 -4.002 1.00 0.00 H new ATOM 1428 N THR A 215 4.318 14.118 -0.475 1.00 0.00 N ATOM 1429 CA THR A 215 5.120 15.098 0.247 1.00 0.00 C ATOM 1430 C THR A 215 6.587 15.014 -0.159 1.00 0.00 C ATOM 1431 O THR A 215 7.022 14.026 -0.750 1.00 0.00 O ATOM 1432 CB THR A 215 5.009 14.902 1.771 1.00 0.00 C ATOM 1433 OG1 THR A 215 5.550 13.629 2.142 1.00 0.00 O ATOM 1434 CG2 THR A 215 3.559 14.993 2.223 1.00 0.00 C ATOM 0 H THR A 215 4.733 13.188 -0.525 1.00 0.00 H new ATOM 0 HA THR A 215 4.729 16.081 -0.015 1.00 0.00 H new ATOM 0 HB THR A 215 5.577 15.694 2.260 1.00 0.00 H new ATOM 0 HG1 THR A 215 5.477 13.513 3.112 1.00 0.00 H new ATOM 0 HG21 THR A 215 3.505 14.852 3.302 1.00 0.00 H new ATOM 0 HG22 THR A 215 3.158 15.973 1.965 1.00 0.00 H new ATOM 0 HG23 THR A 215 2.974 14.219 1.726 1.00 0.00 H new ATOM 1442 N SER A 216 7.346 16.057 0.163 1.00 0.00 N ATOM 1443 CA SER A 216 8.765 16.102 -0.171 1.00 0.00 C ATOM 1444 C SER A 216 9.525 14.985 0.537 1.00 0.00 C ATOM 1445 O SER A 216 10.317 14.272 -0.078 1.00 0.00 O ATOM 1446 CB SER A 216 9.357 17.460 0.212 1.00 0.00 C ATOM 1447 OG SER A 216 9.275 17.677 1.610 1.00 0.00 O ATOM 0 H SER A 216 7.002 16.882 0.655 1.00 0.00 H new ATOM 0 HA SER A 216 8.865 15.960 -1.247 1.00 0.00 H new ATOM 0 HB2 SER A 216 10.398 17.509 -0.106 1.00 0.00 H new ATOM 0 HB3 SER A 216 8.826 18.253 -0.314 1.00 0.00 H new ATOM 0 HG SER A 216 9.661 18.551 1.829 1.00 0.00 H new ATOM 1453 N ASN A 217 9.278 14.840 1.835 1.00 0.00 N ATOM 1454 CA ASN A 217 9.940 13.811 2.629 1.00 0.00 C ATOM 1455 C ASN A 217 9.897 12.463 1.916 1.00 0.00 C ATOM 1456 O ASN A 217 10.837 11.672 2.000 1.00 0.00 O ATOM 1457 CB ASN A 217 9.279 13.694 4.004 1.00 0.00 C ATOM 1458 CG ASN A 217 9.287 15.008 4.762 1.00 0.00 C ATOM 1459 OD1 ASN A 217 10.344 15.588 5.010 1.00 0.00 O ATOM 1460 ND2 ASN A 217 8.104 15.482 5.135 1.00 0.00 N ATOM 0 H ASN A 217 8.624 15.422 2.359 1.00 0.00 H new ATOM 0 HA ASN A 217 10.983 14.101 2.758 1.00 0.00 H new ATOM 0 HB2 ASN A 217 8.251 13.354 3.882 1.00 0.00 H new ATOM 0 HB3 ASN A 217 9.798 12.936 4.591 1.00 0.00 H new ATOM 0 HD21 ASN A 217 8.046 16.361 5.649 1.00 0.00 H new ATOM 0 HD22 ASN A 217 7.253 14.967 4.907 1.00 0.00 H new ATOM 1467 N THR A 218 8.798 12.207 1.212 1.00 0.00 N ATOM 1468 CA THR A 218 8.632 10.955 0.484 1.00 0.00 C ATOM 1469 C THR A 218 9.630 10.849 -0.663 1.00 0.00 C ATOM 1470 O THR A 218 9.524 11.565 -1.659 1.00 