USER MOD reduce.3.24.130724 H: found=0, std=0, add=1002, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1000 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 259 SER OG : rot -125:sc= 1.09 USER MOD Set 1.2: A 262 GLN :FLIP amide:sc= -0.0908 F(o=0.36,f=2) USER MOD Set 1.3: B 893 SER OG : rot 180:sc= 1.01 USER MOD Set 2.1: B 870 GLN : amide:sc= -0.188 X(o=1.1,f=1.2) USER MOD Set 2.2: B 874 THR OG1 : rot 105:sc= 1.26 USER MOD Set 3.1: B 852 CYS SG : rot -22:sc= -5.59! USER MOD Set 3.2: B 856 MET CE :methyl 174:sc= -0.27 (180deg=-0.351) USER MOD Set 4.1: B 848 ASN : amide:sc= -0.24 K(o=-0.23,f=-1.2) USER MOD Set 4.2: B 851 ASN : amide:sc= 0.0113 K(o=-0.23,f=-1.2) USER MOD Set 5.1: B 833 TYR OH : rot -154:sc= 1.09 USER MOD Set 5.2: B 857 HIS : no HE2:sc= -0.829 K(o=0.26,f=-0.81) USER MOD Set 6.1: A 256 THR OG1 : rot 94:sc= 1.25 USER MOD Set 6.2: A 274 CYS SG : rot 103:sc= -1.3 USER MOD Set 7.1: A 236 THR OG1 : rot 47:sc= 1.2 USER MOD Set 7.2: A 250 SER OG : rot -115:sc= -2.92! USER MOD Set 8.1: A 246 ASN : amide:sc= -0.16 K(o=1.1,f=-9.9!) USER MOD Set 8.2: A 247 LYS NZ :NH3+ 159:sc= 1.27 (180deg=0) USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 238 CYS SG : rot 82:sc= 0.218 USER MOD Single : A 240 THR OG1 : rot -159:sc= -2.11! USER MOD Single : A 241 THR OG1 : rot -103:sc= 1.26 USER MOD Single : A 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 244 SER OG : rot -170:sc= 0.973 USER MOD Single : A 248 THR OG1 : rot 180:sc= -0.0142 USER MOD Single : A 251 GLN :FLIP amide:sc= -0.657 F(o=-2.2!,f=-0.66) USER MOD Single : A 252 THR OG1 : rot 85:sc= 1.25 USER MOD Single : A 255 THR OG1 : rot 180:sc= 0 USER MOD Single : A 267 SER OG : rot 33:sc= 0.361 USER MOD Single : A 280 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 281 LYS NZ :NH3+ -141:sc= 0.907 (180deg=0.0912) USER MOD Single : A 290 HIS :FLIP no HE2:sc= 0.117 F(o=-0.84,f=0.12) USER MOD Single : A 295 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 834 ASN : amide:sc= -2.57! C(o=-2.6!,f=-6.3!) USER MOD Single : B 838 GLN :FLIP amide:sc= -0.82 F(o=-1.6,f=-0.82) USER MOD Single : B 843 LYS NZ :NH3+ -143:sc= 2.07 (180deg=-1.01) USER MOD Single : B 844 MET CE :methyl 157:sc= -0.0725 (180deg=-0.654) USER MOD Single : B 850 LYS NZ :NH3+ 167:sc= -0.0512 (180deg=-0.387) USER MOD Single : B 854 SER OG : rot 81:sc= 0.548 USER MOD Single : B 858 HIS : no HD1:sc= 0 X(o=0,f=-0.0037) USER MOD Single : B 860 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 861 ASN :FLIP amide:sc= -3.27! F(o=-4.2,f=-3.3!) USER MOD Single : B 869 SER OG : rot 180:sc= 0.0818 USER MOD Single : B 875 SER OG : rot 180:sc= 0 USER MOD Single : B 879 ASN : amide:sc= 0.499 K(o=0.5,f=-6.8!) USER MOD Single : B 882 ASN : amide:sc=-0.00557 K(o=-0.0056,f=-0.93) USER MOD Single : B 884 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00512) USER MOD Single : B 885 GLN :FLIP amide:sc= 0 F(o=-0.76,f=0) USER MOD Single : B 887 TYR OH : rot 180:sc= 0 USER MOD Single : B 891 HIS : no HE2:sc= 0.236 K(o=0.24,f=-4.6!) USER MOD Single : B 892 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 197 N PHE A 231 -8.386 8.559 -4.688 1.00 0.00 N ATOM 198 CA PHE A 231 -8.159 7.682 -3.541 1.00 0.00 C ATOM 199 C PHE A 231 -8.643 6.242 -3.832 1.00 0.00 C ATOM 200 O PHE A 231 -7.852 5.305 -3.752 1.00 0.00 O ATOM 201 CB PHE A 231 -8.883 8.291 -2.316 1.00 0.00 C ATOM 202 CG PHE A 231 -8.827 7.511 -1.022 1.00 0.00 C ATOM 203 CD1 PHE A 231 -7.841 6.579 -0.777 1.00 0.00 C ATOM 204 CD2 PHE A 231 -9.768 7.739 -0.045 1.00 0.00 C ATOM 205 CE1 PHE A 231 -7.795 5.885 0.407 1.00 0.00 C ATOM 206 CE2 PHE A 231 -9.729 7.048 1.141 1.00 0.00 C ATOM 207 CZ PHE A 231 -8.739 6.120 1.368 1.00 0.00 C ATOM 0 HA PHE A 231 -7.091 7.611 -3.334 1.00 0.00 H new ATOM 0 HB2 PHE A 231 -8.463 9.280 -2.133 1.00 0.00 H new ATOM 0 HB3 PHE A 231 -9.931 8.434 -2.579 1.00 0.00 H new ATOM 0 HD1 PHE A 231 -7.091 6.391 -1.531 1.00 0.00 H new ATOM 0 HD2 PHE A 231 -10.546 8.469 -0.212 1.00 0.00 H new ATOM 0 HE1 PHE A 231 -7.016 5.156 0.579 1.00 0.00 H new ATOM 0 HE2 PHE A 231 -10.477 7.233 1.897 1.00 0.00 H new ATOM 0 HZ PHE A 231 -8.708 5.579 2.302 1.00 0.00 H new ATOM 217 N VAL A 232 -9.899 6.085 -4.249 1.00 0.00 N ATOM 218 CA VAL A 232 -10.439 4.778 -4.613 1.00 0.00 C ATOM 219 C VAL A 232 -9.662 4.172 -5.776 1.00 0.00 C ATOM 220 O VAL A 232 -9.473 2.973 -5.832 1.00 0.00 O ATOM 221 CB VAL A 232 -11.969 4.808 -4.955 1.00 0.00 C ATOM 222 CG1 VAL A 232 -12.784 5.262 -3.766 1.00 0.00 C ATOM 223 CG2 VAL A 232 -12.269 5.684 -6.158 1.00 0.00 C ATOM 0 H VAL A 232 -10.564 6.853 -4.343 1.00 0.00 H new ATOM 0 HA VAL A 232 -10.323 4.153 -3.728 1.00 0.00 H new ATOM 0 HB VAL A 232 -12.253 3.787 -5.208 1.00 0.00 H new ATOM 0 HG11 VAL A 232 -13.841 5.273 -4.032 1.00 0.00 H new ATOM 0 HG12 VAL A 232 -12.627 4.576 -2.934 1.00 0.00 H new ATOM 0 HG13 VAL A 232 -12.473 6.265 -3.473 1.00 0.00 H new ATOM 0 HG21 VAL A 232 -13.341 5.674 -6.357 1.00 0.00 H new ATOM 0 HG22 VAL A 232 -11.947 6.705 -5.954 1.00 0.00 H new ATOM 0 HG23 VAL A 232 -11.735 5.303 -7.028 1.00 0.00 H new ATOM 233 N SER A 233 -9.179 5.018 -6.665 1.00 0.00 N ATOM 234 CA SER A 233 -8.416 4.601 -7.798 1.00 0.00 C ATOM 235 C SER A 233 -7.088 4.013 -7.384 1.00 0.00 C ATOM 236 O SER A 233 -6.738 2.900 -7.804 1.00 0.00 O ATOM 237 CB SER A 233 -8.209 5.786 -8.683 1.00 0.00 C ATOM 238 OG SER A 233 -9.415 6.154 -9.313 1.00 0.00 O ATOM 0 H SER A 233 -9.314 6.027 -6.609 1.00 0.00 H new ATOM 0 HA SER A 233 -8.959 3.820 -8.331 1.00 0.00 H new ATOM 0 HB2 SER A 233 -7.829 6.622 -8.096 1.00 0.00 H new ATOM 0 HB3 SER A 233 -7.455 5.557 -9.436 1.00 0.00 H new ATOM 0 HG SER A 233 -9.260 6.933 -9.887 1.00 0.00 H new ATOM 244 N ARG A 234 -6.376 4.734 -6.534 1.00 0.00 N ATOM 245 CA ARG A 234 -5.087 4.300 -6.064 1.00 0.00 C ATOM 246 C ARG A 234 -5.265 3.017 -5.296 1.00 0.00 C ATOM 247 O ARG A 234 -4.502 2.088 -5.463 1.00 0.00 O ATOM 248 CB ARG A 234 -4.436 5.338 -5.161 1.00 0.00 C ATOM 249 CG ARG A 234 -4.358 6.752 -5.714 1.00 0.00 C ATOM 250 CD ARG A 234 -3.734 6.812 -7.096 1.00 0.00 C ATOM 251 NE ARG A 234 -2.349 6.338 -7.131 1.00 0.00 N ATOM 252 CZ ARG A 234 -1.629 6.235 -8.249 1.00 0.00 C ATOM 253 NH1 ARG A 234 -2.169 6.528 -9.419 1.00 0.00 N ATOM 254 NH2 ARG A 234 -0.382 5.827 -8.186 1.00 0.00 N ATOM 0 H ARG A 234 -6.680 5.631 -6.156 1.00 0.00 H new ATOM 0 HA ARG A 234 -4.436 4.154 -6.926 1.00 0.00 H new ATOM 0 HB2 ARG A 234 -4.986 5.368 -4.220 1.00 0.00 H new ATOM 0 HB3 ARG A 234 -3.425 