USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 545 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 249 MET CE :methyl -160:sc= -3.18 (180deg=-3.88!) USER MOD Single : A 251 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 252 CYS SG : rot 144:sc= -7.34! USER MOD Single : A 254 SER OG : rot 63:sc= 1.7! USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 267 GLN : amide:sc= -2.93! C(o=-2.9!,f=-5!) USER MOD Single : A 275 SER OG : rot 170:sc= -4.02 USER MOD Single : A 276 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 278 THR OG1 : rot 46:sc= 0.29 USER MOD Single : A 279 THR OG1 : rot 180:sc= 0 USER MOD Single : A 280 ASN : amide:sc= -0.301 X(o=-0.3,f=-0.071) USER MOD Single : A 281 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.19) USER MOD Single : A 284 ASN : amide:sc= -0.21 K(o=-0.21,f=-0.87) USER MOD Single : A 292 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 294 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 296 ASN : amide:sc= -0.368 K(o=-0.37,f=-3.6!) USER MOD Single : A 299 SER OG : rot 170:sc= 0 USER MOD Single : A 300 THR OG1 : rot 76:sc= -0.781 USER MOD Single : A 302 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 305 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00169) USER MOD Single : A 306 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 309 HIS : no HE2:sc= -21! C(o=-21!,f=-27!) USER MOD Single : A 310 THR OG1 : rot 180:sc= 0 USER MOD Single : A 311 ASN :FLIP amide:sc= 0 F(o=-0.7,f=0) USER MOD Single : A 312 CYS SG : rot -8:sc= 0.226 USER MOD ----------------------------------------------------------------- ATOM 75 N ARG A 247 -3.999 -15.767 3.315 1.00 0.00 N ATOM 76 CA ARG A 247 -3.736 -14.740 2.308 1.00 0.00 C ATOM 77 C ARG A 247 -4.741 -13.607 2.419 1.00 0.00 C ATOM 78 O ARG A 247 -5.917 -13.843 2.699 1.00 0.00 O ATOM 79 CB ARG A 247 -3.790 -15.339 0.900 1.00 0.00 C ATOM 80 CG ARG A 247 -4.952 -16.296 0.683 1.00 0.00 C ATOM 81 CD ARG A 247 -5.089 -16.686 -0.780 1.00 0.00 C ATOM 82 NE ARG A 247 -4.556 -18.020 -1.041 1.00 0.00 N ATOM 83 CZ ARG A 247 -5.175 -19.147 -0.693 1.00 0.00 C ATOM 84 NH1 ARG A 247 -6.348 -19.105 -0.074 1.00 0.00 N ATOM 85 NH2 ARG A 247 -4.618 -20.320 -0.966 1.00 0.00 N ATOM 0 HA ARG A 247 -2.737 -14.344 2.488 1.00 0.00 H new ATOM 0 HB2 ARG A 247 -3.858 -14.529 0.173 1.00 0.00 H new ATOM 0 HB3 ARG A 247 -2.856 -15.866 0.704 1.00 0.00 H new ATOM 0 HG2 ARG A 247 -4.804 -17.191 1.287 1.00 0.00 H new ATOM 0 HG3 ARG A 247 -5.877 -15.830 1.024 1.00 0.00 H new ATOM 0 HD2 ARG A 247 -6.140 -16.652 -1.068 1.00 0.00 H new ATOM 0 HD3 ARG A 247 -4.565 -15.958 -1.400 1.00 0.00 H new ATOM 0 HE ARG A 247 -3.657 -18.093 -1.518 1.00 0.00 H new ATOM 0 HH11 ARG A 247 -6.781 -18.206 0.138 1.00 0.00 H new ATOM 0 HH12 ARG A 247 -6.817 -19.972 0.190 1.00 0.00 H new ATOM 0 HH21 ARG A 247 -3.717 -20.358 -1.442 1.00 0.00 H new ATOM 0 HH22 ARG A 247 -5.091 -21.184 -0.700 1.00 0.00 H new ATOM 99 N TRP A 248 -4.292 -12.372 2.192 1.00 0.00 N ATOM 100 CA TRP A 248 -5.205 -11.247 2.272 1.00 0.00 C ATOM 101 C TRP A 248 -4.693 -9.970 1.602 1.00 0.00 C ATOM 102 O TRP A 248 -3.792 -9.294 2.093 1.00 0.00 O ATOM 103 CB TRP A 248 -5.657 -11.033 3.716 1.00 0.00 C ATOM 104 CG TRP A 248 -4.691 -10.486 4.694 1.00 0.00 C ATOM 105 CD1 TRP A 248 -3.433 -10.909 5.010 1.00 0.00 C ATOM 106 CD2 TRP A 248 -5.002 -9.417 5.568 1.00 0.00 C ATOM 107 NE1 TRP A 248 -2.934 -10.118 6.031 1.00 0.00 N ATOM 108 CE2 TRP A 248 -3.890 -9.188 6.380 1.00 0.00 C ATOM 109 CE3 TRP A 248 -6.133 -8.620 5.714 1.00 0.00 C ATOM 110 CZ2 TRP A 248 -3.881 -8.177 7.342 1.00 0.00 C ATOM 111 CZ3 TRP A 248 -6.131 -7.629 6.658 1.00 0.00 C ATOM 112 CH2 TRP A 248 -5.009 -7.407 7.466 1.00 0.00 C ATOM 0 H TRP A 248 -3.328 -12.135 1.958 1.00 0.00 H new ATOM 0 HA TRP A 248 -6.081 -11.508 1.679 1.00 0.00 H new ATOM 0 HB2 TRP A 248 -6.519 -10.366 3.696 1.00 0.00 H new ATOM 0 HB3 TRP A 248 -6.005 -11.993 4.098 1.00 0.00 H new ATOM 0 HD1 TRP A 248 -2.911 -11.729 4.540 1.00 0.00 H new ATOM 0 HE1 TRP A 248 -2.011 -10.208 6.455 1.00 0.00 H new ATOM 0 HE3 TRP A 248 -7.000 -8.781 5.091 1.00 0.00 H new ATOM 0 HZ2 TRP A 248 -3.016 -8.007 7.967 1.00 0.00 H new ATOM 0 HZ3 TRP A 248 -7.007 -7.010 6.781 1.00 0.00 H new ATOM 0 HH2 TRP A 248 -5.032 -6.615 8.200 1.00 0.00 H new ATOM 123 N MET A 249 -5.324 -9.670 0.455 1.00 0.00 N ATOM 124 CA MET A 249 -5.020 -8.495 -0.371 1.00 0.00 C ATOM 125 C MET A 249 -4.935 -7.223 0.450 1.00 0.00 C ATOM 126 O MET A 249 -5.032 -7.240 1.673 1.00 0.00 O ATOM 127 CB MET A 249 -6.092 -8.329 -1.454 1.00 0.00 C ATOM 128 CG MET A 249 -6.478 -9.628 -2.143 1.00 0.00 C ATOM 129 SD MET A 249 -7.259 -9.362 -3.745 1.00 0.00 S ATOM 130 CE MET A 249 -8.693 -8.401 -3.266 1.00 0.00 C ATOM 0 H MET A 249 -6.072 -10.248 0.071 1.00 0.00 H new ATOM 0 HA MET A 249 -4.044 -8.663 -0.827 1.00 0.00 H new ATOM 0 HB2 MET A 249 -6.982 -7.889 -1.005 1.00 0.00 H new ATOM 0 HB3 MET A 249 -5.731 -7.625 -2.204 1.00 0.00 H new ATOM 0 HG2 MET A 249 -5.588 -10.242 -2.275 1.00 0.00 H new ATOM 0 HG3 MET A 249 -7.158 -10.187 -1.500 1.00 0.00 H new ATOM 0 HE1 MET A 249 -9.447 -8.456 -4.051 1.00 0.00 H new ATOM 0 HE2 MET A 249 -9.105 -8.800 -2.339 1.00 0.00 H new ATOM 0 HE3 MET A 249 -8.401 -7.362 -3.116 1.00 0.00 H new ATOM 140 N VAL A 250 -4.714 -6.123 -0.246 1.00 0.00 N ATOM 141 CA VAL A 250 -4.575 -4.820 0.400 1.00 0.00 C ATOM 142 C VAL A 250 -4.968 -3.663 -0.500 1.00 0.00 C ATOM 143 O VAL A 250 -4.942 -3.763 -1.726 1.00 0.00 O ATOM 144 CB VAL A 250 -3.119 -4.598 0.829 1.00 0.00 C ATOM 145 CG1 VAL A 250 -2.172 -5.166 -0.212 1.00 0.00 C ATOM 146 CG2 VAL A 250 -2.820 -3.124 1.072 1.00 0.00 C ATOM 0 H VAL A 250 -4.626 -6.101 -1.262 1.00 0.00 H new ATOM 0 HA VAL A 250 -5.249 -4.837 1.256 1.00 0.00 H new ATOM 0 HB VAL A 250 -2.968 -5.123 1.772 1.00 0.00 H new ATOM 0 HG11 VAL A 250 -1.142 -5.002 0.105 1.00 0.00 H new ATOM 0 HG12 VAL A 250 -2.352 -6.235 -0.322 1.00 0.00 H new ATOM 0 HG13 VAL A 250 -2.341 -4.669 -1.167 1.00 0.00 H new ATOM 0 HG21 VAL A 250 -1.779 -3.009 1.374 1.00 0.00 H new ATOM 0 HG22 VAL A 250 -2.996 -2.561 0.155 1.00 0.00 H new ATOM 0 HG23 VAL A 250 -3.471 -2.746 1.861 1.00 0.00 H new ATOM 156 N GLN A 251 -5.271 -2.539 0.142 1.00 0.00 N ATOM 157 CA GLN A 251 -5.602 -1.324 -0.560 1.00 0.00 C ATOM 158 C GLN A 251 -5.205 -0.154 0.313 1.00 0.00 C ATOM 159 O GLN A 251 -6.014 0.703 0.665 1.00 0.00 O ATOM 160 CB GLN A 251 -7.083 -1.281 -0.910 1.00 0.00 C ATOM 161 CG GLN A 251 -7.487 -0.055 -1.715 1.00 0.00 C ATOM 162 CD GLN A 251 -8.953 0.292 -1.551 1.00 0.00 C ATOM 163 OE1 GLN A 251 -9.785 -0.579 -1.299 1.00 0.00 O ATOM 164 NE2 GLN A 251 -9.278 1.572 -1.696 1.00 0.00 N ATOM 0 H GLN A 251 -5.291 -2.454 1.158 1.00 0.00 H new ATOM 0 HA GLN A 251 -5.058 -1.278 -1.503 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -7.339 -2.177 -1.476 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -7.666 -1.308 0.011 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -6.879 0.795 -1.405 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -7.275 -0.231 -2.770 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -8.556 2.261 -1.905 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -10.250 1.866 -1.599 1.00 0.00 H new ATOM 173 N CYS A 252 -3.931 -0.161 0.654 1.00 0.00 N ATOM 174 CA CYS A 252 -3.339 0.860 1.495 1.00 0.00 C ATOM 175 C CYS A 252 -2.829 1.997 0.641 1.00 0.00 C ATOM 176 O CYS A 252 -1.645 2.329 0.664 1.00 0.00 O ATOM 177 CB CYS A 252 -2.196 0.264 2.318 1.00 0.00 C ATOM 178 SG CYS A 252 -2.731 -0.891 3.602 1.00 0.00 S ATOM 0 H CYS A 252 -3.274 -0.880 0.353 1.00 0.00 H new ATOM 0 HA CYS A 252 -4.098 1.243 2.177 1.00 0.00 H new ATOM 0 HB2 CYS A 252 -1.509 -0.250 1.646 1.00 0.00 H new ATOM 0 HB3 CYS A 252 -1.638 1.076 2.785 1.00 0.00 H new ATOM 0 HG CYS A 252 -1.863 -1.853 3.709 1.00 0.00 H new ATOM 184 N GLY A 253 -3.728 