0.00 O ATOM 1471 CB THR A 218 7.204 10.818 -0.079 1.00 0.00 C ATOM 1472 OG1 THR A 218 6.277 10.591 0.989 1.00 0.00 O ATOM 1473 CG2 THR A 218 7.124 9.675 -1.079 1.00 0.00 C ATOM 0 H THR A 218 8.010 12.850 1.131 1.00 0.00 H new ATOM 0 HA THR A 218 8.814 10.149 1.195 1.00 0.00 H new ATOM 0 HB THR A 218 6.948 11.745 -0.591 1.00 0.00 H new ATOM 0 HG1 THR A 218 6.749 10.204 1.755 1.00 0.00 H new ATOM 0 HG21 THR A 218 6.107 9.598 -1.463 1.00 0.00 H new ATOM 0 HG22 THR A 218 7.810 9.865 -1.905 1.00 0.00 H new ATOM 0 HG23 THR A 218 7.398 8.742 -0.587 1.00 0.00 H new ATOM 1481 N ARG A 219 10.598 9.950 -0.517 1.00 0.00 N ATOM 1482 CA ARG A 219 11.616 9.751 -1.542 1.00 0.00 C ATOM 1483 C ARG A 219 11.625 8.303 -2.025 1.00 0.00 C ATOM 1484 O ARG A 219 11.061 7.420 -1.378 1.00 0.00 O ATOM 1485 CB ARG A 219 12.996 10.128 -1.000 1.00 0.00 C ATOM 1486 CG ARG A 219 14.023 10.402 -2.087 1.00 0.00 C ATOM 1487 CD ARG A 219 15.306 10.978 -1.508 1.00 0.00 C ATOM 1488 NE ARG A 219 16.209 9.933 -1.032 1.00 0.00 N ATOM 1489 CZ ARG A 219 16.119 9.377 0.171 1.00 0.00 C ATOM 1490 NH1 ARG A 219 15.172 9.763 1.014 1.00 0.00 N ATOM 1491 NH2 ARG A 219 16.978 8.432 0.531 1.00 0.00 N ATOM 0 H ARG A 219 10.699 9.348 0.300 1.00 0.00 H new ATOM 0 HA ARG A 219 11.377 10.396 -2.387 1.00 0.00 H new ATOM 0 HB2 ARG A 219 12.901 11.013 -0.371 1.00 0.00 H new ATOM 0 HB3 ARG A 219 13.360 9.322 -0.363 1.00 0.00 H new ATOM 0 HG2 ARG A 219 14.246 9.478 -2.620 1.00 0.00 H new ATOM 0 HG3 ARG A 219 13.607 11.098 -2.816 1.00 0.00 H new ATOM 0 HD2 ARG A 219 15.811 11.575 -2.268 1.00 0.00 H new ATOM 0 HD3 ARG A 219 15.063 11.650 -0.685 1.00 0.00 H new ATOM 0 HE ARG A 219 16.949 9.613 -1.657 1.00 0.00 H new ATOM 0 HH11 ARG A 219 14.510 10.489 0.740 1.00 0.00 H new ATOM 0 HH12 ARG A 219 15.105 9.334 1.937 1.00 0.00 H new ATOM 0 HH21 ARG A 219 17.707 8.133 -0.116 1.00 0.00 H new ATOM 0 HH22 ARG A 219 16.909 8.005 1.455 1.00 0.00 H new ATOM 1505 N ILE A 220 12.269 8.069 -3.163 1.00 0.00 N ATOM 1506 CA ILE A 220 12.351 6.729 -3.732 1.00 0.00 C ATOM 1507 C ILE A 220 13.314 5.853 -2.936 1.00 0.00 C ATOM 1508 O ILE A 220 14.415 6.268 -2.574 1.00 0.00 O ATOM 1509 CB ILE A 220 12.807 6.768 -5.202 1.00 0.00 C ATOM 1510 CG1 ILE A 220 11.908 7.705 -6.012 1.00 0.00 C ATOM 1511 CG2 ILE A 220 12.796 5.368 -5.798 1.00 0.00 C ATOM 1512 CD1 ILE A 220 12.398 7.942 -7.424 1.00 0.00 C ATOM 0 H ILE A 220 12.742 