5.004 -4.929 1.00 0.00 H new ATOM 0 HG2 ARG A 234 -5.361 7.176 -5.755 1.00 0.00 H new ATOM 0 HG3 ARG A 234 -3.777 7.372 -5.031 1.00 0.00 H new ATOM 0 HD2 ARG A 234 -4.332 6.213 -7.783 1.00 0.00 H new ATOM 0 HD3 ARG A 234 -3.767 7.840 -7.457 1.00 0.00 H new ATOM 0 HE ARG A 234 -1.910 6.071 -6.250 1.00 0.00 H new ATOM 0 HH11 ARG A 234 -3.141 6.835 -9.470 1.00 0.00 H new ATOM 0 HH12 ARG A 234 -1.614 6.448 -10.271 1.00 0.00 H new ATOM 0 HH21 ARG A 234 0.032 5.590 -7.284 1.00 0.00 H new ATOM 0 HH22 ARG A 234 0.172 5.747 -9.039 1.00 0.00 H new ATOM 268 N VAL A 235 -6.320 2.967 -4.485 1.00 0.00 N ATOM 269 CA VAL A 235 -6.659 1.794 -3.734 1.00 0.00 C ATOM 270 C VAL A 235 -6.938 0.619 -4.664 1.00 0.00 C ATOM 271 O VAL A 235 -6.427 -0.459 -4.447 1.00 0.00 O ATOM 272 CB VAL A 235 -7.859 2.069 -2.781 1.00 0.00 C ATOM 273 CG1 VAL A 235 -8.396 0.830 -2.196 1.00 0.00 C ATOM 274 CG2 VAL A 235 -7.449 3.030 -1.696 1.00 0.00 C ATOM 0 H VAL A 235 -6.957 3.751 -4.340 1.00 0.00 H new ATOM 0 HA VAL A 235 -5.804 1.527 -3.112 1.00 0.00 H new ATOM 0 HB VAL A 235 -8.656 2.516 -3.375 1.00 0.00 H new ATOM 0 HG11 VAL A 235 -9.231 1.070 -1.538 1.00 0.00 H new ATOM 0 HG12 VAL A 235 -8.740 0.171 -2.993 1.00 0.00 H new ATOM 0 HG13 VAL A 235 -7.615 0.330 -1.623 1.00 0.00 H new ATOM 0 HG21 VAL A 235 -8.296 3.215 -1.035 1.00 0.00 H new ATOM 0 HG22 VAL A 235 -6.628 2.602 -1.122 1.00 0.00 H new ATOM 0 HG23 VAL A 235 -7.127 3.970 -2.145 1.00 0.00 H new ATOM 284 N THR A 236 -7.669 0.869 -5.737 1.00 0.00 N ATOM 285 CA THR A 236 -8.017 -0.158 -6.697 1.00 0.00 C ATOM 286 C THR A 236 -6.769 -0.828 -7.271 1.00 0.00 C ATOM 287 O THR A 236 -6.606 -2.036 -7.168 1.00 0.00 O ATOM 288 CB THR A 236 -8.885 0.419 -7.845 1.00 0.00 C ATOM 289 OG1 THR A 236 -10.139 0.906 -7.320 1.00 0.00 O ATOM 290 CG2 THR A 236 -9.159 -0.633 -8.897 1.00 0.00 C ATOM 0 H THR A 236 -8.037 1.792 -5.965 1.00 0.00 H new ATOM 0 HA THR A 236 -8.599 -0.911 -6.166 1.00 0.00 H new ATOM 0 HB THR A 236 -8.334 1.240 -8.304 1.00 0.00 H new ATOM 0 HG1 THR A 236 -9.970 1.453 -6.525 1.00 0.00 H new ATOM 0 HG21 THR A 236 -9.770 -0.203 -9.691 1.00 0.00 H new ATOM 0 HG22 THR A 236 -8.215 -0.984 -9.315 1.00 0.00 H new ATOM 0 HG23 THR A 236 -9.690 -1.471 -8.444 1.00 0.00 H new ATOM 298 N GLU A 237 -5.861 -0.031 -7.787 1.00 0.00 N ATOM 299 CA GLU A 237 -4.637 -0.552 -8.359 1.00 0.00 C ATOM 300 C GLU A 237 -3.758 -1.209 -7.292 1.00 0.00 C ATOM 301 O GLU A 237 -3.009 -2.173 -7.566 1.00 0.00 O ATOM 302 CB GLU A 237 -3.909 0.497 -9.187 1.00 0.00 C ATOM 303 CG GLU A 237 -3.701 1.810 -8.476 1.00 0.00 C ATOM 304 CD GLU A 237 -2.990 2.840 -9.325 1.00 0.00 C ATOM 305 OE1 GLU A 237 -1.759 2.728 -9.522 1.00 0.00 O ATOM 306 OE2 GLU A 237 -3.670 3.758 -9.838 1.00 0.00 O ATOM 0 H GLU A 237 -5.946 0.985 -7.823 1.00 0.00 H new ATOM 0 HA GLU A 237 -4.902 -1.344 -9.059 1.00 0.00 H new ATOM 0 HB2 GLU A 237 -2.938 0.100 -9.484 1.00 0.00 H new ATOM 0 HB3 GLU A 237 -4.473 0.677 -10.102 1.00 0.00 H new ATOM 0 HG2 GLU A 237 -4.669 2.207 -8.169 1.00 0.00 H new ATOM 0 HG3 GLU A 237 -3.124 1.637 -7.567 1.00 0.00 H new ATOM 313 N CYS A 238 -3.858 -0.700 -6.082 1.00 0.00 N ATOM 314 CA CYS A 238 -3.160 -1.248 -4.954 1.00 0.00 C ATOM 315 C CYS A 238 -3.613 -2.663 -4.703 1.00 0.00 C ATOM 316 O CYS A 238 -2.808 -3.559 -4.536 1.00 0.00 O ATOM 317 CB CYS A 238 -3.368 -0.380 -3.719 1.00 0.00 C ATOM 318 SG CYS A 238 -2.424 1.156 -3.718 1.00 0.00 S ATOM 0 H CYS A 238 -4.433 0.113 -5.859 1.00 0.00 H new ATOM 0 HA CYS A 238 -2.093 -1.262 -5.175 1.00 0.00 H new ATOM 0 HB2 CYS A 238 -4.428 -0.140 -3.633 1.00 0.00 H new ATOM 0 HB3 CYS A 238 -3.099 -0.958 -2.835 1.00 0.00 H new ATOM 0 HG CYS A 238 -3.054 2.053 -4.417 1.00 0.00 H new ATOM 324 N LEU A 239 -4.888 -2.870 -4.744 1.00 0.00 N ATOM 325 CA LEU A 239 -5.443 -4.183 -4.537 1.00 0.00 C ATOM 326 C LEU A 239 -5.089 -5.067 -5.700 1.00 0.00 C ATOM 327 O LEU A 239 -4.720 -6.222 -5.533 1.00 0.00 O ATOM 328 CB LEU A 239 -6.954 -4.077 -4.411 1.00 0.00 C ATOM 329 CG LEU A 239 -7.400 -3.008 -3.450 1.00 0.00 C ATOM 330 CD1 LEU A 239 -8.904 -2.919 -3.329 1.00 0.00 C ATOM 331 CD2 LEU A 239 -6.740 -3.174 -2.115 1.00 0.00 C ATOM 0 H LEU A 239 -5.580 -2.141 -4.921 1.00 0.00 H new ATOM 0 HA LEU A 239 -5.034 -4.614 -3.623 1.00 0.00 H new ATOM 0 HB2 LEU A 239 -7.380 -3.873 -5.393 1.00 0.00 H new ATOM 0 HB3 LEU A 239 -7.352 -5.038 -4.085 1.00 0.00 H new ATOM 0 HG LEU A 239 -7.077 -2.054 -3.866 1.00 0.00 H new ATOM 0 HD11 LEU A 239 -9.166 -2.131 -2.623 1.00 0.00 H new ATOM 0 HD12 LEU A 239 -9.335 -2.690 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 239 -9.297 -3.871 -2.973 1.00 0.00 H new ATOM 0 HD21 LEU A 239 -7.080 -2.388 -1.441 1.00 0.00 H new ATOM 0 HD22 LEU A 239 -7.000 -4.147 -1.699 1.00 0.00 H new ATOM 0 HD23 LEU A 239 -5.658 -3.107 -2.233 1.00 0.00 H new ATOM 343 N THR A 240 -5.108 -4.489 -6.881 1.00 0.00 N ATOM 344 CA THR A 240 -4.891 -5.258 -8.064 1.00 0.00 C ATOM 345 C THR A 240 -3.398 -5.419 -8.368 1.00 0.00 C ATOM 346 O THR A 240 -3.040 -5.868 -9.446 1.00 0.00 O ATOM 347 CB THR A 240 -5.627 -4.648 -9.282 1.00 0.00 C ATOM 348 OG1 THR A 240 -5.112 -3.338 -9.556 1.00 0.00 O ATOM 349 CG2 THR A 240 -7.109 -4.522 -8.994 1.00 0.00 C ATOM 0 H THR A 240 -5.271 -3.494 -7.037 1.00 0.00 H new ATOM 0 HA THR A 240 -5.306 -6.248 -7.877 1.00 0.00 H new ATOM 0 HB THR A 240 -5.470 -5.305 -10.138 1.00 0.00 H new ATOM 0 HG1 THR A 240 -5.768 -2.831 -10.079 1.00 0.00 H new ATOM 0 HG21 THR A 240 -7.613 -4.092 -9.860 1.00 0.00 H new ATOM 0 HG22 THR A 240 -7.524 -5.508 -8.786 1.00 0.00 H new ATOM 0 HG23 THR A 240 -7.258 -3.876 -8.129 1.00 0.00 H new ATOM 357 N THR A 241 -2.534 -4.998 -7.431 1.00 0.00 N ATOM 358 CA THR A 241 -1.079 -5.210 -7.562 1.00 0.00 C ATOM 359 C THR A 241 -0.727 -6.667 -7.901 1.00 0.00 C ATOM 360 O THR A 241 0.213 -6.924 -8.671 1.00 0.00 O ATOM 361 CB THR A 241 -0.302 -4.794 -6.287 1.00 0.00 C ATOM 362 OG1 THR A 241 -0.930 -5.344 -5.120 1.00 0.00 O ATOM 363 CG2 THR A 241 -0.191 -3.285 -6.166 1.00 0.00 C ATOM 0 H THR A 241 -2.813 -4.512 -6.579 1.00 0.00 H new ATOM 0 HA THR A 241 -0.773 -4.568 -8.389 1.00 0.00 H new ATOM 0 HB THR A 241 0.709 -5.194 -6.369 1.00 0.00 H new ATOM 0 HG1 THR A 241 -1.435 -4.642 -4.658 1.00 0.00 H new ATOM 0 HG21 THR A 241 0.360 -3.032 -5.260 1.00 0.00 H new ATOM 0 HG22 THR A 241 0.336 -2.888 -7.034 1.00 0.00 H new ATOM 0 HG23 THR A 241 -1.189 -2.850 -6.117 1.00 0.00 H new ATOM 371 N VAL A 242 -1.493 -7.615 -7.363 1.00 0.00 N ATOM 372 CA VAL A 242 -1.230 -9.015 -7.620 