2.579 -0.132 1.00 0.00 N ATOM 185 CA GLY A 253 -3.338 3.655 -1.000 1.00 0.00 C ATOM 186 C GLY A 253 -4.361 4.752 -1.098 1.00 0.00 C ATOM 187 O GLY A 253 -5.286 4.836 -0.289 1.00 0.00 O ATOM 0 H GLY A 253 -4.715 2.325 -0.171 1.00 0.00 H new ATOM 0 HA2 GLY A 253 -2.399 4.077 -0.642 1.00 0.00 H new ATOM 0 HA3 GLY A 253 -3.149 3.256 -1.997 1.00 0.00 H new ATOM 191 N SER A 254 -4.183 5.590 -2.110 1.00 0.00 N ATOM 192 CA SER A 254 -5.075 6.705 -2.375 1.00 0.00 C ATOM 193 C SER A 254 -4.661 7.920 -1.561 1.00 0.00 C ATOM 194 O SER A 254 -5.376 8.373 -0.668 1.00 0.00 O ATOM 195 CB SER A 254 -6.539 6.300 -2.114 1.00 0.00 C ATOM 196 OG SER A 254 -7.041 6.868 -0.916 1.00 0.00 O ATOM 0 H SER A 254 -3.411 5.513 -2.772 1.00 0.00 H new ATOM 0 HA SER A 254 -5.000 6.979 -3.427 1.00 0.00 H new ATOM 0 HB2 SER A 254 -7.158 6.617 -2.953 1.00 0.00 H new ATOM 0 HB3 SER A 254 -6.610 5.214 -2.058 1.00 0.00 H new ATOM 0 HG SER A 254 -7.043 7.845 -0.993 1.00 0.00 H new ATOM 202 N PHE A 255 -3.483 8.442 -1.881 1.00 0.00 N ATOM 203 CA PHE A 255 -2.959 9.606 -1.180 1.00 0.00 C ATOM 204 C PHE A 255 -2.914 10.835 -2.074 1.00 0.00 C ATOM 205 O PHE A 255 -2.353 10.800 -3.169 1.00 0.00 O ATOM 206 CB PHE A 255 -1.545 9.354 -0.622 1.00 0.00 C ATOM 207 CG PHE A 255 -1.105 7.915 -0.622 1.00 0.00 C ATOM 208 CD1 PHE A 255 -1.681 7.011 0.252 1.00 0.00 C ATOM 209 CD2 PHE A 255 -0.107 7.470 -1.482 1.00 0.00 C ATOM 210 CE1 PHE A 255 -1.278 5.693 0.270 1.00 0.00 C ATOM 211 CE2 PHE A 255 0.293 6.154 -1.469 1.00 0.00 C ATOM 212 CZ PHE A 255 -0.291 5.262 -0.593 1.00 0.00 C ATOM 0 H PHE A 255 -2.876 8.080 -2.617 1.00 0.00 H new ATOM 0 HA PHE A 255 -3.646 9.787 -0.353 1.00 0.00 H new ATOM 0 HB2 PHE A 255 -0.832 9.936 -1.206 1.00 0.00 H new ATOM 0 HB3 PHE A 255 -1.502 9.731 0.400 1.00 0.00 H new ATOM 0 HD1 PHE A 255 -2.456 7.342 0.928 1.00 0.00 H new ATOM 0 HD2 PHE A 255 0.358 8.164 -2.166 1.00 0.00 H new ATOM 0 HE1 PHE A 255 -1.734 4.998 0.959 1.00 0.00 H new ATOM 0 HE2 PHE A 255 1.065 5.818 -2.145 1.00 0.00 H new ATOM 0 HZ PHE A 255 0.024 4.229 -0.583 1.00 0.00 H new ATOM 222 N ARG A 256 -3.466 11.942 -1.575 1.00 0.00 N ATOM 223 CA ARG A 256 -3.443 13.199 -2.313 1.00 0.00 C ATOM 224 C ARG A 256 -2.010 13.520 -2.722 1.00 0.00 C ATOM 225 O ARG A 256 -1.768 14.254 -3.680 1.00 0.00 O ATOM 226 CB ARG A 256 -4.012 14.333 -1.458 1.00 0.00 C ATOM 227 CG ARG A 256 -4.830 15.342 -2.248 1.00 0.00 C ATOM 228 CD ARG A 256 -5.280 16.500 -1.372 1.00 0.00 C ATOM 229 NE ARG A 256 -6.347 17.278 -1.998 1.00 0.00 N ATOM 230 CZ ARG A 256 -6.146 18.159 -2.976 1.00 0.00 C ATOM 231 NH1 ARG A 256 -4.922 18.375 -3.443 1.00 0.00 N ATOM 232 NH2 ARG A 256 -7.171 18.824 -3.488 1.00 0.00 N ATOM 0 H ARG A 256 -3.931 11.991 -0.668 1.00 0.00 H new ATOM 0 HA ARG A 256 -4.061 13.099 -3.205 1.00 0.00 H new ATOM 0 HB2 ARG A 256 -4.637 13.906 -0.673 1.00 0.00 H new ATOM 0 HB3 ARG A 256 -3.190 14.852 -0.964 1.00 0.00 H new ATOM 0 HG2 ARG A 256 -4.237 15.722 -3.080 1.00 0.00 H new ATOM 0 HG3 ARG A 256 -5.702 14.849 -2.678 1.00 0.00 H new ATOM 0 HD2 ARG A 256 -5.627 16.115 -0.413 1.00 0.00 H new ATOM 0 HD3 ARG A 256 -4.430 17.151 -1.166 1.00 0.00 H new ATOM 0 HE ARG A 256 -7.301 17.138 -1.666 1.00 0.00 H new ATOM 0 HH11 ARG A 256 -4.130 17.865 -3.052 1.00 0.00 H new ATOM 0 HH12 ARG A 256 -4.774 19.051 -4.192 1.00 0.00 H new ATOM 0 HH21 ARG A 256 -8.113 18.661 -3.133 1.00 0.00 H new ATOM 0 HH22 ARG A 256 -7.018 19.499 -4.237 1.00 0.00 H new ATOM 246 N GLY A 257 -1.067 12.935 -1.988 1.00 0.00 N ATOM 247 CA GLY A 257 0.335 13.122 -2.266 1.00 0.00 C ATOM 248 C GLY A 257 0.755 12.415 -3.541 1.00 0.00 C ATOM 249 O GLY A 257 1.657 11.587 -3.521 1.00 0.00 O ATOM 0 H GLY A 257 -1.261 12.326 -1.193 1.00 0.00 H new ATOM 0 HA2 GLY A 257 0.549 14.187 -2.353 1.00 0.00 H new ATOM 0 HA3 GLY A 257 0.925 12.746 -1.430 1.00 0.00 H new ATOM 253 N ALA A 258 0.086 12.738 -4.649 1.00 0.00 N ATOM 254 CA ALA A 258 0.376 12.130 -5.948 1.00 0.00 C ATOM 255 C ALA A 258 1.871 11.932 -6.143 1.00 0.00 C ATOM 256 O ALA A 258 2.314 10.896 -6.639 1.00 0.00 O ATOM 257 CB ALA A 258 -0.196 12.983 -7.069 1.00 0.00 C ATOM 0 H ALA A 258 -0.668 13.425 -4.671 1.00 0.00 H new ATOM 0 HA ALA A 258 -0.098 11.149 -5.974 1.00 0.00 H new ATOM 0 HB1 ALA A 258 0.027 12.519 -8.030 1.00 0.00 H new ATOM 0 HB2 ALA A 258 -1.276 13.066 -6.948 1.00 0.00 H new ATOM 0 HB3 ALA A 258 0.250 13.977 -7.034 1.00 0.00 H new ATOM 263 N GLU A 259 2.646 12.925 -5.729 1.00 0.00 N ATOM 264 CA GLU A 259 4.097 12.844 -5.839 1.00 0.00 C ATOM 265 C GLU A 259 4.611 11.774 -4.892 1.00 0.00 C ATOM 266 O GLU A 259 5.403 10.915 -5.275 1.00 0.00 O ATOM 267 CB GLU A 259 4.741 14.194 -5.522 1.00 0.00 C ATOM 268 CG GLU A 259 6.131 14.360 -6.117 1.00 0.00 C ATOM 269 CD GLU A 259 6.115 15.108 -7.436 1.00 0.00 C ATOM 270 OE1 GLU A 259 5.481 14.613 -8.392 1.00 0.00 O ATOM 271 OE2 GLU A 259 6.736 16.188 -7.514 1.00 0.00 O ATOM 0 H GLU A 259 2.298 13.791 -5.317 1.00 0.00 H new ATOM 0 HA GLU A 259 4.363 12.580 -6.862 1.00 0.00 H new ATOM 0 HB2 GLU A 259 4.098 14.991 -5.895 1.00 0.00 H new ATOM 0 HB3 GLU A 259 4.801 14.313 -4.440 1.00 0.00 H new ATOM 0 HG2 GLU A 259 6.764 14.894 -5.408 1.00 0.00 H new ATOM 0 HG3 GLU A 259 6.578 13.377 -6.266 1.00 0.00 H new ATOM 278 N GLN A 260 4.120 11.812 -3.658 1.00 0.00 N ATOM 279 CA GLN A 260 4.493 10.821 -2.663 1.00 0.00 C ATOM 280 C GLN A 260 4.044 9.450 -3.140 1.00 0.00 C ATOM 281 O GLN A 260 4.803 8.487 -3.103 1.00 0.00 O ATOM 282 CB GLN A 260 3.840 11.141 -1.316 1.00 0.00 C ATOM 283 CG GLN A 260 4.750 10.886 -0.124 1.00 0.00 C ATOM 284 CD GLN A 260 4.995 12.135 0.701 1.00 0.00 C ATOM 285 OE1 GLN A 260 4.134 12.566 1.467 1.00 0.00 O ATOM 286 NE2 GLN A 260 6.176 12.724 0.546 1.00 0.00 N ATOM 0 H GLN A 260 3.464 12.519 -3.326 1.00 0.00 H new ATOM 0 HA GLN A 260 5.575 10.833 -2.532 1.00 0.00 H new ATOM 0 HB2 GLN A 260 3.531 12.186 -1.310 1.00 0.00 H new ATOM 0 HB3 GLN A 260 2.936 10.541 -1.208 1.00 0.00 H new ATOM 0 HG2 GLN A 260 4.306 10.118 0.509 1.00 0.00 H new ATOM 0 HG3 GLN A 260 5.704 10.495 -0.477 1.00 0.00 H new ATOM 0 HE21 GLN A 260 6.861 12.332 -0.101 1.00 0.00 H new ATOM 0 HE22 GLN A 260 6.398 13.568 1.074 1.00 0.00 H new ATOM 295 N ALA A 261 2.798 9.389 -3.606 1.00 0.00 N ATOM 296 CA ALA A 261 2.208 8.160 -4.118 1.00 0.00 C ATOM 297 C ALA A 261 3.157 7.464 -5.089 1.00 0.00 C ATOM 298 O ALA A 261 3.374 6.256 -4.998 1.00 0.00 O ATOM 299 CB ALA A 261 0.883 8.472 -4.783 1.00 0.00 C ATOM 0 H ALA A 261 2.171 10.193 -3.638 1.00 0.00 H new ATOM 0 HA ALA A 261 2.033 7.478 -3.286 1.00 0.00 H new ATOM 0 HB1 ALA A 261 0.442 7.551 -5.166 1.00 0.00 H new ATOM 0 HB2 ALA A 261 0.208 8.922 -4.055 1.00 0.00 H new ATOM 0 HB3 ALA A 261 1.044 9.167 -5.607 1.00 0.00 H new ATOM 305 N GLU A 262 3.743 8.235 -6.003 1.00 0.00 N ATOM 306 CA GLU A 262 4.692 7.676 -6.960 1.00 0.00 C ATOM 307 C GLU A 262 5.873 7.093 -6.204 1.00 0.00 C ATOM 308 O GLU A 262 6.402 6.041 -6.561 1.00 0.00 O ATOM 309 CB GLU A 262 5.159 8.750 -7.948 1.00 0.00 C ATOM 310 CG GLU A 262 4.608 8.565 -9.354 1.00 0.00 C ATOM 311 CD GLU A 262 5.684 8.652 -10.419 1.00 0.00 C ATOM 312 OE1 GLU A 262 6.515 9.581 -10.349 1.00 0.00 O ATOM 313 OE2 GLU A 262 5.695 7.789 -11.322 1.00 0.00 O ATOM 0 H GLU A 262 3.579 9.237 -6.100 1.00 0.00 H new ATOM 0 HA GLU A 262 4.205 6.887 -7.533 1.00 0.00 H new ATOM 0 HB2 GLU A 262 4.859 9.730 -7.575 1.00 0.00 H new ATOM 0 HB3 GLU A 262 6.248 8.744 -7.990 1.00 0.00 H new ATOM 0 HG2 GLU A 262 4.113 7.596 -9.421 1.00 0.00 H new ATOM 0 HG3 GLU A 262 3.850 9.324 -9.546 1.00 0.00 H new ATOM 320 N THR A 263 6.252 7.772 -5.127 1.00 0.00 N ATOM 321 CA THR A 263 7.338 7.310 -4.282 1.00 0.00 C ATOM 322 C THR A 263 6.841 6.155 -3.423 1.00 0.00 C ATOM 323 O THR A 263 7.601 5.257 -3.070 1.00 0.00 O ATOM 324 CB THR A 263 7.852 8.446 -3.394 1.00 0.00 C ATOM 325 OG1 THR A 263 7.857 9.672 -4.102 1.00 0.00 O ATOM 