8.789 -3.709 1.00 0.00 H new ATOM 0 HA ILE A 220 11.349 6.303 -3.683 1.00 0.00 H new ATOM 0 HB ILE A 220 13.827 7.150 -5.241 1.00 0.00 H new ATOM 0 HG12 ILE A 220 10.902 7.287 -6.051 1.00 0.00 H new ATOM 0 HG13 ILE A 220 11.836 8.662 -5.496 1.00 0.00 H new ATOM 0 HG21 ILE A 220 13.121 5.413 -6.838 1.00 0.00 H new ATOM 0 HG22 ILE A 220 13.473 4.727 -5.233 1.00 0.00 H new ATOM 0 HG23 ILE A 220 11.786 4.960 -5.751 1.00 0.00 H new ATOM 0 HD11 ILE A 220 11.712 8.615 -7.939 1.00 0.00 H new ATOM 0 HD12 ILE A 220 13.392 8.389 -7.394 1.00 0.00 H new ATOM 0 HD13 ILE A 220 12.443 6.993 -7.958 1.00 0.00 H new ATOM 1524 N PRO A 221 12.891 4.611 -2.659 1.00 0.00 N ATOM 1525 CA PRO A 221 13.701 3.649 -1.906 1.00 0.00 C ATOM 1526 C PRO A 221 14.912 3.166 -2.697 1.00 0.00 C ATOM 1527 O PRO A 221 14.898 3.158 -3.927 1.00 0.00 O ATOM 1528 CB PRO A 221 12.733 2.491 -1.652 1.00 0.00 C ATOM 1529 CG PRO A 221 11.734 2.584 -2.754 1.00 0.00 C ATOM 1530 CD PRO A 221 11.590 4.049 -3.060 1.00 0.00 C ATOM 0 HA PRO A 221 14.112 4.087 -0.996 1.00 0.00 H new ATOM 0 HB2 PRO A 221 13.251 1.532 -1.667 1.00 0.00 H new ATOM 0 HB3 PRO A 221 12.256 2.581 -0.676 1.00 0.00 H new ATOM 0 HG2 PRO A 221 12.070 2.033 -3.633 1.00 0.00 H new ATOM 0 HG3 PRO A 221 10.779 2.153 -2.453 1.00 0.00 H new ATOM 0 HD2 PRO A 221 11.387 4.221 -4.117 1.00 0.00 H new ATOM 0 HD3 PRO A 221 10.769 4.498 -2.501 1.00 0.00 H new ATOM 1538 N GLU A 222 15.958 2.763 -1.982 1.00 0.00 N ATOM 1539 CA GLU A 222 17.177 2.279 -2.619 1.00 0.00 C ATOM 1540 C GLU A 222 16.875 1.116 -3.559 1.00 0.00 C ATOM 1541 O GLU A 222 17.384 1.062 -4.678 1.00 0.00 O ATOM 1542 CB GLU A 222 18.194 1.844 -1.561 1.00 0.00 C ATOM 1543 CG GLU A 222 19.570 1.540 -2.129 1.00 0.00 C ATOM 1544 CD GLU A 222 19.583 0.295 -2.993 1.00 0.00 C ATOM 1545 OE1 GLU A 222 18.992 -0.723 -2.575 1.00 0.00 O ATOM 1546 OE2 GLU A 222 20.184 0.337 -4.087 1.00 0.00 O ATOM 0 H GLU A 222 15.986 2.762 -0.962 1.00 0.00 H new ATOM 0 HA GLU A 222 17.599 3.096 -3.204 1.00 0.00 H new ATOM 0 HB2 GLU A 222 18.285 2.630 -0.812 1.00 0.00 H new ATOM 0 HB3 GLU A 222 17.817 0.958 -1.050 1.00 0.00 H new ATOM 0 HG2 GLU A 222 19.911 2.391 -2.719 1.00 0.00 H new ATOM 0 HG3 GLU A 222 20.278 1.416 -1.309 1.00 0.00 H new ATOM 1553 N GLN A 223 16.045 0.188 -3.095 1.00 0.00 N ATOM 1554 CA GLN A 223 15.676 -0.975 -3.893 1.00 0.00 C ATOM 1555 C GLN A 223 14.168 -1.023 -4.120 1.00 0.00 