1.00 0.00 C ATOM 373 C VAL A 242 -1.834 -9.446 -8.952 1.00 0.00 C ATOM 374 O VAL A 242 -2.520 -8.674 -9.615 1.00 0.00 O ATOM 375 CB VAL A 242 -1.767 -9.928 -6.505 1.00 0.00 C ATOM 376 CG1 VAL A 242 -1.095 -9.647 -5.214 1.00 0.00 C ATOM 377 CG2 VAL A 242 -3.222 -9.741 -6.340 1.00 0.00 C ATOM 0 H VAL A 242 -2.291 -7.434 -6.754 1.00 0.00 H new ATOM 0 HA VAL A 242 -0.146 -9.121 -7.654 1.00 0.00 H new ATOM 0 HB VAL A 242 -1.560 -10.958 -6.797 1.00 0.00 H new ATOM 0 HG11 VAL A 242 -1.495 -10.307 -4.444 1.00 0.00 H new ATOM 0 HG12 VAL A 242 -0.023 -9.817 -5.317 1.00 0.00 H new ATOM 0 HG13 VAL A 242 -1.272 -8.610 -4.930 1.00 0.00 H new ATOM 0 HG21 VAL A 242 -3.585 -10.395 -5.547 1.00 0.00 H new ATOM 0 HG22 VAL A 242 -3.428 -8.703 -6.078 1.00 0.00 H new ATOM 0 HG23 VAL A 242 -3.729 -9.987 -7.273 1.00 0.00 H new ATOM 387 N LYS A 243 -1.590 -10.672 -9.324 1.00 0.00 N ATOM 388 CA LYS A 243 -2.074 -11.201 -10.578 1.00 0.00 C ATOM 389 C LYS A 243 -3.560 -11.581 -10.496 1.00 0.00 C ATOM 390 O LYS A 243 -4.365 -11.127 -11.289 1.00 0.00 O ATOM 391 CB LYS A 243 -1.233 -12.425 -10.986 1.00 0.00 C ATOM 392 CG LYS A 243 -1.615 -13.100 -12.316 1.00 0.00 C ATOM 393 CD LYS A 243 -1.008 -12.421 -13.570 1.00 0.00 C ATOM 394 CE LYS A 243 -1.513 -11.005 -13.802 1.00 0.00 C ATOM 395 NZ LYS A 243 -0.963 -10.408 -15.028 1.00 0.00 N ATOM 0 H LYS A 243 -1.050 -11.336 -8.769 1.00 0.00 H new ATOM 0 HA LYS A 243 -1.975 -10.422 -11.334 1.00 0.00 H new ATOM 0 HB2 LYS A 243 -0.189 -12.119 -11.045 1.00 0.00 H new ATOM 0 HB3 LYS A 243 -1.303 -13.169 -10.192 1.00 0.00 H new ATOM 0 HG2 LYS A 243 -1.292 -14.141 -12.288 1.00 0.00 H new ATOM 0 HG3 LYS A 243 -2.701 -13.105 -12.409 1.00 0.00 H new ATOM 0 HD2 LYS A 243 0.077 -12.399 -13.471 1.00 0.00 H new ATOM 0 HD3 LYS A 243 -1.236 -13.027 -14.447 1.00 0.00 H new ATOM 0 HE2 LYS A 243 -2.601 -11.016 -13.863 1.00 0.00 H new ATOM 0 HE3 LYS A 243 -1.248 -10.383 -12.947 1.00 0.00 H new ATOM 0 HZ1 LYS A 243 -1.336 -9.444 -15.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 243 0.074 -10.372 -14.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 243 -1.237 -10.985 -15.849 1.00 0.00 H new ATOM 409 N SER A 244 -3.883 -12.407 -9.530 1.00 0.00 N ATOM 410 CA SER A 244 -5.221 -12.955 -9.367 1.00 0.00 C ATOM 411 C SER A 244 -6.314 -11.904 -9.057 1.00 0.00 C ATOM 412 O SER A 244 -7.424 -12.007 -9.569 1.00 0.00 O ATOM 413 CB SER A 244 -5.165 -14.017 -8.298 1.00 0.00 C ATOM 414 OG SER A 244 -4.173 -14.965 -8.622 1.00 0.00 O ATOM 0 H SER A 244 -3.220 -12.725 -8.823 1.00 0.00 H new ATOM 0 HA SER A 244 -5.522 -13.378 -10.326 1.00 0.00 H new ATOM 0 HB2 SER A 244 -4.946 -13.563 -7.332 1.00 0.00 H new ATOM 0 HB3 SER A 244 -6.134 -14.507 -8.207 1.00 0.00 H new ATOM 0 HG SER A 244 -4.244 -15.732 -8.016 1.00 0.00 H new ATOM 420 N VAL A 245 -6.015 -10.939 -8.201 1.00 0.00 N ATOM 421 CA VAL A 245 -6.998 -9.875 -7.867 1.00 0.00 C ATOM 422 C VAL A 245 -7.296 -9.023 -9.091 1.00 0.00 C ATOM 423 O VAL A 245 -6.386 -8.544 -9.754 1.00 0.00 O ATOM 424 CB VAL A 245 -6.475 -8.971 -6.726 1.00 0.00 C ATOM 425 CG1 VAL A 245 -7.356 -7.755 -6.496 1.00 0.00 C ATOM 426 CG2 VAL A 245 -6.367 -9.763 -5.447 1.00 0.00 C ATOM 0 H VAL A 245 -5.118 -10.855 -7.722 1.00 0.00 H new ATOM 0 HA VAL A 245 -7.914 -10.364 -7.534 1.00 0.00 H new ATOM 0 HB VAL A 245 -5.492 -8.612 -7.030 1.00 0.00 H new ATOM 0 HG11 VAL A 245 -6.943 -7.155 -5.685 1.00 0.00 H new ATOM 0 HG12 VAL A 245 -7.395 -7.157 -7.406 1.00 0.00 H new ATOM 0 HG13 VAL A 245 -8.362 -8.080 -6.232 1.00 0.00 H new ATOM 0 HG21 VAL A 245 -5.998 -9.118 -4.650 1.00 0.00 H new ATOM 0 HG22 VAL A 245 -7.349 -10.151 -5.175 1.00 0.00 H new ATOM 0 HG23 VAL A 245 -5.676 -10.594 -5.591 1.00 0.00 H new ATOM 436 N ASN A 246 -8.556 -8.848 -9.385 1.00 0.00 N ATOM 437 CA ASN A 246 -8.948 -8.080 -10.539 1.00 0.00 C ATOM 438 C ASN A 246 -9.798 -6.901 -10.037 1.00 0.00 C ATOM 439 O ASN A 246 -10.030 -6.801 -8.826 1.00 0.00 O ATOM 440 CB ASN A 246 -9.754 -8.983 -11.486 1.00 0.00 C ATOM 441 CG ASN A 246 -9.858 -8.495 -12.914 1.00 0.00 C ATOM 442 OD1 ASN A 246 -10.864 -8.719 -13.565 1.00 0.00 O ATOM 443 ND2 ASN A 246 -8.835 -7.866 -13.426 1.00 0.00 N ATOM 0 H ASN A 246 -9.331 -9.227 -8.841 1.00 0.00 H new ATOM 0 HA ASN A 246 -8.085 -7.701 -11.087 1.00 0.00 H new ATOM 0 HB2 ASN A 246 -9.300 -9.974 -11.490 1.00 0.00 H new ATOM 0 HB3 ASN A 246 -10.761 -9.096 -11.084 1.00 0.00 H new ATOM 0 HD21 ASN A 246 -8.865 -7.548 -14.395 1.00 0.00 H new ATOM 0 HD22 ASN A 246 -8.006 -7.693 -12.857 1.00 0.00 H new ATOM 450 N LYS A 247 -10.276 -6.016 -10.935 1.00 0.00 N ATOM 451 CA LYS A 247 -11.096 -4.834 -10.533 1.00 0.00 C ATOM 452 C LYS A 247 -12.330 -5.255 -9.715 1.00 0.00 C ATOM 453 O LYS A 247 -12.851 -4.490 -8.887 1.00 0.00 O ATOM 454 CB LYS A 247 -11.544 -3.973 -11.757 1.00 0.00 C ATOM 455 CG LYS A 247 -12.848 -4.403 -12.487 1.00 0.00 C ATOM 456 CD LYS A 247 -12.779 -5.752 -13.214 1.00 0.00 C ATOM 457 CE LYS A 247 -11.758 -5.745 -14.331 1.00 0.00 C ATOM 458 NZ LYS A 247 -11.902 -6.915 -15.220 1.00 0.00 N ATOM 0 H LYS A 247 -10.115 -6.088 -11.940 1.00 0.00 H new ATOM 0 HA LYS A 247 -10.449 -4.218 -9.908 1.00 0.00 H new ATOM 0 HB2 LYS A 247 -11.669 -2.944 -11.419 1.00 0.00 H new ATOM 0 HB3 LYS A 247 -10.733 -3.973 -12.485 1.00 0.00 H new ATOM 0 HG2 LYS A 247 -13.657 -4.443 -11.757 1.00 0.00 H new ATOM 0 HG3 LYS A 247 -13.110 -3.632 -13.211 1.00 0.00 H new ATOM 0 HD2 LYS A 247 -12.529 -6.536 -12.499 1.00 0.00 H new ATOM 0 HD3 LYS A 247 -13.760 -5.994 -13.622 1.00 0.00 H new ATOM 0 HE2 LYS A 247 -11.866 -4.831 -14.915 1.00 0.00 H new ATOM 0 HE3 LYS A 247 -10.755 -5.735 -13.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 247 -11.456 -6.711 -16.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 247 -11.440 -7.740 -14.