326 CG2 THR A 263 9.254 8.210 -2.875 1.00 0.00 C ATOM 0 H THR A 263 5.821 8.644 -4.821 1.00 0.00 H new ATOM 0 HA THR A 263 8.163 6.973 -4.910 1.00 0.00 H new ATOM 0 HB THR A 263 7.168 8.483 -2.546 1.00 0.00 H new ATOM 0 HG1 THR A 263 8.187 10.386 -3.517 1.00 0.00 H new ATOM 0 HG21 THR A 263 9.558 9.052 -2.253 1.00 0.00 H new ATOM 0 HG22 THR A 263 9.274 7.295 -2.283 1.00 0.00 H new ATOM 0 HG23 THR A 263 9.941 8.113 -3.715 1.00 0.00 H new ATOM 334 N VAL A 264 5.543 6.181 -3.112 1.00 0.00 N ATOM 335 CA VAL A 264 4.919 5.136 -2.318 1.00 0.00 C ATOM 336 C VAL A 264 5.016 3.803 -3.053 1.00 0.00 C ATOM 337 O VAL A 264 5.137 2.745 -2.437 1.00 0.00 O ATOM 338 CB VAL A 264 3.436 5.472 -2.006 1.00 0.00 C ATOM 339 CG1 VAL A 264 2.751 4.319 -1.282 1.00 0.00 C ATOM 340 CG2 VAL A 264 3.352 6.745 -1.182 1.00 0.00 C ATOM 0 H VAL A 264 4.906 6.922 -3.403 1.00 0.00 H new ATOM 0 HA VAL A 264 5.450 5.065 -1.369 1.00 0.00 H new ATOM 0 HB VAL A 264 2.915 5.628 -2.951 1.00 0.00 H new ATOM 0 HG11 VAL A 264 1.714 4.583 -1.077 1.00 0.00 H new ATOM 0 HG12 VAL A 264 2.781 3.427 -1.908 1.00 0.00 H new ATOM 0 HG13 VAL A 264 3.268 4.121 -0.343 1.00 0.00 H new ATOM 0 HG21 VAL A 264 2.307 6.972 -0.969 1.00 0.00 H new ATOM 0 HG22 VAL A 264 3.892 6.608 -0.245 1.00 0.00 H new ATOM 0 HG23 VAL A 264 3.796 7.570 -1.740 1.00 0.00 H new ATOM 350 N ARG A 265 4.984 3.872 -4.379 1.00 0.00 N ATOM 351 CA ARG A 265 5.091 2.681 -5.209 1.00 0.00 C ATOM 352 C ARG A 265 6.449 2.022 -4.993 1.00 0.00 C ATOM 353 O ARG A 265 6.554 0.797 -4.929 1.00 0.00 O ATOM 354 CB ARG A 265 4.891 3.061 -6.689 1.00 0.00 C ATOM 355 CG ARG A 265 5.452 2.053 -7.687 1.00 0.00 C ATOM 356 CD ARG A 265 4.557 0.829 -7.819 1.00 0.00 C ATOM 357 NE ARG A 265 4.016 0.693 -9.170 1.00 0.00 N ATOM 358 CZ ARG A 265 3.573 -0.454 -9.682 1.00 0.00 C ATOM 359 NH1 ARG A 265 3.603 -1.567 -8.961 1.00 0.00 N ATOM 360 NH2 ARG A 265 3.097 -0.486 -10.920 1.00 0.00 N ATOM 0 H ARG A 265 4.885 4.742 -4.902 1.00 0.00 H new ATOM 0 HA ARG A 265 4.316 1.968 -4.929 1.00 0.00 H new ATOM 0 HB2 ARG A 265 3.824 3.184 -6.878 1.00 0.00 H new ATOM 0 HB3 ARG A 265 5.360 4.029 -6.868 1.00 0.00 H new ATOM 0 HG2 ARG A 265 5.562 2.529 -8.661 1.00 0.00 H new ATOM 0 HG3 ARG A 265 6.447 1.743 -7.369 1.00 0.00 H new ATOM 0 HD2 ARG A 265 5.125 -0.065 -7.564 1.00 0.00 H new ATOM 0 HD3 ARG A 265 3.737 0.900 -7.105 1.00 0.00 H new ATOM 0 HE ARG A 265 3.975 1.527 -9.756 1.00 0.00 H new ATOM 0 HH11 ARG A 265 3.967 -1.548 -8.008 1.00 0.00 H new ATOM 0 HH12 ARG A 265 3.262 -2.442 -9.359 1.00 0.00 H new ATOM 0 HH21 ARG A 265 3.071 0.367 -11.478 1.00 0.00 H new ATOM 0 HH22 ARG A 265 2.757 -1.364 -11.313 1.00 0.00 H new ATOM 374 N ALA A 266 7.481 2.845 -4.868 1.00 0.00 N ATOM 375 CA ALA A 266 8.829 2.347 -4.644 1.00 0.00 C ATOM 376 C ALA A 266 9.075 2.130 -3.158 1.00 0.00 C ATOM 377 O ALA A 266 9.770 1.198 -2.765 1.00 0.00 O ATOM 378 CB ALA A 266 9.855 3.310 -5.220 1.00 0.00 C ATOM 0 H ALA A 266 7.409 3.861 -4.918 1.00 0.00 H new ATOM 0 HA ALA A 266 8.933 1.389 -5.154 1.00 0.00 H new ATOM 0 HB1 ALA A 266 10.858 2.922 -5.043 1.00 0.00 H new ATOM 0 HB2 ALA A 266 9.691 3.418 -6.292 1.00 0.00 H new ATOM 0 HB3 ALA A 266 9.752 4.282 -4.738 1.00 0.00 H new ATOM 384 N GLN A 267 8.490 2.996 -2.335 1.00 0.00 N ATOM 385 CA GLN A 267 8.639 2.893 -0.888 1.00 0.00 C ATOM 386 C GLN A 267 7.965 1.627 -0.374 1.00 0.00 C ATOM 387 O GLN A 267 8.457 0.980 0.547 1.00 0.00 O ATOM 388 CB GLN A 267 8.044 4.123 -0.197 1.00 0.00 C ATOM 389 CG GLN A 267 8.944 4.709 0.880 1.00 0.00 C ATOM 390 CD GLN A 267 9.334 6.146 0.596 1.00 0.00 C ATOM 391 OE1 GLN A 267 9.687 6.495 -0.531 1.00 0.00 O ATOM 392 NE2 GLN A 267 9.274 6.990 1.620 1.00 0.00 N ATOM 0 H GLN A 267 7.910 3.775 -2.645 1.00 0.00 H new ATOM 0 HA GLN A 267 9.703 2.844 -0.656 1.00 0.00 H new ATOM 0 HB2 GLN A 267 7.842 4.888 -0.946 1.00 0.00 H new ATOM 0 HB3 GLN A 267 7.087 3.852 0.248 1.00 0.00 H new ATOM 0 HG2 GLN A 267 8.434 4.658 1.842 1.00 0.00 H new ATOM 0 HG3 GLN A 267 9.845 4.102 0.965 1.00 0.00 H new ATOM 0 HE21 GLN A 267 8.976 6.658 2.537 1.00 0.00 H new ATOM 0 HE22 GLN A 267 9.526 7.970 1.489 1.00 0.00 H new ATOM 401 N LEU A 268 6.839 1.273 -0.984 1.00 0.00 N ATOM 402 CA LEU A 268 6.106 0.076 -0.594 1.00 0.00 C ATOM 403 C LEU A 268 6.953 -1.162 -0.849 1.00 0.00 C ATOM 404 O LEU A 268 7.061 -2.039 0.007 1.00 0.00 O ATOM 405 CB LEU A 268 4.772 -0.004 -1.364 1.00 0.00 C ATOM 406 CG LEU A 268 3.582 0.754 -0.742 1.00 0.00 C ATOM 407 CD1 LEU A 268 2.616 -0.208 -0.054 1.00 0.00 C ATOM 408 CD2 LEU A 268 4.055 1.824 0.234 1.00 0.00 C ATOM 0 H LEU A 268 6.415 1.798 -1.749 1.00 0.00 H new ATOM 0 HA LEU A 268 5.884 0.126 0.472 1.00 0.00 H new ATOM 0 HB2 LEU A 268 4.934 0.380 -2.371 1.00 0.00 H new ATOM 0 HB3 LEU A 268 4.496 -1.054 -1.463 1.00 0.00 H new ATOM 0 HG LEU A 268 3.051 1.249 -1.555 1.00 0.00 H new ATOM 0 HD11 LEU A 268 1.787 0.354 0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 268 2.232 -0.921 -0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 268 3.139 -0.745 0.738 1.00 0.00 H new ATOM 0 HD21 LEU A 268 3.192 2.340 0.655 1.00 0.00 H new ATOM 0 HD22 LEU A 268 4.626 1.357 1.037 1.00 0.00 H new ATOM 0 HD23 LEU A 268 4.686 2.541 -0.290 1.00 0.00 H new ATOM 420 N ALA A 269 7.568 -1.215 -2.020 1.00 0.00 N ATOM 421 CA ALA A 269 8.422 -2.337 -2.381 1.00 0.00 C ATOM 422 C ALA A 269 9.807 -2.188 -1.765 1.00 0.00 C ATOM 423 O ALA A 269 10.494 -3.178 -1.513 1.00 0.00 O ATOM 424 CB ALA A 269 8.522 -2.455 -3.895 1.00 0.00 C ATOM 0 H ALA A 269 7.492 -0.494 -2.737 1.00 0.00 H new ATOM 0 HA ALA A 269 7.974 -3.249 -1.986 1.00 0.00 H new ATOM 0 HB1 ALA A 269 9.163 -3.298 -4.153 1.00 0.00 H new ATOM 0 HB2 ALA A 269 7.528 -2.614 -4.314 1.00 0.00 H new ATOM 0 HB3 ALA A 269 8.946 -1.538 -4.304 1.00 0.00 H new ATOM 430 N PHE A 270 10.210 -0.947 -1.522 1.00 0.00 N ATOM 431 CA PHE A 270 11.511 -0.672 -0.932 1.00 0.00 C ATOM 432 C PHE A 270 11.461 -0.825 0.582 1.00 0.00 C ATOM 433 O PHE A 270 12.472 -1.131 1.214 1.00 0.00 O ATOM 434 CB PHE A 270 11.980 0.737 -1.299 1.00 0.00 C ATOM 435 CG PHE A 270 13.390 1.030 -0.873 1.00 0.00 C ATOM 436 CD1 PHE A 270 13.704 1.192 0.467 1.00 0.00 C ATOM 437 CD2 PHE A 270 14.401 1.146 -1.813 1.00 0.00 C ATOM 438 CE1 PHE A 270 15.000 1.463 0.862 1.00 0.00 C ATOM 439 CE2 PHE A 270 15.700 1.417 -1.425 1.00 0.00 C ATOM 440 CZ PHE A 270 15.999 1.576 -0.086 1.00 0.00 C ATOM 0 H PHE A 270 9.654 -0.116 -1.725 1.00 0.00 H new ATOM 0 HA PHE A 270 12.222 -1.395 -1.332 1.00 0.00 H new ATOM 0 HB2 PHE A 270 11.900 0.868 -2.378 1.00 0.00 H new ATOM 0 HB3 PHE A 270 11.311 1.465 -0.839 1.00 0.00 H new ATOM 0 HD1 PHE A 270 12.926 1.105 1.211 1.00 0.00 H new ATOM 0 HD2 PHE A 270 14.172 1.023 -2.861 1.00 0.00 H new ATOM 0 HE1 PHE A 270 15.232 1.586 1.910 1.00 0.00 H new ATOM 0 HE2 PHE A 270 16.479 1.504 -2.167 1.00 0.00 H new ATOM 0 HZ PHE A 270 17.013 1.788 0.220 1.00 0.00 H new ATOM 450 N GLU A 271 10.282 -0.618 1.166 1.00 0.00 N ATOM 451 CA GLU A 271 10.130 -0.745 2.607 1.00 0.00 C ATOM 452 C GLU A 271 10.017 -2.210 3.015 1.00 0.00 C ATOM 453 O GLU A 271 10.216 -2.555 4.180 1.00 0.00 O ATOM 454 CB GLU A 271 8.907 0.032 3.089 1.00 0.00 C ATOM 455 CG GLU A 271 9.120 1.535 3.121 1.00 0.00 C ATOM 456 CD GLU A 271 9.735 2.010 4.423 1.00 0.00 C ATOM 457 OE1 GLU A 271 10.449 1.213 5.068 1.00 0.00 O ATOM 458 OE2 GLU A 271 9.504 3.178 4.798 1.00 0.00 O ATOM 0 H GLU A 271 9.429 -0.365 0.667 1.00 0.00 H new ATOM 0 HA GLU A 271 11.019 -0.324 3.077 1.00 0.00 H new ATOM 0 HB2 GLU A 271 8.063 -0.194 2.438 1.00 0.00 H new ATOM 0 HB3 GLU A 271 8.639 -0.311 4.088 1.00 0.00 H new ATOM 0 HG2 GLU A 271 9.766 1.824 2.292 1.00 0.00 H new ATOM 0 HG3 GLU A 271 8.164 2.037 2.971 1.00 0.00 H new ATOM 465 N GLY A 272 9.705 -3.072 2.050 1.00 0.00 N ATOM 466 CA GLY A 272 9.583 -4.488 2.341 1.00 0.00 C ATOM 467 C GLY A 272 8.225 -5.054 1.980 1.00 0.00 