C ATOM 1556 O GLN A 223 13.391 -0.544 -3.295 1.00 0.00 O ATOM 1557 CB GLN A 223 16.142 -2.260 -3.207 1.00 0.00 C ATOM 1558 CG GLN A 223 15.613 -3.526 -3.861 1.00 0.00 C ATOM 1559 CD GLN A 223 16.502 -4.728 -3.610 1.00 0.00 C ATOM 1560 OE1 GLN A 223 16.481 -5.683 -4.533 1.00 0.00 O flip ATOM 1561 NE2 GLN A 223 17.200 -4.798 -2.598 1.00 0.00 N flip ATOM 0 H GLN A 223 15.615 0.219 -2.170 1.00 0.00 H new ATOM 0 HA GLN A 223 16.168 -0.890 -4.862 1.00 0.00 H new ATOM 0 HB2 GLN A 223 17.232 -2.288 -3.209 1.00 0.00 H new ATOM 0 HB3 GLN A 223 15.826 -2.240 -2.164 1.00 0.00 H new ATOM 0 HG2 GLN A 223 14.612 -3.734 -3.484 1.00 0.00 H new ATOM 0 HG3 GLN A 223 15.522 -3.365 -4.935 1.00 0.00 H new ATOM 0 HE21 GLN A 223 17.185 -4.041 -1.915 1.00 0.00 H new ATOM 0 HE22 GLN A 223 17.793 -5.613 -2.443 1.00 0.00 H new ATOM 1570 N ARG A 224 13.763 -1.605 -5.244 1.00 0.00 N ATOM 1571 CA ARG A 224 12.348 -1.714 -5.580 1.00 0.00 C ATOM 1572 C ARG A 224 11.882 -3.165 -5.502 1.00 0.00 C ATOM 1573 O ARG A 224 12.684 -4.076 -5.298 1.00 0.00 O ATOM 1574 CB ARG A 224 12.091 -1.159 -6.982 1.00 0.00 C ATOM 1575 CG ARG A 224 12.069 0.359 -7.042 1.00 0.00 C ATOM 1576 CD ARG A 224 11.605 0.857 -8.402 1.00 0.00 C ATOM 1577 NE ARG A 224 10.198 0.551 -8.646 1.00 0.00 N ATOM 1578 CZ ARG A 224 9.669 0.443 -9.860 1.00 0.00 C ATOM 1579 NH1 ARG A 224 10.427 0.615 -10.934 1.00 0.00 N ATOM 1580 NH2 ARG A 224 8.380 0.162 -10.001 1.00 0.00 N ATOM 0 H ARG A 224 14.394 -2.008 -5.937 1.00 0.00 H new ATOM 0 HA ARG A 224 11.781 -1.129 -4.856 1.00 0.00 H new ATOM 0 HB2 ARG A 224 12.862 -1.530 -7.657 1.00 0.00 H new ATOM 0 HB3 ARG A 224 11.138 -1.542 -7.346 1.00 0.00 H new ATOM 0 HG2 ARG A 224 11.407 0.745 -6.267 1.00 0.00 H new ATOM 0 HG3 ARG A 224 13.066 0.747 -6.832 1.00 0.00 H new ATOM 0 HD2 ARG A 224 11.758 1.934 -8.465 1.00 0.00 H new ATOM 0 HD3 ARG A 224 12.215 0.402 -9.182 1.00 0.00 H new ATOM 0 HE ARG A 224 9.588 0.413 -7.840 1.00 0.00 H new ATOM 0 HH11 ARG A 224 11.418 0.831 -10.829 1.00 0.00 H new ATOM 0 HH12 ARG A 224 10.019 0.532 -11.865 1.00 0.00 H new ATOM 0 HH21 ARG A 224 7.794 0.029 -9.177 1.00 0.00 H new ATOM 0 HH22 ARG A 224 7.975 0.079 -10.934 1.00 0.00 H new ATOM 1594 N PHE A 225 10.579 -3.372 -5.665 1.00 0.00 N ATOM 1595 CA PHE A 225 10.005 -4.711 -5.611 1.00 0.00 C ATOM 1596 C PHE A 225 10.433 -5.535 -6.822 1.00 0.00 C ATOM 1597 O PHE A 225 10.766 -6.714 -6.698 1.00 