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 247 -12.911 -7.120 -15.363 1.00 0.00 H new ATOM 472 N THR A 248 -12.777 -6.462 -9.977 1.00 0.00 N ATOM 473 CA THR A 248 -13.886 -7.081 -9.341 1.00 0.00 C ATOM 474 C THR A 248 -13.630 -7.209 -7.847 1.00 0.00 C ATOM 475 O THR A 248 -14.479 -6.874 -7.017 1.00 0.00 O ATOM 476 CB THR A 248 -13.993 -8.460 -9.924 1.00 0.00 C ATOM 477 OG1 THR A 248 -13.461 -8.405 -11.271 1.00 0.00 O ATOM 478 CG2 THR A 248 -15.432 -8.902 -9.971 1.00 0.00 C ATOM 0 H THR A 248 -12.343 -7.060 -10.681 1.00 0.00 H new ATOM 0 HA THR A 248 -14.793 -6.495 -9.492 1.00 0.00 H new ATOM 0 HB THR A 248 -13.439 -9.171 -9.311 1.00 0.00 H new ATOM 0 HG1 THR A 248 -13.515 -9.294 -11.681 1.00 0.00 H new ATOM 0 HG21 THR A 248 -15.491 -9.904 -10.396 1.00 0.00 H new ATOM 0 HG22 THR A 248 -15.843 -8.912 -8.961 1.00 0.00 H new ATOM 0 HG23 THR A 248 -16.005 -8.211 -10.589 1.00 0.00 H new ATOM 486 N ASP A 249 -12.454 -7.671 -7.508 1.00 0.00 N ATOM 487 CA ASP A 249 -12.097 -7.832 -6.147 1.00 0.00 C ATOM 488 C ASP A 249 -11.868 -6.495 -5.489 1.00 0.00 C ATOM 489 O ASP A 249 -12.206 -6.308 -4.346 1.00 0.00 O ATOM 490 CB ASP A 249 -10.885 -8.689 -6.016 1.00 0.00 C ATOM 491 CG ASP A 249 -10.663 -9.023 -4.591 1.00 0.00 C ATOM 492 OD1 ASP A 249 -11.671 -9.423 -3.944 1.00 0.00 O ATOM 493 OD2 ASP A 249 -9.535 -8.905 -4.114 1.00 0.00 O ATOM 0 H ASP A 249 -11.730 -7.941 -8.173 1.00 0.00 H new ATOM 0 HA ASP A 249 -12.926 -8.326 -5.640 1.00 0.00 H new ATOM 0 HB2 ASP A 249 -11.008 -9.602 -6.599 1.00 0.00 H new ATOM 0 HB3 ASP A 249 -10.015 -8.169 -6.418 1.00 0.00 H new ATOM 498 N SER A 250 -11.361 -5.540 -6.254 1.00 0.00 N ATOM 499 CA SER A 250 -11.131 -4.210 -5.743 1.00 0.00 C ATOM 500 C SER A 250 -12.422 -3.620 -5.168 1.00 0.00 C ATOM 501 O SER A 250 -12.462 -3.215 -4.011 1.00 0.00 O ATOM 502 CB SER A 250 -10.541 -3.303 -6.815 1.00 0.00 C ATOM 503 OG SER A 250 -10.369 -1.999 -6.322 1.00 0.00 O ATOM 0 H SER A 250 -11.103 -5.668 -7.232 1.00 0.00 H new ATOM 0 HA SER A 250 -10.403 -4.280 -4.935 1.00 0.00 H new ATOM 0 HB2 SER A 250 -9.582 -3.701 -7.148 1.00 0.00 H new ATOM 0 HB3 SER A 250 -11.198 -3.285 -7.685 1.00 0.00 H new ATOM 0 HG SER A 250 -10.956 -1.385 -6.810 1.00 0.00 H new ATOM 509 N GLN A 251 -13.499 -3.657 -5.952 1.00 0.00 N ATOM 510 CA GLN A 251 -14.784 -3.149 -5.488 1.00 0.00 C ATOM 511 C GLN A 251 -15.322 -3.994 -4.325 1.00 0.00 C ATOM 512 O GLN A 251 -15.995 -3.486 -3.423 1.00 0.00 O ATOM 513 CB GLN A 251 -15.792 -3.039 -6.637 1.00 0.00 C ATOM 514 CG GLN A 251 -16.003 -4.312 -7.435 1.00 0.00 C ATOM 515 CD GLN A 251 -17.036 -4.155 -8.528 1.00 0.00 C ATOM 516 OE1 GLN A 251 -16.862 -4.860 -9.601 1.00 0.00 O flip ATOM 517 NE2 GLN A 251 -17.973 -3.383 -8.411 1.00 0.00 N flip ATOM 0 H GLN A 251 -13.506 -4.030 -6.901 1.00 0.00 H new ATOM 0 HA GLN A 251 -14.629 -2.139 -5.109 1.00 0.00 H new ATOM 0 HB2 GLN A 251 -16.751 -2.722 -6.228 1.00 0.00 H new ATOM 0 HB3 GLN A 251 -15.460 -2.254 -7.316 1.00 0.00 H new ATOM 0 HG2 GLN A 251 -15.056 -4.618 -7.878 1.00 0.00 H new ATOM 0 HG3 GLN A 251 -16.313 -5.111 -6.761 1.00 0.00 H new ATOM 0 HE21 GLN A 251 -18.084 -2.841 -7.554 1.00 0.00 H new ATOM 0 HE22 GLN A 251 -18.646 -3.279 -9.170 1.00 0.00 H new ATOM 526 N THR A 252 -14.964 -5.260 -4.328 1.00 0.00 N ATOM 527 CA THR A 252 -15.318 -6.176 -3.269 1.00 0.00 C ATOM 528 C THR A 252 -14.659 -5.740 -1.935 1.00 0.00 C ATOM 529 O THR A 252 -15.318 -5.644 -0.887 1.00 0.00 O ATOM 530 CB THR A 252 -14.864 -7.608 -3.637 1.00 0.00 C ATOM 531 OG1 THR A 252 -15.561 -8.056 -4.821 1.00 0.00 O ATOM 532 CG2 THR A 252 -15.092 -8.572 -2.497 1.00 0.00 C ATOM 0 H THR A 252 -14.413 -5.685 -5.074 1.00 0.00 H new ATOM 0 HA THR A 252 -16.401 -6.164 -3.145 1.00 0.00 H new ATOM 0 HB THR A 252 -13.793 -7.582 -3.837 1.00 0.00 H new ATOM 0 HG1 THR A 252 -15.085 -7.744 -5.619 1.00 0.00 H new ATOM 0 HG21 THR A 252 -14.762 -9.568 -2.791 1.00 0.00 H new ATOM 0 HG22 THR A 252 -14.526 -8.245 -1.625 1.00 0.00 H new ATOM 0 HG23 THR A 252 -16.153 -8.600 -2.251 1.00 0.00 H new ATOM 540 N LEU A 253 -13.389 -5.446 -1.985 1.00 0.00 N ATOM 541 CA LEU A 253 -12.658 -5.047 -0.806 1.00 0.00 C ATOM 542 C LEU A 253 -13.044 -3.634 -0.416 1.00 0.00 C ATOM 543 O LEU A 253 -13.015 -3.281 0.762 1.00 0.00 O ATOM 544 CB LEU A 253 -11.147 -5.142 -1.027 1.00 0.00 C ATOM 545 CG LEU A 253 -10.619 -6.433 -1.682 1.00 0.00 C ATOM 546 CD1 LEU A 253 -9.109 -6.418 -1.767 1.00 0.00 C ATOM 547 CD2 LEU A 253 -11.085 -7.675 -0.959 1.00 0.00 C ATOM 0 H LEU A 253 -12.830 -5.475 -2.838 1.00 0.00 H new ATOM 0 HA LEU A 253 -12.918 -5.729 0.003 1.00 0.00 H new ATOM 0 HB2 LEU A 253 -10.841 -4.298 -1.645 1.00 0.00 H new ATOM 0 HB3 LEU A 253 -10.655 -5.025 -0.062 1.00 0.00 H new ATOM 0 HG LEU A 253 -11.032 -6.463 -2.690 1.00 0.00 H new ATOM 0 HD11 LEU A 253 -8.762 -7.340 -2.233 1.00 0.00 H new ATOM 0 HD12 LEU A 253 -8.787 -5.565 -2.365 1.00 0.00 H new ATOM 0 HD13 LEU A 253 -8.689 -6.338 -0.764 1.00 0.00 H new ATOM 0 HD21 LEU A 253 -10.687 -8.558 -1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 253 -10.731 -7.651 0.072 1.00 0.00 H new ATOM 0 HD23 LEU A 253 -12.174 -7.714 -0.967 1.00 0.00 H new ATOM 559 N LEU A 254 -13.418 -2.833 -1.399 1.00 0.00 N ATOM 560 CA LEU A 254 -13.873 -1.463 -1.142 1.00 0.00 C ATOM 561 C LEU A 254 -15.064 -1.452 -0.223 1.00 0.00 C ATOM 562 O LEU A 254 -15.076 -0.755 0.780 1.00 0.00 O ATOM 563 CB LEU A 254 -14.232 -0.688 -2.421 1.00 0.00 C ATOM 564 CG LEU A 254 -13.096 -0.144 -3.305 1.00 0.00 C ATOM 565 CD1 LEU A 254 -13.339 1.328 -3.540 1.00 0.00 C ATOM 566 CD2 LEU A 254 -11.725 -0.348 -2.683 1.00 0.00 C ATOM 0 H LEU A 254 -13.418 -3.100 -2.383 1.00 0.00 H new ATOM 0 HA LEU A 254 -13.026 -0.962 -0.673 1.00 0.00 H new ATOM 0 HB2 LEU A 254 -14.847 -1.341 -3.040 1.00 0.00 H new ATOM 0 HB3 LEU A 254 -14.856 0.157 -2.130 1.00 0.00 H new ATOM 0 HG LEU A 254 -13.100 -0.696 -4.245 1.00 0.00 H new ATOM 0 HD11 LEU A 254 -12.543 1.733 -4.165 1.00 0.00 H new ATOM 0 HD12 LEU A 254 -14.298 1.463 -4.040 1.00 0.00 H new ATOM 0 HD13 LEU A 254 -13.351 1.852 -2.584 1.00 0.00 H new ATOM 0 HD21 LEU A 254 -10.960 0.054 -3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 254 -11.680 0.169 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU A 254 -11.550 -1.413 -2.530 1.00 0.00 H new ATOM 578 N THR A 255 -16.034 -2.256 -0.546 1.00 0.00 N ATOM 579 CA THR A 255 -17.242 -2.330 0.240 1.00 0.00 C ATOM 580 C THR A 255 -16.984 -3.063 1.581 1.00 0.00 C ATOM 581 O THR A 255 -17.667 -2.809 2.579 1.00 0.00 O ATOM 582 CB THR A 255 -18.427 -2.980 -0.571 1.00 0.00 C ATOM 583 OG1 THR A 255 -19.662 -2.901 0.159 1.00 0.00 O ATOM 584 CG2 THR A 255 -18.153 -4.434 -0.914 1.00 0.00 C ATOM 0 H THR A 255 -16.016 -2.877 -1.355 1.00 0.00 H new ATOM 0 HA THR A 255 -17.549 -1.311 0.477 1.00 0.00 H new ATOM 0 HB THR A 255 -18.511 -2.411 -1.497 1.00 0.00 H new ATOM 0 HG1 THR A 255 -20.380 -3.310 -0.368 1.00 0.00 H new ATOM 0 HG21 THR A 255 -18.996 -4.841 -1.473 1.00 0.00 H new ATOM 0 HG22 THR A 255 -17.250 -4.501 -1.520 1.00 0.00 H new ATOM 0 HG23 THR A 255 -18.017 -5.005 0.004 1.00 0.00 H new ATOM 592 N THR A 256 -15.977 -3.922 1.607 1.00 0.00 N ATOM 593 CA THR A 256 -15.660 -4.685 2.794 1.00 0.00 C ATOM 594 C THR A 