C ATOM 468 O GLY A 272 7.891 -6.169 2.380 1.00 0.00 O ATOM 0 H GLY A 272 9.536 -2.816 1.077 1.00 0.00 H new ATOM 0 HA2 GLY A 272 10.354 -5.033 1.796 1.00 0.00 H new ATOM 0 HA3 GLY A 272 9.768 -4.652 3.403 1.00 0.00 H new ATOM 472 N PHE A 273 7.438 -4.299 1.216 1.00 0.00 N ATOM 473 CA PHE A 273 6.119 -4.763 0.809 1.00 0.00 C ATOM 474 C PHE A 273 5.822 -4.385 -0.641 1.00 0.00 C ATOM 475 O PHE A 273 5.272 -3.320 -0.921 1.00 0.00 O ATOM 476 CB PHE A 273 5.028 -4.224 1.743 1.00 0.00 C ATOM 477 CG PHE A 273 5.294 -2.867 2.357 1.00 0.00 C ATOM 478 CD1 PHE A 273 6.253 -2.691 3.354 1.00 0.00 C ATOM 479 CD2 PHE A 273 4.546 -1.772 1.962 1.00 0.00 C ATOM 480 CE1 PHE A 273 6.454 -1.441 3.929 1.00 0.00 C ATOM 481 CE2 PHE A 273 4.741 -0.533 2.540 1.00 0.00 C ATOM 482 CZ PHE A 273 5.694 -0.369 3.521 1.00 0.00 C ATOM 0 H PHE A 273 7.690 -3.373 0.871 1.00 0.00 H new ATOM 0 HA PHE A 273 6.119 -5.851 0.881 1.00 0.00 H new ATOM 0 HB2 PHE A 273 4.093 -4.172 1.185 1.00 0.00 H new ATOM 0 HB3 PHE A 273 4.879 -4.943 2.549 1.00 0.00 H new ATOM 0 HD1 PHE A 273 6.845 -3.533 3.682 1.00 0.00 H new ATOM 0 HD2 PHE A 273 3.799 -1.888 1.191 1.00 0.00 H new ATOM 0 HE1 PHE A 273 7.205 -1.312 4.694 1.00 0.00 H new ATOM 0 HE2 PHE A 273 4.145 0.310 2.222 1.00 0.00 H new ATOM 0 HZ PHE A 273 5.845 0.602 3.970 1.00 0.00 H new ATOM 492 N ASP A 274 6.201 -5.274 -1.560 1.00 0.00 N ATOM 493 CA ASP A 274 5.997 -5.055 -2.993 1.00 0.00 C ATOM 494 C ASP A 274 4.532 -4.783 -3.330 1.00 0.00 C ATOM 495 O ASP A 274 3.799 -5.684 -3.732 1.00 0.00 O ATOM 496 CB ASP A 274 6.493 -6.267 -3.784 1.00 0.00 C ATOM 497 CG ASP A 274 5.956 -7.574 -3.236 1.00 0.00 C ATOM 498 OD1 ASP A 274 4.937 -7.543 -2.514 1.00 0.00 O ATOM 499 OD2 ASP A 274 6.556 -8.631 -3.528 1.00 0.00 O ATOM 0 H ASP A 274 6.655 -6.159 -1.335 1.00 0.00 H new ATOM 0 HA ASP A 274 6.570 -4.171 -3.272 1.00 0.00 H new ATOM 0 HB2 ASP A 274 6.194 -6.164 -4.827 1.00 0.00 H new ATOM 0 HB3 ASP A 274 7.583 -6.289 -3.765 1.00 0.00 H new ATOM 504 N SER A 275 4.128 -3.527 -3.179 1.00 0.00 N ATOM 505 CA SER A 275 2.762 -3.098 -3.474 1.00 0.00 C ATOM 506 C SER A 275 2.646 -2.633 -4.925 1.00 0.00 C ATOM 507 O SER A 275 3.650 -2.397 -5.597 1.00 0.00 O ATOM 508 CB SER A 275 2.389 -1.939 -2.551 1.00 0.00 C ATOM 509 OG SER A 275 0.984 -1.772 -2.462 1.00 0.00 O ATOM 0 H SER A 275 4.735 -2.777 -2.849 1.00 0.00 H new ATOM 0 HA SER A 275 2.089 -3.941 -3.317 1.00 0.00 H new ATOM 0 HB2 SER A 275 2.798 -2.119 -1.557 1.00 0.00 H new ATOM 0 HB3 SER A 275 2.842 -1.019 -2.920 1.00 0.00 H new ATOM 0 HG SER A 275 0.775 -1.135 -1.747 1.00 0.00 H new ATOM 515 N LYS A 276 1.415 -2.488 -5.389 1.00 0.00 N ATOM 516 CA LYS A 276 1.148 -2.028 -6.753 1.00 0.00 C ATOM 517 C LYS A 276 0.225 -0.809 -6.731 1.00 0.00 C ATOM 518 O LYS A 276 -0.919 -0.896 -6.285 1.00 0.00 O ATOM 519 CB LYS A 276 0.519 -3.150 -7.583 1.00 0.00 C ATOM 520 CG LYS A 276 1.491 -4.265 -7.935 1.00 0.00 C ATOM 521 CD LYS A 276 0.764 -5.502 -8.436 1.00 0.00 C ATOM 522 CE LYS A 276 1.735 -6.627 -8.756 1.00 0.00 C ATOM 523 NZ LYS A 276 1.332 -7.380 -9.976 1.00 0.00 N ATOM 0 H LYS A 276 0.577 -2.682 -4.841 1.00 0.00 H new ATOM 0 HA LYS A 276 2.095 -1.744 -7.212 1.00 0.00 H new ATOM 0 HB2 LYS A 276 -0.321 -3.572 -7.031 1.00 0.00 H new ATOM 0 HB3 LYS A 276 0.115 -2.727 -8.503 1.00 0.00 H new ATOM 0 HG2 LYS A 276 2.185 -3.916 -8.699 1.00 0.00 H new ATOM 0 HG3 LYS A 276 2.085 -4.521 -7.058 1.00 0.00 H new ATOM 0 HD2 LYS A 276 0.052 -5.838 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 276 0.189 -5.251 -9.328 1.00 0.00 H new ATOM 0 HE2 LYS A 276 2.734 -6.215 -8.898 1.00 0.00 H new ATOM 0 HE3 LYS A 276 1.790 -7.311 -7.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 276 2.020 -8.138 -10.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 276 0.389 -7.795 -9.832 1.00 0.00 H new ATOM 0 HZ3 LYS A 276 1.305 -6.733 -10.790 1.00 0.00 H new ATOM 537 N ILE A 277 0.734 0.336 -7.189 1.00 0.00 N ATOM 538 CA ILE A 277 -0.038 1.568 -7.190 1.00 0.00 C ATOM 539 C ILE A 277 -0.941 1.705 -8.412 1.00 0.00 C ATOM 540 O ILE A 277 -0.749 1.040 -9.431 1.00 0.00 O ATOM 541 CB ILE A 277 0.886 2.794 -7.104 1.00 0.00 C ATOM 542 CG1 ILE A 277 1.734 2.938 -8.371 1.00 0.00 C ATOM 543 CG2 ILE A 277 1.777 2.698 -5.876 1.00 0.00 C ATOM 544 CD1 ILE A 277 2.101 4.374 -8.680 1.00 0.00 C ATOM 0 H ILE A 277 1.678 0.430 -7.563 1.00 0.00 H new ATOM 0 HA ILE A 277 -0.677 1.521 -6.309 1.00 0.00 H new ATOM 0 HB ILE A 277 0.261 3.683 -7.016 1.00 0.00 H new ATOM 0 HG12 ILE A 277 2.646 2.352 -8.259 1.00 0.00 H new ATOM 0 HG13 ILE A 277 1.188 2.519 -9.216 1.00 0.00 H new ATOM 0 HG21 ILE A 277 2.426 3.573 -5.828 1.00 0.00 H new ATOM 0 HG22 ILE A 277 1.158 2.656 -4.980 1.00 0.00 H new ATOM 0 HG23 ILE A 277 2.387 1.797 -5.939 1.00 0.00 H new ATOM 0 HD11 ILE A 277 2.702 4.409 -9.589 1.00 0.00 H new ATOM 0 HD12 ILE A 277 1.192 4.959 -8.823 1.00 0.00 H new ATOM 0 HD13 ILE A 277 2.674 4.790 -7.851 1.00 0.00 H new ATOM 556 N THR A 278 -1.927 2.591 -8.288 1.00 0.00 N ATOM 557 CA THR A 278 -2.882 2.861 -9.358 1.00 0.00 C ATOM 558 C THR A 278 -3.707 4.099 -9.014 1.00 0.00 C ATOM 559 O THR A 278 -4.160 4.248 -7.884 1.00 0.00 O ATOM 560 CB THR A 278 -3.804 1.658 -9.570 1.00 0.00 C ATOM 561 OG1 THR A 278 -3.948 0.918 -8.372 1.00 0.00 O ATOM 562 CG2 THR A 278 -3.310 0.709 -10.640 1.00 0.00 C ATOM 0 H THR A 278 -2.085 3.141 -7.444 1.00 0.00 H new ATOM 0 HA THR A 278 -2.332 3.042 -10.282 1.00 0.00 H new ATOM 0 HB THR A 278 -4.758 2.078 -9.890 1.00 0.00 H new ATOM 0 HG1 THR A 278 -4.114 1.532 -7.626 1.00 0.00 H new ATOM 0 HG21 THR A 278 -4.009 -0.122 -10.740 1.00 0.00 H new ATOM 0 HG22 THR A 278 -3.237 1.238 -11.590 1.00 0.00 H new ATOM 0 HG23 THR A 278 -2.328 0.326 -10.361 1.00 0.00 H new ATOM 570 N THR A 279 -3.887 4.992 -9.981 1.00 0.00 N ATOM 571 CA THR A 279 -4.645 6.220 -9.745 1.00 0.00 C ATOM 572 C THR A 279 -6.152 5.961 -9.744 1.00 0.00 C ATOM 573 O THR A 279 -6.665 5.218 -10.581 1.00 0.00 O ATOM 574 CB THR A 279 -4.285 7.277 -10.793 1.00 0.00 C ATOM 575 OG1 THR A 279 -4.611 8.573 -10.322 1.00 0.00 O ATOM 576 CG2 THR A 279 -4.979 7.082 -12.126 1.00 0.00 C ATOM 0 H THR A 279 -3.523 4.892 -10.929 1.00 0.00 H new ATOM 0 HA THR A 279 -4.374 6.593 -8.757 1.00 0.00 H new ATOM 0 HB THR A 279 -3.212 7.166 -10.952 1.00 0.00 H new ATOM 0 HG1 THR A 279 -4.374 9.238 -11.002 1.00 0.00 H new ATOM 0 HG21 THR A 279 -4.673 7.870 -12.814 1.00 0.00 H new ATOM 0 HG22 THR A 279 -4.705 6.112 -12.540 1.00 0.00 H new ATOM 0 HG23 THR A 279 -6.059 7.124 -11.984 1.00 0.00 H new ATOM 584 N ASN A 280 -6.854 6.588 -8.799 1.00 0.00 N ATOM 585 CA ASN A 280 -8.303 6.440 -8.682 1.00 0.00 C ATOM 586 C ASN A 280 -8.815 7.195 -7.462 1.00 0.00 C ATOM 587 O ASN A 280 -8.089 7.375 -6.485 1.00 0.00 O ATOM 588 CB ASN A 280 -8.692 4.962 -8.582 1.00 0.00 C ATOM 589 CG ASN A 280 -9.966 4.648 -9.342 1.00 0.00 C ATOM 590 OD1 ASN A 280 -10.899 4.058 -8.797 1.00 0.00 O ATOM 591 ND2 ASN A 280 -10.013 5.043 -10.609 1.00 0.00 N ATOM 0 H ASN A 280 -6.439 7.206 -8.101 1.00 0.00 H new ATOM 0 HA ASN A 280 -8.761 6.860 -9.578 1.00 0.00 H new ATOM 0 HB2 ASN A 280 -7.879 4.348 -8.970 1.00 0.00 H new ATOM 0 HB3 ASN A 280 -8.822 4.693 -7.534 1.00 0.00 H new ATOM 0 HD21 ASN A 280 -10.845 4.860 -11.170 1.00 0.00 H new ATOM 0 HD22 ASN A 280 -9.217 5.529 -11.021 1.00 0.00 H new ATOM 598 N ASN A 281 -10.066 7.641 -7.524 1.00 0.00 N ATOM 599 CA ASN A 281 -10.670 8.387 -6.419 1.00 0.00 C ATOM 600 C ASN A 281 -10.064 9.786 -6.303 1.00 0.00 C ATOM 601 O ASN A 281 -10.350 10.516 -5.354 1.00 0.00 O ATOM 602 CB ASN A 281 -10.481 7.637 -5.100 1.00 0.00 C ATOM 603 CG ASN A 281 -10.832 6.167 -5.213 1.00 0.00 C ATOM 604 OD1 ASN A 281 -10.005 5.296 -4.941 1.00 0.00 O ATOM 605 ND2 ASN A 281 -12.064 5.882 -5.617 1.00 0.00 N ATOM 0 H ASN A 281 -10.682 7.501 -8.325 1.00 0.00 H new ATOM 0 HA ASN A 281 -11.735 8.484 -6.629 1.00 0.00 