0.00 O ATOM 1598 CB PHE A 225 8.478 -4.632 -5.548 1.00 0.00 C ATOM 1599 CG PHE A 225 7.956 -4.201 -4.207 1.00 0.00 C ATOM 1600 CD1 PHE A 225 8.432 -3.049 -3.602 1.00 0.00 C ATOM 1601 CD2 PHE A 225 6.988 -4.946 -3.553 1.00 0.00 C ATOM 1602 CE1 PHE A 225 7.953 -2.650 -2.368 1.00 0.00 C ATOM 1603 CE2 PHE A 225 6.505 -4.552 -2.320 1.00 0.00 C ATOM 1604 CZ PHE A 225 6.988 -3.401 -1.727 1.00 0.00 C ATOM 0 H PHE A 225 9.901 -2.629 -5.836 1.00 0.00 H new ATOM 0 HA PHE A 225 10.374 -5.202 -4.710 1.00 0.00 H new ATOM 0 HB2 PHE A 225 8.126 -3.934 -6.308 1.00 0.00 H new ATOM 0 HB3 PHE A 225 8.061 -5.608 -5.795 1.00 0.00 H new ATOM 0 HD1 PHE A 225 9.185 -2.456 -4.100 1.00 0.00 H new ATOM 0 HD2 PHE A 225 6.606 -5.846 -4.013 1.00 0.00 H new ATOM 0 HE1 PHE A 225 8.334 -1.751 -1.906 1.00 0.00 H new ATOM 0 HE2 PHE A 225 5.751 -5.143 -1.820 1.00 0.00 H new ATOM 0 HZ PHE A 225 6.611 -3.090 -0.764 1.00 0.00 H new ATOM 1614 N SER A 226 10.420 -4.906 -7.993 1.00 0.00 N ATOM 1615 CA SER A 226 10.802 -5.581 -9.228 1.00 0.00 C ATOM 1616 C SER A 226 12.241 -6.081 -9.151 1.00 0.00 C ATOM 1617 O SER A 226 12.560 -7.163 -9.641 1.00 0.00 O ATOM 1618 CB SER A 226 10.641 -4.637 -10.421 1.00 0.00 C ATOM 1619 OG SER A 226 11.393 -3.450 -10.237 1.00 0.00 O ATOM 0 H SER A 226 10.149 -3.930 -8.112 1.00 0.00 H new ATOM 0 HA SER A 226 10.144 -6.440 -9.362 1.00 0.00 H new ATOM 0 HB2 SER A 226 10.965 -5.139 -11.332 1.00 0.00 H new ATOM 0 HB3 SER A 226 9.588 -4.388 -10.552 1.00 0.00 H new ATOM 0 HG SER A 226 11.275 -2.864 -11.014 1.00 0.00 H new ATOM 1625 N GLU A 227 13.106 -5.283 -8.531 1.00 0.00 N ATOM 1626 CA GLU A 227 14.512 -5.644 -8.391 1.00 0.00 C ATOM 1627 C GLU A 227 14.659 -7.099 -7.954 1.00 0.00 C ATOM 1628 O GLU A 227 15.443 -7.854 -8.529 1.00 0.00 O ATOM 1629 CB GLU A 227 15.198 -4.724 -7.379 1.00 0.00 C ATOM 1630 CG GLU A 227 15.349 -3.292 -7.862 1.00 0.00 C ATOM 1631 CD GLU A 227 16.216 -3.183 -9.101 1.00 0.00 C ATOM 1632 OE1 GLU A 227 15.675 -3.317 -10.219 1.00 0.00 O ATOM 1633 OE2 GLU A 227 17.437 -2.962 -8.953 1.00 0.00 O ATOM 0 H GLU A 227 12.858 -4.384 -8.118 1.00 0.00 H new ATOM 0 HA GLU A 227 14.991 -5.525 -9.363 1.00 0.00 H new ATOM 0 HB2 GLU A 227 14.625 -4.727 -6.452 1.00 0.00 H new ATOM 0 HB3 GLU A 227 16.184 -5.126 -7.146 1.00 0.00 H new ATOM 0 HG2 GLU A 227 14.363 -2.879 -8.075 1.00 0.00 H new ATOM 0 HG3 GLU A 227 15.783 -2.688 -7.065 1.00 0.00 H new