256 -14.811 -3.891 3.816 1.00 0.00 C ATOM 595 O THR A 256 -15.182 -3.761 4.990 1.00 0.00 O ATOM 596 CB THR A 256 -14.955 -5.994 2.407 1.00 0.00 C ATOM 597 OG1 THR A 256 -15.816 -6.719 1.510 1.00 0.00 O ATOM 598 CG2 THR A 256 -14.663 -6.851 3.634 1.00 0.00 C ATOM 0 H THR A 256 -15.365 -4.106 0.812 1.00 0.00 H new ATOM 0 HA THR A 256 -16.605 -4.911 3.288 1.00 0.00 H new ATOM 0 HB THR A 256 -14.003 -5.759 1.931 1.00 0.00 H new ATOM 0 HG1 THR A 256 -15.574 -6.510 0.584 1.00 0.00 H new ATOM 0 HG21 THR A 256 -14.164 -7.770 3.326 1.00 0.00 H new ATOM 0 HG22 THR A 256 -14.018 -6.299 4.318 1.00 0.00 H new ATOM 0 HG23 THR A 256 -15.598 -7.097 4.137 1.00 0.00 H new ATOM 606 N PHE A 257 -13.707 -3.348 3.372 1.00 0.00 N ATOM 607 CA PHE A 257 -12.793 -2.674 4.261 1.00 0.00 C ATOM 608 C PHE A 257 -13.097 -1.209 4.293 1.00 0.00 C ATOM 609 O PHE A 257 -13.291 -0.636 5.348 1.00 0.00 O ATOM 610 CB PHE A 257 -11.357 -2.933 3.824 1.00 0.00 C ATOM 611 CG PHE A 257 -11.049 -4.394 3.765 1.00 0.00 C ATOM 612 CD1 PHE A 257 -10.590 -5.061 4.873 1.00 0.00 C ATOM 613 CD2 PHE A 257 -11.250 -5.104 2.604 1.00 0.00 C ATOM 614 CE1 PHE A 257 -10.342 -6.408 4.822 1.00 0.00 C ATOM 615 CE2 PHE A 257 -11.000 -6.449 2.550 1.00 0.00 C ATOM 616 CZ PHE A 257 -10.543 -7.103 3.660 1.00 0.00 C ATOM 0 H PHE A 257 -13.417 -3.359 2.394 1.00 0.00 H new ATOM 0 HA PHE A 257 -12.914 -3.065 5.271 1.00 0.00 H new ATOM 0 HB2 PHE A 257 -11.189 -2.486 2.844 1.00 0.00 H new ATOM 0 HB3 PHE A 257 -10.672 -2.445 4.518 1.00 0.00 H new ATOM 0 HD1 PHE A 257 -10.423 -4.520 5.793 1.00 0.00 H new ATOM 0 HD2 PHE A 257 -11.610 -4.593 1.723 1.00 0.00 H new ATOM 0 HE1 PHE A 257 -9.987 -6.923 5.702 1.00 0.00 H new ATOM 0 HE2 PHE A 257 -11.164 -6.993 1.631 1.00 0.00 H new ATOM 0 HZ PHE A 257 -10.341 -8.163 3.620 1.00 0.00 H new ATOM 626 N GLY A 258 -13.142 -0.615 3.131 1.00 0.00 N ATOM 627 CA GLY A 258 -13.508 0.777 3.023 1.00 0.00 C ATOM 628 C GLY A 258 -12.400 1.769 3.337 1.00 0.00 C ATOM 629 O GLY A 258 -12.605 2.979 3.183 1.00 0.00 O ATOM 0 H GLY A 258 -12.930 -1.071 2.244 1.00 0.00 H new ATOM 0 HA2 GLY A 258 -13.863 0.964 2.010 1.00 0.00 H new ATOM 0 HA3 GLY A 258 -14.345 0.968 3.695 1.00 0.00 H new ATOM 633 N SER A 259 -11.218 1.288 3.699 1.00 0.00 N ATOM 634 CA SER A 259 -10.127 2.177 4.089 1.00 0.00 C ATOM 635 C SER A 259 -8.835 1.456 3.786 1.00 0.00 C ATOM 636 O SER A 259 -8.774 0.232 3.970 1.00 0.00 O ATOM 637 CB SER A 259 -10.177 2.466 5.598 1.00 0.00 C ATOM 638 OG SER A 259 -11.506 2.627 6.070 1.00 0.00 O ATOM 0 H SER A 259 -10.989 0.295 3.731 1.00 0.00 H new ATOM 0 HA SER A 259 -10.207 3.121 3.549 1.00 0.00 H new ATOM 0 HB2 SER A 259 -9.698 1.650 6.138 1.00 0.00 H new ATOM 0 HB3 SER A 259 -9.605 3.369 5.812 1.00 0.00 H new ATOM 0 HG SER A 259 -11.588 3.490 6.528 1.00 0.00 H new ATOM 644 N LEU A 260 -7.806 2.179 3.353 1.00 0.00 N ATOM 645 CA LEU A 260 -6.552 1.541 2.972 1.00 0.00 C ATOM 646 C LEU A 260 -5.908 0.878 4.202 1.00 0.00 C ATOM 647 O LEU A 260 -5.362 -0.197 4.097 1.00 0.00 O ATOM 648 CB LEU A 260 -5.602 2.556 2.287 1.00 0.00 C ATOM 649 CG LEU A 260 -4.383 2.007 1.468 1.00 0.00 C ATOM 650 CD1 LEU A 260 -3.304 1.428 2.353 1.00 0.00 C ATOM 651 CD2 LEU A 260 -4.830 0.955 0.460 1.00 0.00 C ATOM 0 H LEU A 260 -7.815 3.195 3.258 1.00 0.00 H new ATOM 0 HA LEU A 260 -6.754 0.759 2.240 1.00 0.00 H new ATOM 0 HB2 LEU A 260 -6.202 3.170 1.616 1.00 0.00 H new ATOM 0 HB3 LEU A 260 -5.211 3.217 3.060 1.00 0.00 H new ATOM 0 HG LEU A 260 -3.961 2.862 0.940 1.00 0.00 H new ATOM 0 HD11 LEU A 260 -2.484 1.062 1.735 1.00 0.00 H new ATOM 0 HD12 LEU A 260 -2.934 2.200 3.028 1.00 0.00 H new ATOM 0 HD13 LEU A 260 -3.715 0.603 2.936 1.00 0.00 H new ATOM 0 HD21 LEU A 260 -3.965 0.591 -0.094 1.00 0.00 H new ATOM 0 HD22 LEU A 260 -5.300 0.124 0.986 1.00 0.00 H new ATOM 0 HD23 LEU A 260 -5.546 1.397 -0.234 1.00 0.00 H new ATOM 663 N GLU A 261 -6.025 1.523 5.356 1.00 0.00 N ATOM 664 CA GLU A 261 -5.515 1.011 6.640 1.00 0.00 C ATOM 665 C GLU A 261 -5.948 -0.453 6.880 1.00 0.00 C ATOM 666 O GLU A 261 -5.120 -1.319 7.117 1.00 0.00 O ATOM 667 CB GLU A 261 -6.033 1.899 7.769 1.00 0.00 C ATOM 668 CG GLU A 261 -5.512 1.558 9.149 1.00 0.00 C ATOM 669 CD GLU A 261 -6.242 2.329 10.228 1.00 0.00 C ATOM 670 OE1 GLU A 261 -7.418 2.019 10.511 1.00 0.00 O ATOM 671 OE2 GLU A 261 -5.663 3.264 10.813 1.00 0.00 O ATOM 0 H GLU A 261 -6.482 2.431 5.437 1.00 0.00 H new ATOM 0 HA GLU A 261 -4.426 1.032 6.614 1.00 0.00 H new ATOM 0 HB2 GLU A 261 -5.772 2.933 7.545 1.00 0.00 H new ATOM 0 HB3 GLU A 261 -7.121 1.841 7.785 1.00 0.00 H new ATOM 0 HG2 GLU A 261 -5.624 0.488 9.327 1.00 0.00 H new ATOM 0 HG3 GLU A 261 -4.446 1.780 9.201 1.00 0.00 H new ATOM 678 N GLN A 262 -7.242 -0.721 6.765 1.00 0.00 N ATOM 679 CA GLN A 262 -7.777 -2.078 6.968 1.00 0.00 C ATOM 680 C GLN A 262 -7.420 -2.950 5.797 1.00 0.00 C ATOM 681 O GLN A 262 -7.285 -4.145 5.941 1.00 0.00 O ATOM 682 CB GLN A 262 -9.315 -2.119 7.195 1.00 0.00 C ATOM 683 CG GLN A 262 -10.036 -0.785 7.168 1.00 0.00 C ATOM 684 CD GLN A 262 -9.864 0.079 8.442 1.00 0.00 C ATOM 685 OE1 GLN A 262 -8.755 -0.043 9.125 1.00 0.00 O flip ATOM 686 NE2 GLN A 262 -10.753 0.854 8.800 1.00 0.00 N flip ATOM 0 H GLN A 262 -7.948 -0.022 6.532 1.00 0.00 H new ATOM 0 HA GLN A 262 -7.317 -2.452 7.883 1.00 0.00 H new ATOM 0 HB2 GLN A 262 -9.756 -2.761 6.433 1.00 0.00 H new ATOM 0 HB3 GLN A 262 -9.506 -2.591 8.159 1.00 0.00 H new ATOM 0 HG2 GLN A 262 -9.681 -0.215 6.310 1.00 0.00 H new ATOM 0 HG3 GLN A 262 -11.099 -0.967 7.012 1.00 0.00 H new ATOM 0 HE21 GLN A 262 -11.610 0.934 8.253 1.00 0.00 H new ATOM 0 HE22 GLN A 262 -10.631 1.415 9.643 1.00 0.00 H new ATOM 695 N LEU A 263 -7.245 -2.326 4.652 1.00 0.00 N ATOM 696 CA LEU A 263 -6.940 -3.023 3.422 1.00 0.00 C ATOM 697 C LEU A 263 -5.600 -3.736 3.574 1.00 0.00 C ATOM 698 O LEU A 263 -5.473 -4.904 3.280 1.00 0.00 O ATOM 699 CB LEU A 263 -6.852 -2.040 2.242 1.00 0.00 C ATOM 700 CG LEU A 263 -7.855 -2.168 1.100 1.00 0.00 C ATOM 701 CD1 LEU A 263 -8.236 -3.596 0.803 1.00 0.00 C ATOM 702 CD2 LEU A 263 -9.049 -1.220 1.183 1.00 0.00 C ATOM 0 H LEU A 263 -7.311 -1.313 4.548 1.00 0.00 H new ATOM 0 HA LEU A 263 -7.736 -3.740 3.221 1.00 0.00 H new ATOM 0 HB2 LEU A 263 -6.939 -1.031 2.646 1.00 0.00 H new ATOM 0 HB3 LEU A 263 -5.853 -2.127 1.815 1.00 0.00 H new ATOM 0 HG LEU A 263 -7.310 -1.817 0.224 1.00 0.00 H new ATOM 0 HD11 LEU A 263 -8.952 -3.618 -0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 263 -7.346 -4.160 0.524 1.00 0.00 H new ATOM 