H new ATOM 0 HB2 ASN A 281 -9.445 7.736 -4.775 1.00 0.00 H new ATOM 0 HB3 ASN A 281 -11.102 8.098 -4.332 1.00 0.00 H new ATOM 0 HD21 ASN A 281 -12.357 4.910 -5.712 1.00 0.00 H new ATOM 0 HD22 ASN A 281 -12.717 6.635 -5.832 1.00 0.00 H new ATOM 612 N GLY A 282 -9.227 10.154 -7.269 1.00 0.00 N ATOM 613 CA GLY A 282 -8.599 11.460 -7.246 1.00 0.00 C ATOM 614 C GLY A 282 -7.112 11.383 -6.960 1.00 0.00 C ATOM 615 O GLY A 282 -6.342 12.231 -7.412 1.00 0.00 O ATOM 0 H GLY A 282 -8.974 9.570 -8.066 1.00 0.00 H new ATOM 0 HA2 GLY A 282 -8.756 11.952 -8.206 1.00 0.00 H new ATOM 0 HA3 GLY A 282 -9.080 12.078 -6.488 1.00 0.00 H new ATOM 619 N TRP A 283 -6.707 10.370 -6.200 1.00 0.00 N ATOM 620 CA TRP A 283 -5.316 10.191 -5.847 1.00 0.00 C ATOM 621 C TRP A 283 -4.859 8.759 -6.089 1.00 0.00 C ATOM 622 O TRP A 283 -5.668 7.857 -6.303 1.00 0.00 O ATOM 623 CB TRP A 283 -5.098 10.587 -4.392 1.00 0.00 C ATOM 624 CG TRP A 283 -6.166 10.116 -3.452 1.00 0.00 C ATOM 625 CD1 TRP A 283 -6.791 8.909 -3.463 1.00 0.00 C ATOM 626 CD2 TRP A 283 -6.724 10.845 -2.353 1.00 0.00 C ATOM 627 NE1 TRP A 283 -7.712 8.842 -2.444 1.00 0.00 N ATOM 628 CE2 TRP A 283 -7.688 10.019 -1.748 1.00 0.00 C ATOM 629 CE3 TRP A 283 -6.504 12.118 -1.824 1.00 0.00 C ATOM 630 CZ2 TRP A 283 -8.428 10.422 -0.641 1.00 0.00 C ATOM 631 CZ3 TRP A 283 -7.238 12.518 -0.725 1.00 0.00 C ATOM 632 CH2 TRP A 283 -8.189 11.673 -0.141 1.00 0.00 C ATOM 0 H TRP A 283 -7.332 9.660 -5.818 1.00 0.00 H new ATOM 0 HA TRP A 283 -4.715 10.837 -6.487 1.00 0.00 H new ATOM 0 HB2 TRP A 283 -4.139 10.189 -4.060 1.00 0.00 H new ATOM 0 HB3 TRP A 283 -5.031 11.673 -4.331 1.00 0.00 H new ATOM 0 HD1 TRP A 283 -6.593 8.117 -4.170 1.00 0.00 H new ATOM 0 HE1 TRP A 283 -8.315 8.045 -2.241 1.00 0.00 H new ATOM 0 HE3 TRP A 283 -5.773 12.778 -2.266 1.00 0.00 H new ATOM 0 HZ2 TRP A 283 -9.164 9.771 -0.193 1.00 0.00 H new ATOM 0 HZ3 TRP A 283 -7.075 13.501 -0.308 1.00 0.00 H new ATOM 0 HH2 TRP A 283 -8.744 12.015 0.720 1.00 0.00 H new ATOM 643 N ASN A 284 -3.549 8.574 -6.067 1.00 0.00 N ATOM 644 CA ASN A 284 -2.941 7.267 -6.296 1.00 0.00 C ATOM 645 C ASN A 284 -3.404 6.247 -5.258 1.00 0.00 C ATOM 646 O ASN A 284 -2.970 6.286 -4.109 1.00 0.00 O ATOM 647 CB ASN A 284 -1.419 7.403 -6.269 1.00 0.00 C ATOM 648 CG ASN A 284 -0.803 7.294 -7.649 1.00 0.00 C ATOM 649 OD1 ASN A 284 -0.791 6.222 -8.255 1.00 0.00 O ATOM 650 ND2 ASN A 284 -0.286 8.408 -8.155 1.00 0.00 N ATOM 0 H ASN A 284 -2.877 9.321 -5.891 1.00 0.00 H new ATOM 0 HA ASN A 284 -3.257 6.905 -7.274 1.00 0.00 H new ATOM 0 HB2 ASN A 284 -1.151 8.364 -5.830 1.00 0.00 H new ATOM 0 HB3 ASN A 284 -1.000 6.630 -5.625 1.00 0.00 H new ATOM 0 HD21 ASN A 284 0.143 8.397 -9.081 1.00 0.00 H new ATOM 0 HD22 ASN A 284 -0.318 9.275 -7.618 1.00 0.00 H new ATOM 657 N ARG A 285 -4.282 5.334 -5.675 1.00 0.00 N ATOM 658 CA ARG A 285 -4.807 4.301 -4.782 1.00 0.00 C ATOM 659 C ARG A 285 -4.004 3.008 -4.892 1.00 0.00 C ATOM 660 O ARG A 285 -4.386 2.085 -5.611 1.00 0.00 O ATOM 661 CB ARG A 285 -6.285 4.029 -5.082 1.00 0.00 C ATOM 662 CG ARG A 285 -6.556 3.574 -6.507 1.00 0.00 C ATOM 663 CD ARG A 285 -7.709 2.584 -6.563 1.00 0.00 C ATOM 664 NE ARG A 285 -7.241 1.201 -6.619 1.00 0.00 N ATOM 665 CZ ARG A 285 -7.995 0.149 -6.305 1.00 0.00 C ATOM 666 NH1 ARG A 285 -9.252 0.318 -5.914 1.00 0.00 N ATOM 667 NH2 ARG A 285 -7.491 -1.075 -6.384 1.00 0.00 N ATOM 0 H ARG A 285 -4.645 5.289 -6.627 1.00 0.00 H new ATOM 0 HA ARG A 285 -4.715 4.671 -3.761 1.00 0.00 H new ATOM 0 HB2 ARG A 285 -6.650 3.267 -4.393 1.00 0.00 H new ATOM 0 HB3 ARG A 285 -6.857 4.936 -4.887 1.00 0.00 H new ATOM 0 HG2 ARG A 285 -6.786 4.439 -7.129 1.00 0.00 H new ATOM 0 HG3 ARG A 285 -5.659 3.114 -6.921 1.00 0.00 H new ATOM 0 HD2 ARG A 285 -8.344 2.717 -5.687 1.00 0.00 H new ATOM 0 HD3 ARG A 285 -8.325 2.794 -7.437 1.00 0.00 H new ATOM 0 HE ARG A 285 -6.280 1.031 -6.916 1.00 0.00 H new ATOM 0 HH11 ARG A 285 -9.645 1.257 -5.853 1.00 0.00 H new ATOM 0 HH12 ARG A 285 -9.825 -0.491 -5.675 1.00 0.00 H new ATOM 0 HH21 ARG A 285 -6.526 -1.211 -6.685 1.00 0.00 H new ATOM 0 HH22 ARG A 285 -8.068 -1.881 -6.144 1.00 0.00 H new ATOM 681 N VAL A 286 -2.886 2.944 -4.177 1.00 0.00 N ATOM 682 CA VAL A 286 -2.035 1.761 -4.205 1.00 0.00 C ATOM 683 C VAL A 286 -2.727 0.537 -3.634 1.00 0.00 C ATOM 684 O VAL A 286 -3.675 0.633 -2.854 1.00 0.00 O ATOM 685 CB VAL A 286 -0.704 1.972 -3.452 1.00 0.00 C ATOM 686 CG1 VAL A 286 -0.947 2.300 -1.989 1.00 0.00 C ATOM 687 CG2 VAL A 286 0.198 0.752 -3.575 1.00 0.00 C ATOM 0 H VAL A 286 -2.549 3.694 -3.573 1.00 0.00 H new ATOM 0 HA VAL A 286 -1.823 1.592 -5.261 1.00 0.00 H new ATOM 0 HB VAL A 286 -0.200 2.820 -3.915 1.00 0.00 H new ATOM 0 HG11 VAL A 286 0.009 2.443 -1.485 1.00 0.00 H new ATOM 0 HG12 VAL A 286 -1.537 3.213 -1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 286 -1.487 1.479 -1.517 1.00 0.00 H new ATOM 0 HG21 VAL A 286 1.128 0.931 -3.035 1.00 0.00 H new ATOM 0 HG22 VAL A 286 -0.306 -0.117 -3.152 1.00 0.00 H new ATOM 0 HG23 VAL A 286 0.419 0.568 -4.626 1.00 0.00 H new ATOM 697 N VAL A 287 -2.209 -0.609 -4.038 1.00 0.00 N ATOM 698 CA VAL A 287 -2.707 -1.908 -3.604 1.00 0.00 C ATOM 699 C VAL A 287 -1.645 -2.975 -3.878 1.00 0.00 C ATOM 700 O VAL A 287 -0.990 -2.939 -4.917 1.00 0.00 O ATOM 701 CB VAL A 287 -4.001 -2.310 -4.346 1.00 0.00 C ATOM 702 CG1 VAL A 287 -5.058 -1.221 -4.237 1.00 0.00 C ATOM 703 CG2 VAL A 287 -3.715 -2.628 -5.809 1.00 0.00 C ATOM 0 H VAL A 287 -1.422 -0.668 -4.684 1.00 0.00 H new ATOM 0 HA VAL A 287 -2.927 -1.834 -2.539 1.00 0.00 H new ATOM 0 HB VAL A 287 -4.389 -3.210 -3.868 1.00 0.00 H new ATOM 0 HG11 VAL A 287 -5.957 -1.532 -4.769 1.00 0.00 H new ATOM 0 HG12 VAL A 287 -5.298 -1.050 -3.187 1.00 0.00 H new ATOM 0 HG13 VAL A 287 -4.677 -0.299 -4.677 1.00 0.00 H new ATOM 0 HG21 VAL A 287 -4.642 -2.908 -6.309 1.00 0.00 H new ATOM 0 HG22 VAL A 287 -3.291 -1.750 -6.296 1.00 0.00 H new ATOM 0 HG23 VAL A 287 -3.006 -3.454 -5.870 1.00 0.00 H new ATOM 713 N ILE A 288 -1.492 -3.933 -2.975 1.00 0.00 N ATOM 714 CA ILE A 288 -0.513 -5.005 -3.185 1.00 0.00 C ATOM 715 C ILE A 288 -1.224 -6.274 -3.633 1.00 0.00 C ATOM 716 O ILE A 288 -2.281 -6.618 -3.102 1.00 0.00 O ATOM 717 CB ILE A 288 0.330 -5.354 -1.928 1.00 0.00 C ATOM 718 CG1 ILE A 288 0.696 -4.119 -1.098 1.00 0.00 C ATOM 719 CG2 ILE A 288 1.587 -6.108 -2.330 1.00 0.00 C ATOM 720 CD1 ILE A 288 0.829 -4.407 0.386 1.00 0.00 C ATOM 0 H ILE A 288 -2.019 -3.996 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 288 0.171 -4.627 -3.945 1.00 0.00 H new ATOM 0 HB ILE A 288 -0.291 -5.989 -1.296 1.00 0.00 H new ATOM 0 HG12 ILE A 288 1.636 -3.709 -1.466 1.00 0.00 H new ATOM 0 HG13 ILE A 288 -0.066 -3.353 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 288 2.169 -6.346 -1.440 1.00 0.00 H new ATOM 0 HG22 ILE A 288 1.310 -7.030 -2.840 1.00 0.00 H new ATOM 0 HG23 ILE A 288 2.185 -5.489 -2.999 1.00 0.00 H new ATOM 0 HD11 ILE A 288 1.089 -3.489 0.913 1.00 0.00 H new ATOM 0 HD12 ILE A 288 -0.117 -4.789 0.769 1.00 0.00 H new ATOM 0 HD13 ILE A 288 1.611 -5.150 0.544 1.00 0.00 H new ATOM 732 N GLY A 289 -0.644 -6.975 -4.602 1.00 0.00 N ATOM 733 CA GLY A 289 -1.250 -8.205 -5.081 1.00 0.00 C ATOM 734 C GLY A 289 -1.635 -9.124 -3.937 1.00 0.00 C ATOM 735 O GLY A 289 -1.063 -9.027 -2.851 1.00 0.00 O ATOM 0 H GLY A 289 0.229 -6.716 -5.062 1.00 0.00 H new ATOM 0 HA2 GLY A 289 -2.135 -7.969 -5.671 1.00 0.00 H new ATOM 0 HA3 GLY A 289 -0.554 -8.720 -5.743 1.00 0.00 H new ATOM 739 N PRO A 290 -2.606 -10.030 -4.139 1.00 0.00 N ATOM 740 CA PRO A 290 -3.044 -10.951 -3.090 1.00 0.00 C ATOM 741 C PRO A 290 -1.866 -11.568 -2.344 1.00 0.00 C ATOM 742 O PRO A 290 -1.178 -12.452 -2.857 1.00 0.00 O ATOM 743 CB PRO A 290 -3.819 -12.016 -3.863 1.00 0.00 C ATOM 744 CG PRO A 290 -4.356 -11.298 -5.056 1.00 0.00 C ATOM 745 CD PRO A 290 -3.352 -10.225 -5.397 1.00 0.00 C ATOM 0 HA PRO A 