0 HD13 LEU A 263 -8.686 -4.044 1.689 1.00 0.00 H new ATOM 0 HD21 LEU A 263 -9.705 -1.386 0.329 1.00 0.00 H new ATOM 0 HD22 LEU A 263 -9.599 -1.408 2.105 1.00 0.00 H new ATOM 0 HD23 LEU A 263 -8.696 -0.189 1.175 1.00 0.00 H new ATOM 714 N ILE A 264 -4.621 -3.001 4.071 1.00 0.00 N ATOM 715 CA ILE A 264 -3.302 -3.540 4.321 1.00 0.00 C ATOM 716 C ILE A 264 -3.298 -4.433 5.562 1.00 0.00 C ATOM 717 O ILE A 264 -2.639 -5.466 5.592 1.00 0.00 O ATOM 718 CB ILE A 264 -2.174 -2.401 4.357 1.00 0.00 C ATOM 719 CG1 ILE A 264 -0.856 -2.854 5.020 1.00 0.00 C ATOM 720 CG2 ILE A 264 -2.667 -1.137 5.035 1.00 0.00 C ATOM 721 CD1 ILE A 264 -0.875 -2.751 6.554 1.00 0.00 C ATOM 0 H ILE A 264 -4.721 -2.015 4.311 1.00 0.00 H new ATOM 0 HA ILE A 264 -3.039 -4.177 3.476 1.00 0.00 H new ATOM 0 HB ILE A 264 -1.960 -2.192 3.309 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -0.651 -3.886 4.735 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -0.037 -2.248 4.633 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -1.872 -0.392 5.038 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -3.529 -0.746 4.494 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -2.955 -1.363 6.061 1.00 0.00 H new ATOM 0 HD11 ILE A 264 0.083 -3.085 6.953 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -1.049 -1.716 6.847 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -1.673 -3.379 6.951 1.00 0.00 H new ATOM 733 N ALA A 265 -4.053 -4.035 6.578 1.00 0.00 N ATOM 734 CA ALA A 265 -4.122 -4.787 7.834 1.00 0.00 C ATOM 735 C ALA A 265 -4.889 -6.103 7.671 1.00 0.00 C ATOM 736 O ALA A 265 -4.972 -6.919 8.609 1.00 0.00 O ATOM 737 CB ALA A 265 -4.760 -3.933 8.913 1.00 0.00 C ATOM 0 H ALA A 265 -4.629 -3.194 6.561 1.00 0.00 H new ATOM 0 HA ALA A 265 -3.103 -5.040 8.128 1.00 0.00 H new ATOM 0 HB1 ALA A 265 -4.808 -4.498 9.844 1.00 0.00 H new ATOM 0 HB2 ALA A 265 -4.163 -3.034 9.065 1.00 0.00 H new ATOM 0 HB3 ALA A 265 -5.768 -3.652 8.607 1.00 0.00 H new ATOM 743 N ALA A 266 -5.473 -6.283 6.519 1.00 0.00 N ATOM 744 CA ALA A 266 -6.199 -7.484 6.204 1.00 0.00 C ATOM 745 C ALA A 266 -5.264 -8.653 5.930 1.00 0.00 C ATOM 746 O ALA A 266 -4.424 -8.593 5.046 1.00 0.00 O ATOM 747 CB ALA A 266 -7.105 -7.252 5.021 1.00 0.00 C ATOM 0 H ALA A 266 -5.459 -5.595 5.766 1.00 0.00 H new ATOM 0 HA ALA A 266 -6.804 -7.741 7.074 1.00 0.00 H new ATOM 0 HB1 ALA A 266 -7.648 -8.169 4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 266 -7.815 -6.459 5.256 1.00 0.00 H new ATOM 0 HB3 ALA A 266 -6.508 -6.960 4.157 1.00 0.00 H new ATOM 753 N SER A 267 -5.410 -9.701 6.704 1.00 0.00 N ATOM 754 CA SER A 267 -4.645 -10.902 6.499 1.00 0.00 C ATOM 755 C SER A 267 -5.465 -11.834 5.577 1.00 0.00 C ATOM 756 O SER A 267 -6.579 -11.482 5.187 1.00 0.00 O ATOM 757 CB SER A 267 -4.350 -11.562 7.855 1.00 0.00 C ATOM 758 OG SER A 267 -3.482 -12.682 7.729 1.00 0.00 O ATOM 0 H SER A 267 -6.060 -9.743 7.489 1.00 0.00 H new ATOM 0 HA SER A 267 -3.687 -10.685 6.027 1.00 0.00 H new ATOM 0 HB2 SER A 267 -3.900 -10.829 8.524 1.00 0.00 H new ATOM 0 HB3 SER A 267 -5.286 -11.880 8.314 1.00 0.00 H new ATOM 0 HG SER A 267 -2.849 -12.525 6.997 1.00 0.00 H new ATOM 764 N ARG A 268 -4.951 -13.024 5.286 1.00 0.00 N ATOM 765 CA ARG A 268 -5.590 -13.978 4.343 1.00 0.00 C ATOM 766 C ARG A 268 -7.037 -14.266 4.703 1.00 0.00 C ATOM 767 O ARG A 268 -7.901 -14.332 3.828 1.00 0.00 O ATOM 768 CB ARG A 268 -4.800 -15.279 4.264 1.00 0.00 C ATOM 769 CG ARG A 268 -3.416 -15.089 3.716 1.00 0.00 C ATOM 770 CD ARG A 268 -2.593 -16.356 3.724 1.00 0.00 C ATOM 771 NE ARG A 268 -2.369 -16.873 5.065 1.00 0.00 N ATOM 772 CZ ARG A 268 -1.241 -17.432 5.492 1.00 0.00 C ATOM 773 NH1 ARG A 268 -0.178 -17.510 4.683 1.00 0.00 N ATOM 774 NH2 ARG A 268 -1.177 -17.912 6.724 1.00 0.00 N ATOM 0 H ARG A 268 -4.080 -13.369 5.689 1.00 0.00 H new ATOM 0 HA ARG A 268 -5.585 -13.499 3.364 1.00 0.00 H new ATOM 0 HB2 ARG A 268 -4.734 -15.719 5.259 1.00 0.00 H new ATOM 0 HB3 ARG A 268 -5.340 -15.988 3.637 1.00 0.00 H new ATOM 0 HG2 ARG A 268 -3.485 -14.715 2.695 1.00 0.00 H new ATOM 0 HG3 ARG A 268 -2.902 -14.326 4.301 1.00 0.00 H new ATOM 0 HD2 ARG A 268 -3.097 -17.115 3.126 1.00 0.00 H new ATOM 0 HD3 ARG A 268 -1.631 -16.162 3.249 1.00 0.00 H new ATOM 0 HE ARG A 268 -3.139 -16.801 5.731 1.00 0.00 H new ATOM 0 HH11 ARG A 268 -0.231 -17.140 3.734 1.00 0.00 H new ATOM 0 HH12 ARG A 268 0.685 -17.940 5.015 1.00 0.00 H new ATOM 0 HH21 ARG A 268 -1.989 -17.851 7.338 1.00 0.00 H new ATOM 0 HH22 ARG A 268 -0.315 -18.343 7.059 1.00 0.00 H new ATOM 788 N GLU A 269 -7.297 -14.411 5.978 1.00 0.00 N ATOM 789 CA GLU A 269 -8.640 -14.634 6.469 1.00 0.00 C ATOM 790 C GLU A 269 -9.518 -13.420 6.241 1.00 0.00 C ATOM 791 O GLU A 269 -10.679 -13.550 5.836 1.00 0.00 O ATOM 792 CB GLU A 269 -8.606 -14.986 7.951 1.00 0.00 C ATOM 793 CG GLU A 269 -9.960 -14.909 8.637 1.00 0.00 C ATOM 794 CD GLU A 269 -9.891 -15.299 10.082 1.00 0.00 C ATOM 795 OE1 GLU A 269 -9.577 -14.443 10.930 1.00 0.00 O ATOM 796 OE2 GLU A 269 -10.141 -16.475 10.402 1.00 0.00 O ATOM 0 H GLU A 269 -6.585 -14.378 6.708 1.00 0.00 H new ATOM 0 HA GLU A 269 -9.067 -15.468 5.913 1.00 0.00 H new ATOM 0 HB2 GLU A 269 -8.209 -15.995 8.065 1.00 0.00 H new ATOM 0 HB3 GLU A 269 -7.915 -14.313 8.458 1.00 0.00 H new ATOM 0 HG2 GLU A 269 -10.348 -13.894 8.556 1.00 0.00 H new ATOM 0 HG3 GLU A 269 -10.664 -15.562 8.120 1.00 0.00 H new ATOM 803 N ASP A 270 -8.949 -12.259 6.437 1.00 0.00 N ATOM 804 CA ASP A 270 -9.699 -11.020 6.377 1.00 0.00 C ATOM 805 C ASP A 270 -10.055 -10.698 4.933 1.00 0.00 C ATOM 806 O ASP A 270 -11.090 -10.135 4.653 1.00 0.00 O ATOM 807 CB ASP A 270 -8.925 -9.896 7.055 1.00 0.00 C ATOM 808 CG ASP A 270 -9.795 -8.718 7.475 1.00 0.00 C ATOM 809 OD1 ASP A 270 -10.952 -8.931 7.888 1.00 0.00 O ATOM 810 OD2 ASP A 270 -9.292 -7.582 7.527 1.00 0.00 O ATOM 0 H ASP A 270 -7.957 -12.140 6.642 1.00 0.00 H new ATOM 0 HA ASP A 270 -10.635 -11.132 6.924 1.00 0.00 H new ATOM 0 HB2 ASP A 270 -8.420 -10.294 7.935 1.00 0.00 H new ATOM 0 HB3 ASP A 270 -8.150 -9.540 6.376 1.00 0.00 H new ATOM 815 N LEU A 271 -9.199 -11.100 4.009 1.00 0.00 N ATOM 816 CA LEU A 271 -9.541 -10.988 2.604 1.00 0.00 C ATOM 817 C LEU A 271 -10.604 -12.032 2.230 1.00 0.00 C ATOM 818 O LEU A 271 -11.557 -11.740 1.547 1.00 0.00 O ATOM 819 CB LEU A 271 -8.321 -11.128 1.649 1.00 0.00 C ATOM 820 CG LEU A 271 -7.340 -9.945 1.481 1.00 0.00 C ATOM 821 CD1 LEU A 271 -8.056 -8.637 1.217 1.00 0.00 C ATOM 822 CD2 LEU A 271 -6.365 -9.831 2.618 1.00 0.00 