290 -3.636 -10.456 -2.320 1.00 0.00 H new ATOM 0 HB2 PRO A 290 -3.172 -12.843 -4.156 1.00 0.00 H new ATOM 0 HB3 PRO A 290 -4.622 -12.438 -3.259 1.00 0.00 H new ATOM 0 HG2 PRO A 290 -4.491 -11.983 -5.893 1.00 0.00 H new ATOM 0 HG3 PRO A 290 -5.331 -10.862 -4.840 1.00 0.00 H new ATOM 0 HD2 PRO A 290 -2.694 -10.536 -6.208 1.00 0.00 H new ATOM 0 HD3 PRO A 290 -3.842 -9.306 -5.718 1.00 0.00 H new ATOM 753 N VAL A 291 -1.637 -11.076 -1.137 1.00 0.00 N ATOM 754 CA VAL A 291 -0.542 -11.540 -0.299 1.00 0.00 C ATOM 755 C VAL A 291 -0.904 -12.826 0.436 1.00 0.00 C ATOM 756 O VAL A 291 -1.906 -13.469 0.123 1.00 0.00 O ATOM 757 CB VAL A 291 -0.182 -10.463 0.734 1.00 0.00 C ATOM 758 CG1 VAL A 291 0.260 -9.181 0.035 1.00 0.00 C ATOM 759 CG2 VAL A 291 -1.373 -10.204 1.649 1.00 0.00 C ATOM 0 H VAL A 291 -2.205 -10.344 -0.710 1.00 0.00 H new ATOM 0 HA VAL A 291 0.309 -11.739 -0.951 1.00 0.00 H new ATOM 0 HB VAL A 291 0.650 -10.817 1.342 1.00 0.00 H new ATOM 0 HG11 VAL A 291 0.512 -8.428 0.782 1.00 0.00 H new ATOM 0 HG12 VAL A 291 1.134 -9.386 -0.582 1.00 0.00 H new ATOM 0 HG13 VAL A 291 -0.550 -8.812 -0.594 1.00 0.00 H new ATOM 0 HG21 VAL A 291 -1.111 -9.439 2.380 1.00 0.00 H new ATOM 0 HG22 VAL A 291 -2.221 -9.863 1.055 1.00 0.00 H new ATOM 0 HG23 VAL A 291 -1.640 -11.125 2.168 1.00 0.00 H new ATOM 769 N LYS A 292 -0.089 -13.191 1.424 1.00 0.00 N ATOM 770 CA LYS A 292 -0.340 -14.392 2.206 1.00 0.00 C ATOM 771 C LYS A 292 0.603 -14.496 3.395 1.00 0.00 C ATOM 772 O LYS A 292 1.824 -14.433 3.248 1.00 0.00 O ATOM 773 CB LYS A 292 -0.223 -15.640 1.328 1.00 0.00 C ATOM 774 CG LYS A 292 1.148 -15.815 0.691 1.00 0.00 C ATOM 775 CD LYS A 292 1.661 -17.238 0.847 1.00 0.00 C ATOM 776 CE LYS A 292 2.436 -17.415 2.143 1.00 0.00 C ATOM 777 NZ LYS A 292 2.082 -18.686 2.833 1.00 0.00 N ATOM 0 H LYS A 292 0.746 -12.673 1.698 1.00 0.00 H new ATOM 0 HA LYS A 292 -1.357 -14.324 2.592 1.00 0.00 H new ATOM 0 HB2 LYS A 292 -0.448 -16.520 1.931 1.00 0.00 H new ATOM 0 HB3 LYS A 292 -0.976 -15.591 0.541 1.00 0.00 H new ATOM 0 HG2 LYS A 292 1.093 -15.562 -0.368 1.00 0.00 H new ATOM 0 HG3 LYS A 292 1.853 -15.121 1.148 1.00 0.00 H new ATOM 0 HD2 LYS A 292 0.821 -17.932 0.827 1.00 0.00 H new ATOM 0 HD3 LYS A 292 2.302 -17.489 0.002 1.00 0.00 H new ATOM 0 HE2 LYS A 292 3.505 -17.403 1.931 1.00 0.00 H new ATOM 0 HE3 LYS A 292 2.233 -16.574 2.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 292 2.632 -18.769 3.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 292 1.067 -18.688 3.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 292 2.300 -19.491 2.211 1.00 0.00 H new ATOM 791 N GLY A 293 0.018 -14.657 4.576 1.00 0.00 N ATOM 792 CA GLY A 293 0.803 -14.772 5.788 1.00 0.00 C ATOM 793 C GLY A 293 0.082 -14.218 7.000 1.00 0.00 C ATOM 794 O GLY A 293 0.463 -14.498 8.136 1.00 0.00 O ATOM 0 H GLY A 293 -0.991 -14.710 4.715 1.00 0.00 H new ATOM 0 HA2 GLY A 293 1.046 -15.820 5.962 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.747 -14.243 5.657 1.00 0.00 H new ATOM 798 N LYS A 294 -0.958 -13.421 6.760 1.00 0.00 N ATOM 799 CA LYS A 294 -1.732 -12.812 7.838 1.00 0.00 C ATOM 800 C LYS A 294 -0.945 -11.672 8.466 1.00 0.00 C ATOM 801 O LYS A 294 -1.405 -10.532 8.502 1.00 0.00 O ATOM 802 CB LYS A 294 -2.101 -13.850 8.902 1.00 0.00 C ATOM 803 CG LYS A 294 -3.224 -13.401 9.822 1.00 0.00 C ATOM 804 CD LYS A 294 -4.569 -13.434 9.114 1.00 0.00 C ATOM 805 CE LYS A 294 -5.618 -12.637 9.873 1.00 0.00 C ATOM 806 NZ LYS A 294 -6.996 -13.132 9.603 1.00 0.00 N ATOM 0 H LYS A 294 -1.284 -13.182 5.824 1.00 0.00 H new ATOM 0 HA LYS A 294 -2.656 -12.417 7.415 1.00 0.00 H new ATOM 0 HB2 LYS A 294 -2.395 -14.776 8.408 1.00 0.00 H new ATOM 0 HB3 LYS A 294 -1.219 -14.074 9.501 1.00 0.00 H new ATOM 0 HG2 LYS A 294 -3.257 -14.047 10.700 1.00 0.00 H new ATOM 0 HG3 LYS A 294 -3.023 -12.390 10.177 1.00 0.00 H new ATOM 0 HD2 LYS A 294 -4.461 -13.030 8.107 1.00 0.00 H new ATOM 0 HD3 LYS A 294 -4.901 -14.467 9.009 1.00 0.00 H new ATOM 0 HE2 LYS A 294 -5.415 -12.695 10.942 1.00 0.00 H new ATOM 0 HE3 LYS A 294 -5.549 -11.586 9.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 294 -7.681 -12.562 10.139 1.00 0.00 H new ATOM 0 HZ2 LYS A 294 -7.200 -13.053 8.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 294 -7.071 -14.128 9.894 1.00 0.00 H new ATOM 820 N GLU A 295 0.250 -11.986 8.948 1.00 0.00 N ATOM 821 CA GLU A 295 1.113 -10.986 9.560 1.00 0.00 C ATOM 822 C GLU A 295 1.823 -10.165 8.490 1.00 0.00 C ATOM 823 O GLU A 295 2.237 -9.033 8.736 1.00 0.00 O ATOM 824 CB GLU A 295 2.138 -11.656 10.478 1.00 0.00 C ATOM 825 CG GLU A 295 1.649 -11.843 11.905 1.00 0.00 C ATOM 826 CD GLU A 295 2.431 -11.014 12.905 1.00 0.00 C ATOM 827 OE1 GLU A 295 2.413 -9.770 12.788 1.00 0.00 O ATOM 828 OE2 GLU A 295 3.063 -11.608 13.803 1.00 0.00 O ATOM 0 H GLU A 295 0.644 -12.927 8.927 1.00 0.00 H new ATOM 0 HA GLU A 295 0.493 -10.317 10.157 1.00 0.00 H new ATOM 0 HB2 GLU A 295 2.403 -12.629 10.064 1.00 0.00 H new ATOM 0 HB3 GLU A 295 3.048 -11.056 10.491 1.00 0.00 H new ATOM 0 HG2 GLU A 295 0.594 -11.573 11.962 1.00 0.00 H new ATOM 0 HG3 GLU A 295 1.724 -12.896 12.175 1.00 0.00 H new ATOM 835 N ASN A 296 1.954 -10.739 7.295 1.00 0.00 N ATOM 836 CA ASN A 296 2.605 -10.048 6.190 1.00 0.00 C ATOM 837 C ASN A 296 1.773 -8.848 5.761 1.00 0.00 C ATOM 838 O ASN A 296 2.195 -7.703 5.922 1.00 0.00 O ATOM 839 CB ASN A 296 2.809 -10.998 5.007 1.00 0.00 C ATOM 840 CG ASN A 296 3.704 -12.170 5.356 1.00 0.00 C ATOM 841 OD1 ASN A 296 3.810 -12.563 6.518 1.00 0.00 O ATOM 842 ND2 ASN A 296 4.355 -12.738 4.347 1.00 0.00 N ATOM 0 H ASN A 296 1.619 -11.676 7.071 1.00 0.00 H new ATOM 0 HA ASN A 296 3.582 -9.700 6.526 1.00 0.00 H new ATOM 0 HB2 ASN A 296 1.841 -11.371 4.672 1.00 0.00 H new ATOM 0 HB3 ASN A 296 3.244 -10.447 4.173 1.00 0.00 H new ATOM 0 HD21 ASN A 296 4.972 -13.532 4.520 1.00 0.00 H new ATOM 0 HD22 ASN A 296 4.238 -12.380 3.399 1.00 0.00 H new ATOM 849 N ALA A 297 0.577 -9.111 5.239 1.00 0.00 N ATOM 850 CA ALA A 297 -0.313 -8.037 4.821 1.00 0.00 C ATOM 851 C ALA A 297 -0.568 -7.110 6.007 1.00 0.00 C ATOM 852 O ALA A 297 -0.608 -5.889 5.860 1.00 0.00 O ATOM 853 CB ALA A 297 -1.628 -8.610 4.267 1.00 0.00 C ATOM 0 H ALA A 297 0.207 -10.051 5.097 1.00 0.00 H new ATOM 0 HA ALA A 297 0.155 -7.464 4.020 1.00 0.00 H new ATOM 0 HB1 ALA A 297 -2.280 -7.793 3.960 1.00 0.00 H new ATOM 0 HB2 ALA A 297 -1.414 -9.246 3.408 1.00 0.00 H new ATOM 0 HB3 ALA A 297 -2.123 -9.198 5.040 1.00 0.00 H new ATOM 859 N ASP A 298 -0.710 -7.703 7.193 1.00 0.00 N ATOM 860 CA ASP A 298 -0.937 -6.935 8.413 1.00 0.00 C ATOM 861 C ASP A 298 0.243 -6.019 8.698 1.00 0.00 C ATOM 862 O ASP A 298 0.071 -4.823 8.932 1.00 0.00 O ATOM 863 CB ASP A 298 -1.164 -7.869 9.603 1.00 0.00 C ATOM 864 CG ASP A 298 -1.605 -7.125 10.849 1.00 0.00 C ATOM 865 OD1 ASP A 298 -1.083 -6.016 11.094 1.00 0.00 O ATOM 866 OD2 ASP A 298 -2.472 -7.650 11.579 1.00 0.00 O ATOM 0 H ASP A 298 -0.671 -8.713 7.332 1.00 0.00 H new ATOM 0 HA ASP A 298 -1.829 -6.326 8.266 1.00 0.00 H new ATOM 0 HB2 ASP A 298 -1.919 -8.610 9.340 1.00 0.00 H new ATOM 0 HB3 ASP A 298 -0.243 -8.413 9.815 1.00 0.00 H new ATOM 871 N SER A 299 1.446 -6.585 8.672 1.00 0.00 N ATOM 872 CA SER A 299 2.649 -5.809 8.923 1.00 0.00 C ATOM 873 C SER A 299 2.786 -4.707 7.885 1.00 0.00 C ATOM 874 O SER A 299 3.073 -3.563 8.221 1.00 0.00 O ATOM 875 CB SER A 299 3.885 -6.710 8.901 1.00 0.00 C ATOM 876 OG SER A 299 5.072 -5.947 8.772 1.00 0.00 O ATOM 0 H SER A 299 1.610 -7.573 8.480 1.00 0.00 H new ATOM 0 HA SER A 299 2.569 -5.357 9.912 1.00 0.00 H new ATOM 0 HB2 SER A 299 3.926 -7.299 9.817 1.00 0.00 H new ATOM 0 HB3 SER A 299 3.810 -7.414 8.073 1.00 0.00 H new ATOM 0 HG SER A 299 5.850 -6.524 8.921 1.00 0.00 H new ATOM 882 N THR A 300 2.560 -5.064 6.623 1.00 0.00 N ATOM 883 CA THR A 300 2.643 -4.107 5.527 1.00 0.00 C ATOM 884 C THR A 300 1.713 -2.921 5.774 1.00 0.00 C ATOM 885 O THR A 300 2.070 -1.781 5.488 1.00 0.00 O ATOM 886 CB THR A 300 2.298 -4.796 4.209 1.00 0.00 C ATOM 887 OG1 THR A 300 3.285 -5.756 3.875 1.00 0.00 O ATOM 888 CG2 THR A 300 2.178 -3.842 3.045 1.00 0.00 C ATOM 0 H THR A 300 2.317 -6.012 6.335 1.00 0.00 H new ATOM 0 HA THR A 300 3.663 -3.728 5.469 1.00 0.00 H new ATOM 0 HB THR A 300 1.327 -5.263 4.374 1.00 0.00 H new ATOM 0 HG1 THR A 300 3.165 -6.555 4.429 1.00 0.00 H new ATOM 0 HG21 THR A 300 1.931 -4.400 2.141 1.00 0.00 H new ATOM 0 HG22 THR A 300 1.391 -3.116 3.249 1.00 0.00 H new ATOM 0 HG23 THR A 300 3.125 -3.321 2.903 1.00 0.00 H new ATOM 896 N LEU A 301 0.529 -3.188 6.323 1.00 0.00 N ATOM 897 CA LEU A 301 -0.420 -2.116 6.621 1.00 0.00 C ATOM 898 C LEU A 301 0.248 -1.100 7.534 1.00 0.00 C ATOM 899 O LEU A 301 0.292 0.093 7.233 1.00 0.00 O ATOM 900 CB LEU A 301 -1.681 -2.676 7.286 1.00 0.00 C ATOM 901 CG LEU A 301 -2.652 -1.624 7.831 1.00 0.00 C ATOM 902 CD1 LEU A 301 -3.015 -0.617 6.749 1.00 0.00 C ATOM 903 CD2 LEU A 301 -3.904 -2.290 8.382 1.00 0.00 C ATOM 0 H LEU A 301 0.207 -4.124 6.568 1.00 0.00 H new ATOM 0 HA LEU A 301 -0.717 -1.634 5.690 1.00 0.00 H new ATOM 0 HB2 LEU A 301 -2.210 -3.295 6.562 1.00 0.00 H new ATOM 0 HB3 LEU A 301 -1.381 -3.330 8.105 1.00 0.00 H new ATOM 0 HG LEU A 301 -2.159 -1.090 8.643 1.00 0.00 H new ATOM 0 HD11 LEU A 301 -3.705 0.122 7.156 1.00 0.00 H new ATOM 0 HD12 LEU A 301 -2.112 -0.116 6.400 1.00 0.00 H new ATOM 0 HD13 LEU A 301 -3.488 -1.134 5.914 1.00 0.00 H new ATOM 0 HD21 LEU A 301 -4.583 -1.528 8.765 1.00 0.00 H new ATOM 0 HD22 LEU A 301 -4.398 -2.850 7.588 1.00 0.00 H new ATOM 0 HD23 LEU A 301 -3.630 -2.970 9.189 1.00 0.00 H new ATOM 915 N ASN A 302 0.800 -1.595 8.634 1.00 0.00 N ATOM 916 CA ASN A 302 1.509 -0.748 9.578 1.00 0.00 C ATOM 917 C ASN A 302 2.826 -0.296 8.962 1.00 0.00 C ATOM 918 O ASN A 302 3.372 0.747 9.319 1.00 0.00 O ATOM 919 CB ASN A 302 1.769 -1.509 10.879 1.00 0.00 C ATOM 920 CG ASN A 302 0.553 -1.538 11.785 1.00 0.00 C ATOM 921 OD1 ASN A 302 -0.416 -2.248 11.520 1.00 0.00 O ATOM 922 ND2 ASN A 302 0.600 -0.762 12.861 1.00 0.00 N ATOM 0 H ASN A 302 0.769 -2.581 8.893 1.00 0.00 H new ATOM 0 HA ASN A 302 0.899 0.126 9.805 1.00 0.00 H new ATOM 0 HB2 ASN A 302 2.069 -2.531 10.645 1.00 0.00 H new ATOM 0 HB3 ASN A 302 2.602 -1.045 11.408 1.00 0.00 H new ATOM 0 HD21 ASN A 302 -0.189 -0.738 13.508 1.00 0.00 H new ATOM 0 HD22 ASN A 302 1.425 -0.189 13.041 1.00 0.00 H new ATOM 929 N ARG A 303 3.323 -1.094 8.018 1.00 0.00 N ATOM 930 CA ARG A 303 4.564 -0.789 7.331 1.00 0.00 C ATOM 931 C ARG A 303 4.355 0.355 6.343 1.00 0.00 C ATOM 932 O ARG A 303 5.260 1.149 6.103 1.00 0.00 O ATOM 933 CB ARG A 303 5.104 -2.032 6.626 1.00 0.00 C ATOM 934 CG ARG A 303 6.554 -2.337 6.967 1.00 0.00 C ATOM 935 CD ARG A 303 6.967 -3.715 6.477 1.00 0.00 C ATOM 936 NE ARG A 303 7.840 -4.395 7.431 1.00 0.00 N ATOM 937 CZ ARG A 303 8.015 -5.713 7.470 1.00 0.00 C ATOM 938 NH1 ARG A 303 7.381 -6.501 6.610 1.00 0.00 N ATOM 939 NH2 ARG A 303 8.828 -6.247 8.371 1.00 0.00 N ATOM 0 H ARG A 303 2.878 -1.960 7.715 1.00 0.00 H new ATOM 0 HA ARG A 303 5.303 -0.472 8.066 1.00 0.00 H new ATOM 0 HB2 ARG A 303 4.487 -2.890 6.894 1.00 0.00 H new ATOM 0 HB3 ARG A 303 5.012 -1.898 5.548 1.00 0.00 H new ATOM 0 HG2 ARG A 303 7.200 -1.582 6.519 1.00 0.00 H new ATOM 0 HG3 ARG A 303 6.695 -2.277 8.046 1.00 0.00 H new ATOM 0 HD2 ARG A 303 6.077 -4.320 6.304 1.00 0.00 H new ATOM 0 HD3 ARG A 303 7.479 -3.621 5.520 1.00 0.00 H new ATOM 0 HE ARG A 303 8.346 -3.824 8.108 1.00 0.00 H new ATOM 0 HH11 ARG A 303 6.755 -6.097 5.914 1.00 0.00 H new ATOM 0 HH12 ARG A 303 7.520 -7.511 6.646 1.00 0.00 H new ATOM 0 HH21 ARG A 303 9.319 -5.647 9.034 1.00 0.00 H new ATOM 0 HH22 ARG A 303 8.962 -7.258 8.401 1.00 0.00 H new ATOM 953 N LEU A 304 3.141 0.472 5.805 1.00 0.00 N ATOM 954 CA LEU A 304 2.830 1.569 4.897 1.00 0.00 C ATOM 955 C LEU A 304 3.029 2.879 5.643 1.00 0.00 C ATOM 956 O LEU A 304 3.345 3.910 5.049 1.00 0.00 O ATOM 957 CB LEU A 304 1.408 1.435 4.347 1.00 0.00 C ATOM 958 CG LEU A 304 1.342 0.770 2.970 1.00 0.00 C ATOM 959 CD1 LEU A 304 0.693 -0.601 3.057 1.00 0.00 C ATOM 960 CD2 LEU A 304 0.611 1.653 1.966 1.00 0.00 C ATOM 0 H LEU A 304 2.369 -0.171 5.980 1.00 0.00 H new ATOM 0 HA LEU A 304 3.498 1.545 4.036 1.00 0.00 H new ATOM 0 HB2 LEU A 304 0.809 0.856 5.050 1.00 0.00 H new ATOM 0 HB3 LEU A 304 0.957 2.425 4.285 1.00 0.00 H new ATOM 0 HG LEU A 304 2.365 0.638 2.617 1.00 0.00 H new ATOM 0 HD11 LEU A 304 0.659 -1.051 2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 304 1.275 -1.237 3.724 1.00 0.00 H new ATOM 0 HD13 LEU A 304 -0.321 -0.500 3.444 1.00 0.00 H new ATOM 0 HD21 LEU A 304 0.580 1.154 0.997 1.00 0.00 H new ATOM 0 HD22 LEU A 304 -0.406 1.834 2.314 1.00 0.00 H new ATOM 0 HD23 LEU A 304 1.135 2.604 1.868 1.00 0.00 H new ATOM 972 N LYS A 305 2.913 2.804 6.970 1.00 0.00 N ATOM 973 CA LYS A 305 3.154 3.951 7.823 1.00 0.00 C ATOM 974 C LYS A 305 4.665 4.138 7.932 1.00 0.00 C ATOM 975 O LYS A 305 5.166 5.256 8.061 1.00 0.00 O ATOM 976 CB LYS A 305 2.532 3.736 9.207 1.00 0.00 C ATOM 977 CG LYS A 305 1.287 4.573 9.448 1.00 0.00 C ATOM 978 CD LYS A 305 0.533 4.111 10.684 1.00 0.00 C ATOM 979 CE LYS A 305 0.752 5.053 11.857 1.00 0.00 C ATOM 980 NZ LYS A 305 2.069 4.825 12.514 1.00 0.00 N ATOM 0 H LYS A 305 2.652 1.955 7.471 1.00 0.00 H new ATOM 0 HA LYS A 305 2.694 4.843 7.398 1.00 0.00 H new ATOM 0 HB2 LYS A 305 2.280 2.682 9.324 1.00 0.00 H new ATOM 0 HB3 LYS A 305 3.273 3.973 9.971 1.00 0.00 H new ATOM 0 HG2 LYS A 305 1.568 5.620 9.563 1.00 0.00 H new ATOM 0 HG3 LYS A 305 0.633 4.512 8.578 1.00 0.00 H new ATOM 0 HD2 LYS A 305 -0.532 4.050 10.460 1.00 0.00 H new ATOM 0 HD3 LYS A 305 0.860 3.107 10.956 1.00 0.00 H new ATOM 0 HE2 LYS A 305 0.693 6.085 11.510 1.00 0.00 H new ATOM 0 HE3 LYS A 305 -0.046 4.916 12.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 305 2.173 5.475 13.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 305 2.123 3.843 12.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 305 2.833 4.997 11.830 1.00 0.00 H new ATOM 994 N MET A 306 5.383 3.012 7.835 1.00 0.00 N ATOM 995 CA MET A 306 6.840 3.005 7.873 1.00 0.00 C ATOM 996 C MET A 306 7.392 3.880 6.753 1.00 0.00 C ATOM 997 O MET A 306 8.545 4.313 6.796 1.00 0.00 O ATOM 998 CB MET A 306 7.371 1.566 7.720 1.00 0.00 C ATOM 999 CG MET A 306 8.802 1.394 8.206 1.00 0.00 C ATOM 1000 SD MET A 306 9.478 -0.231 7.816 1.00 0.00 S ATOM 1001 CE MET A 306 11.145 -0.065 8.448 1.00 0.00 C ATOM 0 H MET A 306 4.967 2.087 7.729 1.00 0.00 H new ATOM 0 HA MET A 306 7.168 3.402 8.834 1.00 0.00 H new ATOM 0 HB2 MET A 306 6.723 0.887 8.274 1.00 0.00 H new ATOM 0 HB3 MET A 306 7.314 1.276 6.671 1.00 0.00 H new ATOM 0 HG2 MET A 306 9.430 2.162 7.754 1.00 0.00 H new ATOM 0 HG3 MET A 306 8.836 1.548 9.285 1.00 0.00 H new ATOM 0 HE1 MET A 306 11.692 -0.993 8.280 1.00 0.00 H new ATOM 0 HE2 MET A 306 11.650 0.752 7.933 1.00 0.00 H new ATOM 0 HE3 MET A 306 11.110 0.147 9.517 1.00 0.00 H new ATOM 1011 N ALA A 307 6.556 4.134 5.749 1.00 0.00 N ATOM 1012 CA ALA A 307 6.941 4.948 4.613 1.00 0.00 C ATOM 1013 C ALA A 307 6.365 6.357 4.729 1.00 0.00 C ATOM 1014 O ALA A 307 7.108 7.336 4.793 1.00 0.00 O ATOM 1015 CB ALA A 307 6.477 4.282 3.329 1.00 0.00 C ATOM 0 H ALA A 307 5.600 3.781 5.705 1.00 0.00 H new ATOM 0 HA ALA A 307 8.027 5.036 4.597 1.00 0.00 H new ATOM 0 HB1 ALA A 307 6.767 4.895 2.476 1.00 0.00 H new ATOM 0 HB2 ALA A 307 6.938 3.298 3.242 1.00 0.00 H new ATOM 0 HB3 ALA A 307 5.392 4.174 3.346 1.00 0.00 H new ATOM 1021 N GLY A 308 5.037 6.452 4.760 1.00 0.00 N ATOM 1022 CA GLY A 308 4.388 7.747 4.875 1.00 0.00 C ATOM 1023 C GLY A 308 3.361 7.991 3.784 1.00 0.00 C ATOM 1024 O GLY A 308 3.670 8.596 2.757 1.00 0.00 O ATOM 0 H GLY A 308 4.401 5.657 4.708 1.00 0.00 H new ATOM 0 HA2 GLY A 308 