C ATOM 0 H LEU A 271 -8.280 -11.499 4.201 1.00 0.00 H new ATOM 0 HA LEU A 271 -9.932 -9.979 2.471 1.00 0.00 H new ATOM 0 HB2 LEU A 271 -7.741 -11.987 1.986 1.00 0.00 H new ATOM 0 HB3 LEU A 271 -8.708 -11.373 0.660 1.00 0.00 H new ATOM 0 HG LEU A 271 -6.751 -10.169 0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 271 -7.324 -7.837 1.106 1.00 0.00 H new ATOM 0 HD12 LEU A 271 -8.642 -8.721 0.302 1.00 0.00 H new ATOM 0 HD13 LEU A 271 -8.718 -8.410 2.052 1.00 0.00 H new ATOM 0 HD21 LEU A 271 -5.702 -8.983 2.445 1.00 0.00 H new ATOM 0 HD22 LEU A 271 -6.909 -9.682 3.550 1.00 0.00 H new ATOM 0 HD23 LEU A 271 -5.775 -10.745 2.685 1.00 0.00 H new ATOM 834 N ALA A 272 -10.465 -13.231 2.747 1.00 0.00 N ATOM 835 CA ALA A 272 -11.322 -14.340 2.347 1.00 0.00 C ATOM 836 C ALA A 272 -12.735 -14.244 2.920 1.00 0.00 C ATOM 837 O ALA A 272 -13.664 -14.844 2.384 1.00 0.00 O ATOM 838 CB ALA A 272 -10.685 -15.662 2.710 1.00 0.00 C ATOM 0 H ALA A 272 -9.765 -13.471 3.449 1.00 0.00 H new ATOM 0 HA ALA A 272 -11.425 -14.278 1.264 1.00 0.00 H new ATOM 0 HB1 ALA A 272 -11.340 -16.478 2.403 1.00 0.00 H new ATOM 0 HB2 ALA A 272 -9.726 -15.756 2.201 1.00 0.00 H new ATOM 0 HB3 ALA A 272 -10.529 -15.707 3.788 1.00 0.00 H new ATOM 844 N LEU A 273 -12.898 -13.528 4.020 1.00 0.00 N ATOM 845 CA LEU A 273 -14.226 -13.325 4.603 1.00 0.00 C ATOM 846 C LEU A 273 -15.100 -12.362 3.781 1.00 0.00 C ATOM 847 O LEU A 273 -16.289 -12.175 4.080 1.00 0.00 O ATOM 848 CB LEU A 273 -14.120 -12.916 6.084 1.00 0.00 C ATOM 849 CG LEU A 273 -13.257 -11.692 6.416 1.00 0.00 C ATOM 850 CD1 LEU A 273 -13.916 -10.393 5.996 1.00 0.00 C ATOM 851 CD2 LEU A 273 -12.883 -11.677 7.885 1.00 0.00 C ATOM 0 H LEU A 273 -12.137 -13.078 4.529 1.00 0.00 H new ATOM 0 HA LEU A 273 -14.745 -14.283 4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 273 -15.128 -12.729 6.455 1.00 0.00 H new ATOM 0 HB3 LEU A 273 -13.728 -13.767 6.642 1.00 0.00 H new ATOM 0 HG LEU A 273 -12.339 -11.776 5.834 1.00 0.00 H new ATOM 0 HD11 LEU A 273 -13.266 -9.556 6.252 1.00 0.00 H new ATOM 0 HD12 LEU A 273 -14.087 -10.403 4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 273 -14.869 -10.284 6.514 1.00 0.00 H new ATOM 0 HD21 LEU A 273 -12.271 -10.800 8.096 1.00 0.00 H new ATOM 0 HD22 LEU A 273 -13.789 -11.642 8.491 1.00 0.00 H new ATOM 0 HD23 LEU A 273 -12.320 -12.579 8.126 1.00 0.00 H new ATOM 863 N CYS A 274 -14.499 -11.745 2.778 1.00 0.00 N ATOM 864 CA CYS A 274 -15.195 -10.855 1.849 1.00 0.00 C ATOM 865 C CYS A 274 -16.405 -11.544 1.170 1.00 0.00 C ATOM 866 O CYS A 274 -16.460 -12.774 1.083 1.00 0.00 O ATOM 867 CB CYS A 274 -14.210 -10.314 0.812 1.00 0.00 C ATOM 868 SG CYS A 274 -13.005 -9.181 1.503 1.00 0.00 S ATOM 0 H CYS A 274 -13.504 -11.845 2.579 1.00 0.00 H new ATOM 0 HA CYS A 274 -15.599 -10.021 2.423 1.00 0.00 H new ATOM 0 HB2 CYS A 274 -13.688 -11.150 0.347 1.00 0.00 H new ATOM 0 HB3 CYS A 274 -14.766 -9.806 0.023 1.00 0.00 H new ATOM 0 HG CYS A 274 -11.864 -9.789 1.636 1.00 0.00 H new ATOM 874 N PRO A 275 -17.378 -10.748 0.656 1.00 0.00 N ATOM 875 CA PRO A 275 -18.646 -11.252 0.066 1.00 0.00 C ATOM 876 C PRO A 275 -18.491 -11.947 -1.298 1.00 0.00 C ATOM 877 O PRO A 275 -19.476 -12.158 -2.020 1.00 0.00 O ATOM 878 CB PRO A 275 -19.450 -9.972 -0.109 1.00 0.00 C ATOM 879 CG PRO A 275 -18.425 -8.940 -0.336 1.00 0.00 C ATOM 880 CD PRO A 275 -17.349 -9.273 0.627 1.00 0.00 C ATOM 0 HA PRO A 275 -19.093 -12.017 0.701 1.00 0.00 H new ATOM 0 HB2 PRO A 275 -20.138 -10.044 -0.951 1.00 0.00 H new ATOM 0 HB3 PRO A 275 -20.050 -9.753 0.774 1.00 0.00 H new ATOM 0 HG2 PRO A 275 -18.060 -8.961 -1.363 1.00 0.00 H new ATOM 0 HG3 PRO A 275 -18.821 -7.940 -0.159 1.00 0.00 H new ATOM 0 HD2 PRO A 275 -16.381 -8.894 0.298 1.00 0.00 H new ATOM 0 HD3 PRO A 275 -17.541 -8.846 1.611 1.00 0.00 H new ATOM 888 N GLY A 276 -17.291 -12.289 -1.634 1.00 0.00 N ATOM 889 CA GLY A 276 -17.033 -12.951 -2.869 1.00 0.00 C ATOM 890 C GLY A 276 -15.623 -12.755 -3.319 1.00 0.00 C ATOM 891 O GLY A 276 -15.373 -12.038 -4.289 1.00 0.00 O ATOM 0 H GLY A 276 -16.464 -12.118 -1.062 1.00 0.00 H new ATOM 0 HA2 GLY A 276 -17.235 -14.017 -2.759 1.00 0.00 H new ATOM 0 HA3 GLY A 276 -17.714 -12.575 -3.632 1.00 0.00 H new ATOM 895 N LEU A 277 -14.698 -13.346 -2.600 1.00 0.00 N ATOM 896 CA LEU A 277 -13.304 -13.285 -2.968 1.00 0.00 C ATOM 897 C LEU A 277 -12.710 -14.670 -3.245 1.00 0.00 C ATOM 898 O LEU A 277 -12.774 -15.150 -4.379 1.00 0.00 O ATOM 899 CB LEU A 277 -12.461 -12.462 -1.968 1.00 0.00 C ATOM 900 CG LEU A 277 -10.932 -12.466 -2.188 1.00 0.00 C ATOM 901 CD1 LEU A 277 -10.585 -12.164 -3.618 1.00 0.00 C ATOM 902 CD2 LEU A 277 -10.269 -11.464 -1.291 1.00 0.00 C ATOM 0 H LEU A 277 -14.888 -13.878 -1.751 1.00 0.00 H new ATOM 0 HA LEU A 277 -13.261 -12.743 -3.913 1.00 0.00 H new ATOM 0 HB2 LEU A 277 -12.807 -11.429 -1.999 1.00 0.00 H new ATOM 0 HB3 LEU A 277 -12.662 -12.836 -0.964 1.00 0.00 H new ATOM 0 HG LEU A 277 -10.569 -13.465 -1.946 1.00 0.00 H new ATOM 0 HD11 LEU A 277 -9.502 -12.174 -3.740 1.00 0.00 H new ATOM 0 HD12 LEU A 277 -11.030 -12.918 -4.267 1.00 0.00 H new ATOM 0 HD13 LEU A 277 -10.971 -11.180 -3.886 1.00 0.00 H new ATOM 0 HD21 LEU A 277 -9.192 -11.481 -1.460 1.00 0.00 H new ATOM 0 HD22 LEU A 277 -10.655 -10.468 -1.510 1.00 0.00 H new ATOM 0 HD23 LEU A 277 -10.477 -11.713 -0.251 1.00 0.00 H new ATOM 914 N GLY A 278 -12.163 -15.312 -2.238 1.00 0.00 N ATOM 915 CA GLY A 278 -11.540 -16.599 -2.448 1.00 0.00 C ATOM 916 C GLY A 278 -10.098 -16.613 -1.951 1.00 0.00 C ATOM 917 O GLY A 278 -9.344 -15.646 -2.190 1.00 0.00 O ATOM 0 H GLY A 278 -12.136 -14.970 -1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 278 -12.111 -17.369 -1.930 1.00 0.00 H new ATOM 0 HA3 GLY A 278 -11.562 -16.846 -3.510 1.00 0.00 H new ATOM 921 N PRO A 279 -9.683 -17.697 -1.272 1.00 0.00 N ATOM 922 CA PRO A 279 -8.352 -17.818 -0.654 1.00 0.00 C ATOM 923 C PRO A 279 -7.155 -17.622 -1.606 1.00 0.00 C ATOM 924 O PRO A 279 -6.115 -17.139 -1.168 1.00 0.00 O ATOM 925 CB PRO A 279 -8.335 -19.219 -0.026 1.00 0.00 C ATOM 926 CG PRO A 279 -9.507 -19.940 -0.602 1.00 0.00 C ATOM 927 CD PRO A 279 -10.505 -18.897 -1.013 1.00 0.00 C ATOM 0 HA PRO A 279 -8.218 -17.011 0.067 1.00 0.00 H new ATOM 0 HB2 PRO A 279 -7.405 -19.739 -0.256 1.00 0.00 H new ATOM 0 HB3 PRO A 279 -8.407 -19.161 1.060 1.00 0.00 H new ATOM 0 HG2 PRO A 279 -9.206 -20.544 -1.458 1.00 0.00 H new ATOM 0 HG3 PRO A 279 -9.940 -20.620 0.131 1.00 0.00 H new ATOM 0 HD2 PRO A 279 -11.057 -19.202 -1.902 