3.902 7.819 5.848 1.00 0.00 H new ATOM 0 HA3 GLY A 308 5.144 8.531 4.838 1.00 0.00 H new ATOM 1028 N HIS A 309 2.137 7.518 4.006 1.00 0.00 N ATOM 1029 CA HIS A 309 1.062 7.689 3.027 1.00 0.00 C ATOM 1030 C HIS A 309 -0.270 7.980 3.714 1.00 0.00 C ATOM 1031 O HIS A 309 -0.564 7.423 4.771 1.00 0.00 O ATOM 1032 CB HIS A 309 0.935 6.441 2.151 1.00 0.00 C ATOM 1033 CG HIS A 309 2.219 5.681 2.005 1.00 0.00 C ATOM 1034 ND1 HIS A 309 3.360 6.253 1.490 1.00 0.00 N ATOM 1035 CD2 HIS A 309 2.545 4.394 2.294 1.00 0.00 C ATOM 1036 CE1 HIS A 309 4.325 5.357 1.454 1.00 0.00 C ATOM 1037 NE2 HIS A 309 3.858 4.222 1.937 1.00 0.00 N ATOM 0 H HIS A 309 1.864 7.015 4.850 1.00 0.00 H new ATOM 0 HA HIS A 309 1.316 8.543 2.399 1.00 0.00 H new ATOM 0 HB2 HIS A 309 0.178 5.782 2.578 1.00 0.00 H new ATOM 0 HB3 HIS A 309 0.581 6.735 1.163 1.00 0.00 H new ATOM 0 HD1 HIS A 309 3.445 7.222 1.183 1.00 0.00 H new ATOM 0 HD2 HIS A 309 1.893 3.648 2.724 1.00 0.00 H new ATOM 0 HE1 HIS A 309 5.328 5.524 1.091 1.00 0.00 H new ATOM 1046 N THR A 310 -1.072 8.861 3.115 1.00 0.00 N ATOM 1047 CA THR A 310 -2.368 9.220 3.692 1.00 0.00 C ATOM 1048 C THR A 310 -3.480 8.267 3.241 1.00 0.00 C ATOM 1049 O THR A 310 -3.865 8.265 2.073 1.00 0.00 O ATOM 1050 CB THR A 310 -2.735 10.655 3.312 1.00 0.00 C ATOM 1051 OG1 THR A 310 -1.604 11.502 3.405 1.00 0.00 O ATOM 1052 CG2 THR A 310 -3.825 11.245 4.180 1.00 0.00 C ATOM 0 H THR A 310 -0.850 9.335 2.239 1.00 0.00 H new ATOM 0 HA THR A 310 -2.276 9.138 4.775 1.00 0.00 H new ATOM 0 HB THR A 310 -3.102 10.598 2.287 1.00 0.00 H new ATOM 0 HG1 THR A 310 -1.858 12.415 3.157 1.00 0.00 H new ATOM 0 HG21 THR A 310 -4.036 12.264 3.856 1.00 0.00 H new ATOM 0 HG22 THR A 310 -4.728 10.641 4.091 1.00 0.00 H new ATOM 0 HG23 THR A 310 -3.497 11.255 5.219 1.00 0.00 H new ATOM 1060 N ASN A 311 -4.002 7.472 4.186 1.00 0.00 N ATOM 1061 CA ASN A 311 -5.084 6.516 3.915 1.00 0.00 C ATOM 1062 C ASN A 311 -4.535 5.150 3.509 1.00 0.00 C ATOM 1063 O ASN A 311 -3.937 4.998 2.444 1.00 0.00 O ATOM 1064 CB ASN A 311 -6.037 7.042 2.835 1.00 0.00 C ATOM 1065 CG ASN A 311 -7.488 6.711 3.129 1.00 0.00 C ATOM 1066 OD1 ASN A 311 -7.735 5.497 3.609 1.00 0.00 O flip ATOM 1067 ND2 ASN A 311 -8.377 7.538 2.928 1.00 0.00 N flip ATOM 0 H ASN A 311 -3.687 7.474 5.156 1.00 0.00 H new ATOM 0 HA ASN A 311 -5.644 6.399 4.843 1.00 0.00 H new ATOM 0 HB2 ASN A 311 -5.924 8.123 2.751 1.00 0.00 H new ATOM 0 HB3 ASN A 311 -5.759 6.616 1.871 1.00 0.00 H new ATOM 0 HD21 ASN A 311 -8.142 8.459 2.558 1.00 0.00 H new ATOM 0 HD22 ASN A 311 -9.348 7.302 3.131 1.00 0.00 H new ATOM 1074 N CYS A 312 -4.746 4.159 4.375 1.00 0.00 N ATOM 1075 CA CYS A 312 -4.277 2.795 4.123 1.00 0.00 C ATOM 1076 C CYS A 312 -5.167 1.766 4.825 1.00 0.00 C ATOM 1077 O CYS A 312 -5.630 2.006 5.940 1.00 0.00 O ATOM 1078 CB CYS A 312 -2.837 2.642 4.614 1.00 0.00 C ATOM 1079 SG CYS A 312 -1.683 3.843 3.908 1.00 0.00 S ATOM 0 H CYS A 312 -5.240 4.275 5.260 1.00 0.00 H new ATOM 0 HA CYS A 312 -4.322 2.615 3.049 1.00 0.00 H new ATOM 0 HB2 CYS A 312 -2.823 2.736 5.700 1.00 0.00 H new ATOM 0 HB3 CYS A 312 -2.489 1.637 4.377 1.00 0.00 H new ATOM 0 HG CYS A 312 -2.278 4.517 2.969 1.00 0.00 H new ATOM 1085 N ILE A 313 -5.400 0.611 4.182 1.00 0.00 N ATOM 1086 CA ILE A 313 -6.226 -0.430 4.781 1.00 0.00 C ATOM 1087 C ILE A 313 -6.007 -1.767 4.088 1.00 0.00 C ATOM 1088 O ILE A 313 -6.332 -1.928 2.911 1.00 0.00 O ATOM 1089 CB ILE A 313 -7.725 -0.082 4.719 1.00 0.00 C ATOM 1090 CG1 ILE A 313 -8.089 0.490 3.346 1.00 0.00 C ATOM 1091 CG2 ILE A 313 -8.093 0.896 5.825 1.00 0.00 C ATOM 1092 CD1 ILE A 313 -9.331 -0.130 2.744 1.00 0.00 C ATOM 0 H ILE A 313 -5.030 0.383 3.259 1.00 0.00 H new ATOM 0 HA ILE A 313 -5.923 -0.501 5.826 1.00 0.00 H new ATOM 0 HB ILE A 313 -8.297 -0.998 4.869 1.00 0.00 H new ATOM 0 HG12 ILE A 313 -8.237 1.566 3.437 1.00 0.00 H new ATOM 0 HG13 ILE A 313 -7.251 0.340 2.665 1.00 0.00 H new ATOM 0 HG21 ILE A 313 -9.156 1.130 5.765 1.00 0.00 H new ATOM 0 HG22 ILE A 313 -7.874 0.448 6.794 1.00 0.00 H new ATOM 0 HG23 ILE A 313 -7.513 1.811 5.709 1.00 0.00 H new ATOM 0 HD11 ILE A 313 -9.529 0.323 1.772 1.00 0.00 H new ATOM 0 HD12 ILE A 313 -9.179 -1.202 2.621 1.00 0.00 H new ATOM 0 HD13 ILE A 313 -10.181 0.042 3.405 1.00 0.00 H new ATOM 1104 N ARG A 314 -5.467 -2.729 4.826 1.00 0.00 N ATOM 1105 CA ARG A 314 -5.220 -4.057 4.280 1.00 0.00 C ATOM 1106 C ARG A 314 -6.541 -4.709 3.895 1.00 0.00 C ATOM 1107 O ARG A 314 -7.593 -4.372 4.440 1.00 0.00 O ATOM 1108 CB ARG A 314 -4.453 -4.920 5.293 1.00 0.00 C ATOM 1109 CG ARG A 314 -3.176 -5.542 4.742 1.00 0.00 C ATOM 1110 CD ARG A 314 -2.299 -4.517 4.023 1.00 0.00 C ATOM 1111 NE ARG A 314 -1.053 -5.084 3.502 1.00 0.00 N ATOM 1112 CZ ARG A 314 -0.976 -6.081 2.615 1.00 0.00 C ATOM 1113 NH1 ARG A 314 -2.064 -6.719 2.203 1.00 0.00 N ATOM 1114 NH2 ARG A 314 0.207 -6.458 2.152 1.00 0.00 N ATOM 0 H ARG A 314 -5.192 -2.615 5.802 1.00 0.00 H new ATOM 0 HA ARG A 314 -4.604 -3.967 3.385 1.00 0.00 H new ATOM 0 HB2 ARG A 314 -4.201 -4.307 6.159 1.00 0.00 H new ATOM 0 HB3 ARG A 314 -5.109 -5.716 5.646 1.00 0.00 H new ATOM 0 HG2 ARG A 314 -2.611 -5.992 5.559 1.00 0.00 H new ATOM 0 HG3 ARG A 314 -3.433 -6.345 4.052 1.00 0.00 H new ATOM 0 HD2 ARG A 314 -2.864 -4.080 3.199 1.00 0.00 H new ATOM 0 HD3 ARG A 314 -2.061 -3.706 4.712 1.00 0.00 H new ATOM 0 HE ARG A 314 -0.177 -4.688 3.842 1.00 0.00 H new ATOM 0 HH11 ARG A 314 -2.980 -6.451 2.564 1.00 0.00 H new ATOM 0 HH12 ARG A 314 -1.985 -7.477 1.525 1.00 0.00 H new ATOM 0 HH21 ARG A 314 1.054 -5.988 2.473 1.00 0.00 H new ATOM 0 HH22 ARG A 314 0.271 -7.218 1.475 1.00 0.00 H new ATOM 1128 N LEU A 315 -6.485 -5.629 2.944 1.00 0.00 N ATOM 1129 CA LEU A 315 -7.679 -6.312 2.472 1.00 0.00 C ATOM 1130 C LEU A 315 -7.590 -7.802 2.743 1.00 0.00 C ATOM 1131 O LEU A 315 -6.517 -8.332 3.023 1.00 0.00 O ATOM 1132 CB LEU A 315 -7.873 -6.062 0.976 1.00 0.00 C ATOM 1133 CG LEU A 315 -9.330 -5.982 0.516 1.00 0.00 C ATOM 1134 CD1 LEU A 315 -9.767 -4.531 0.379 1.00 0.00 C ATOM 1135 CD2 LEU A 315 -9.516 -6.723 -0.799 1.00 0.00 C ATOM 0 H LEU A 315 -5.623 -5.920 2.483 1.00 0.00 H new ATOM 0 HA LEU A 315 -8.537 -5.914 3.014 1.00 0.00 H new ATOM 0 HB2 LEU A 315 -7.373 -5.131 0.711 1.00 0.00 H new ATOM 0 HB3 LEU A 315 -7.377 -6.859 0.423 1.00 0.00 H new ATOM 0 HG LEU A 315 -9.956 -6.459 1.270 1.00 0.00 H new ATOM 0 HD11 LEU A 315 -10.806 -4.493 0.051 1.00 0.00 H new ATOM 0 HD12 LEU A 315 -9.672 -4.030 1.342 1.00 0.00 H new ATOM 0 HD13 LEU A 315 -9.136 -4.029 -0.355 1.00 0.00 H new ATOM 0 HD21 LEU A 315 -10.558 -6.655 -1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 315 -8.879 -6.275 -1.562 1.00 0.00 H new ATOM 0 HD23 LEU A 315 -9.244 -7.770 -0.668 1.00 0.00 H new ATOM 1147 N ALA A 316 -8.725 -8.474 2.666 1.00 0.00 N ATOM 1148 CA ALA A 316 -8.770 -9.909 2.910 1.00 0.00 C ATOM 1149 C ALA A 316 -9.522 -10.643 1.807 1.00 0.00 C ATOM 1150 O ALA A 316 -10.626 -10.255 1.424 1.00 0.00 O ATOM 1151 CB ALA A 316 -9.396 -10.191 4.268 1.00 0.00 C ATOM 0 H ALA A 316 -9.626 -8.053 2.438 1.00 0.00 H new ATOM 0 HA ALA A 316 -7.746 -10.282 2.909 1.00 0.00 H new ATOM 0 HB1 ALA A 316 -9.424 -11.267 4.439 1.00 0.00 H new ATOM 0 HB2 ALA A 316 -8.802 -9.715 5.048 1.00 0.00 H new ATOM 0 HB3 ALA A 316 -10.411 -9.793 4.291 1.00 0.00 H new ATOM 1157 N ALA A 317 -8.912 -11.712 1.300 1.00 0.00 N ATOM 1158 CA ALA A 317 -9.513 -12.510 0.240 1.00 0.00 C ATOM 1159 C ALA A 317 -10.602 -13.423 0.793 1.00 0.00 C ATOM 1160 O ALA A 317 -10.771 -13.538 2.007 1.00 0.00 O ATOM 1161 CB ALA A 317 -8.444 -13.329 -0.473 1.00 0.00 C ATOM 0 H ALA A 317 -7.999 -12.044 1.609 1.00 0.00 H new ATOM 0 HA ALA A 317 -9.974 -11.832 -0.478 1.00 0.00 H new ATOM 0 HB1 ALA A 317 -8.906 -13.921 -1.263 1.00 0.00 H new ATOM 0 HB2 ALA A 317 -7.702 -12.659 -0.908 1.00 0.00 H new ATOM 0 HB3 ALA A 317 -7.958 -13.993 0.241 1.00 0.00 H new