1.00 0.00 H new ATOM 0 HD3 PRO A 279 -11.239 -18.716 -0.228 1.00 0.00 H new ATOM 935 N GLN A 280 -7.298 -17.980 -2.891 1.00 0.00 N ATOM 936 CA GLN A 280 -6.204 -17.799 -3.875 1.00 0.00 C ATOM 937 C GLN A 280 -5.724 -16.324 -3.933 1.00 0.00 C ATOM 938 O GLN A 280 -4.532 -16.016 -3.784 1.00 0.00 O ATOM 939 CB GLN A 280 -6.643 -18.284 -5.282 1.00 0.00 C ATOM 940 CG GLN A 280 -7.923 -17.638 -5.812 1.00 0.00 C ATOM 941 CD GLN A 280 -8.310 -18.107 -7.194 1.00 0.00 C ATOM 942 OE1 GLN A 280 -9.028 -19.086 -7.347 1.00 0.00 O ATOM 943 NE2 GLN A 280 -7.857 -17.418 -8.202 1.00 0.00 N ATOM 0 H GLN A 280 -8.148 -18.392 -3.276 1.00 0.00 H new ATOM 0 HA GLN A 280 -5.363 -18.408 -3.544 1.00 0.00 H new ATOM 0 HB2 GLN A 280 -5.835 -18.088 -5.987 1.00 0.00 H new ATOM 0 HB3 GLN A 280 -6.784 -19.364 -5.251 1.00 0.00 H new ATOM 0 HG2 GLN A 280 -8.740 -17.852 -5.123 1.00 0.00 H new ATOM 0 HG3 GLN A 280 -7.794 -16.556 -5.828 1.00 0.00 H new ATOM 0 HE21 GLN A 280 -7.260 -16.607 -8.038 1.00 0.00 H new ATOM 0 HE22 GLN A 280 -8.099 -17.689 -9.155 1.00 0.00 H new ATOM 952 N LYS A 281 -6.668 -15.434 -4.108 1.00 0.00 N ATOM 953 CA LYS A 281 -6.411 -14.026 -4.199 1.00 0.00 C ATOM 954 C LYS A 281 -6.010 -13.456 -2.847 1.00 0.00 C ATOM 955 O LYS A 281 -5.097 -12.635 -2.764 1.00 0.00 O ATOM 956 CB LYS A 281 -7.633 -13.349 -4.783 1.00 0.00 C ATOM 957 CG LYS A 281 -7.813 -13.617 -6.274 1.00 0.00 C ATOM 958 CD LYS A 281 -9.215 -13.317 -6.767 1.00 0.00 C ATOM 959 CE LYS A 281 -10.184 -14.422 -6.375 1.00 0.00 C ATOM 960 NZ LYS A 281 -11.576 -14.111 -6.765 1.00 0.00 N ATOM 0 H LYS A 281 -7.655 -15.677 -4.192 1.00 0.00 H new ATOM 0 HA LYS A 281 -5.566 -13.839 -4.862 1.00 0.00 H new ATOM 0 HB2 LYS A 281 -8.520 -13.691 -4.249 1.00 0.00 H new ATOM 0 HB3 LYS A 281 -7.558 -12.274 -4.620 1.00 0.00 H new ATOM 0 HG2 LYS A 281 -7.100 -13.012 -6.834 1.00 0.00 H new ATOM 0 HG3 LYS A 281 -7.577 -14.661 -6.481 1.00 0.00 H new ATOM 0 HD2 LYS A 281 -9.554 -12.368 -6.352 1.00 0.00 H new ATOM 0 HD3 LYS A 281 -9.206 -13.205 -7.851 1.00 0.00 H new ATOM 0 HE2 LYS A 281 -9.877 -15.356 -6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 281 -10.137 -14.578 -5.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 281 -12.225 -14.428 -6.017 1.00 0.00 H new ATOM 0 HZ2 LYS A 281 -11.678 -13.085 -6.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 281 -11.806 -14.601 -7.653 1.00 0.00 H new ATOM 974 N ALA A 282 -6.673 -13.939 -1.800 1.00 0.00 N ATOM 975 CA ALA A 282 -6.381 -13.542 -0.425 1.00 0.00 C ATOM 976 C ALA A 282 -4.922 -13.838 -0.070 1.00 0.00 C ATOM 977 O ALA A 282 -4.242 -13.020 0.546 1.00 0.00 O ATOM 978 CB ALA A 282 -7.307 -14.280 0.527 1.00 0.00 C ATOM 0 H ALA A 282 -7.430 -14.618 -1.881 1.00 0.00 H new ATOM 0 HA ALA A 282 -6.544 -12.468 -0.331 1.00 0.00 H new ATOM 0 HB1 ALA A 282 -7.087 -13.982 1.552 1.00 0.00 H new ATOM 0 HB2 ALA A 282 -8.342 -14.034 0.292 1.00 0.00 H new ATOM 0 HB3 ALA A 282 -7.157 -15.354 0.421 1.00 0.00 H new ATOM 984 N ARG A 283 -4.459 -15.015 -0.477 1.00 0.00 N ATOM 985 CA ARG A 283 -3.080 -15.443 -0.282 1.00 0.00 C ATOM 986 C ARG A 283 -2.110 -14.487 -0.940 1.00 0.00 C ATOM 987 O ARG A 283 -1.133 -14.065 -0.330 1.00 0.00 O ATOM 988 CB ARG A 283 -2.853 -16.835 -0.872 1.00 0.00 C ATOM 989 CG ARG A 283 -2.607 -17.923 0.147 1.00 0.00 C ATOM 990 CD ARG A 283 -3.842 -18.272 0.951 1.00 0.00 C ATOM 991 NE ARG A 283 -3.524 -19.254 1.996 1.00 0.00 N ATOM 992 CZ ARG A 283 -4.348 -19.627 2.992 1.00 0.00 C ATOM 993 NH1 ARG A 283 -5.575 -19.120 3.077 1.00 0.00 N ATOM 994 NH2 ARG A 283 -3.936 -20.495 3.900 1.00 0.00 N ATOM 0 H ARG A 283 -5.037 -15.705 -0.956 1.00 0.00 H new ATOM 0 HA ARG A 283 -2.904 -15.460 0.793 1.00 0.00 H new ATOM 0 HB2 ARG A 283 -3.723 -17.107 -1.470 1.00 0.00 H new ATOM 0 HB3 ARG A 283 -2.001 -16.792 -1.550 1.00 0.00 H new ATOM 0 HG2 ARG A 283 -2.248 -18.817 -0.364 1.00 0.00 H new ATOM 0 HG3 ARG A 283 -1.816 -17.605 0.826 1.00 0.00 H new ATOM 0 HD2 ARG A 283 -4.252 -17.370 1.406 1.00 0.00 H new ATOM 0 HD3 ARG A 283 -4.610 -18.673 0.290 1.00 0.00 H new ATOM 0 HE ARG A 283 -2.602 -19.689 1.964 1.00 0.00 H new ATOM 0 HH11 ARG A 283 -5.897 -18.444 2.384 1.00 0.00 H new ATOM 0 HH12 ARG A 283 -6.194 -19.407 3.835 1.00 0.00 H new ATOM 0 HH21 ARG A 283 -2.994 -20.882 3.845 1.00 0.00 H new ATOM 0 HH22 ARG A 283 -4.560 -20.778 4.655 1.00 0.00 H new ATOM 1008 N ARG A 284 -2.396 -14.142 -2.172 1.00 0.00 N ATOM 1009 CA ARG A 284 -1.525 -13.282 -2.943 1.00 0.00 C ATOM 1010 C ARG A 284 -1.477 -11.858 -2.448 1.00 0.00 C ATOM 1011 O ARG A 284 -0.405 -11.243 -2.428 1.00 0.00 O ATOM 1012 CB ARG A 284 -1.833 -13.380 -4.410 1.00 0.00 C ATOM 1013 CG ARG A 284 -1.351 -14.702 -4.955 1.00 0.00 C ATOM 1014 CD ARG A 284 -1.600 -14.877 -6.423 1.00 0.00 C ATOM 1015 NE ARG A 284 -0.799 -16.002 -6.911 1.00 0.00 N ATOM 1016 CZ ARG A 284 -0.827 -16.526 -8.124 1.00 0.00 C ATOM 1017 NH1 ARG A 284 -1.773 -16.189 -8.977 1.00 0.00 N ATOM 1018 NH2 ARG A 284 0.074 -17.439 -8.457 1.00 0.00 N ATOM 0 H ARG A 284 -3.234 -14.446 -2.668 1.00 0.00 H new ATOM 0 HA ARG A 284 -0.512 -13.654 -2.792 1.00 0.00 H new ATOM 0 HB2 ARG A 284 -2.906 -13.281 -4.571 1.00 0.00 H new ATOM 0 HB3 ARG A 284 -1.353 -12.561 -4.946 1.00 0.00 H new ATOM 0 HG2 ARG A 284 -0.282 -14.796 -4.763 1.00 0.00 H new ATOM 0 HG3 ARG A 284 -1.844 -15.509 -4.413 1.00 0.00 H new ATOM 0 HD2 ARG A 284 -2.659 -15.061 -6.606 1.00 0.00 H new ATOM 0 HD3 ARG A 284 -1.337 -13.966 -6.961 1.00 0.00 H new ATOM 0 HE ARG A 284 -0.152 -16.425 -6.245 1.00 0.00 H new ATOM 0 HH11 ARG A 284 -2.491 -15.519 -8.703 1.00 0.00 H new ATOM 0 HH12 ARG A 284 -1.787 -16.598 -9.911 1.00 0.00 H new ATOM 0 HH21 ARG A 284 0.779 -17.730 -7.780 1.00 0.00 H new ATOM 0 HH22 ARG A 284 0.062 -17.850 -9.390 1.00 0.00 H new ATOM 1032 N LEU A 285 -2.603 -11.332 -2.040 1.00 0.00 N ATOM 1033 CA LEU A 285 -2.623 -10.008 -1.459 1.00 0.00 C ATOM 1034 C LEU A 285 -1.905 -10.003 -0.126 1.00 0.00 C ATOM 1035 O LEU A 285 -1.249 -9.045 0.202 1.00 0.00 O ATOM 1036 CB LEU A 285 -4.032 -9.467 -1.357 1.00 0.00 C ATOM 1037 CG LEU A 285 -4.439 -8.466 -2.449 1.00 0.00 C ATOM 1038 CD1 LEU A 285 -5.895 -8.129 -2.324 1.00 0.00 C ATOM 1039 CD2 LEU A 285 -3.621 -7.181 -2.346 1.00 0.00 C ATOM 0 H LEU A 285 -3.512 -11.792 -2.097 1.00 0.00 H new ATOM 0 HA LEU A 285 -2.083 -9.333 -2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 285 -4.727 -10.306 -1.381 1.00 0.00 H new ATOM 0 HB3 LEU A 285 -4.148 -8.985 -0.386 1.00 0.00 H new ATOM 0 HG LEU A 285 -4.248 -8.931 -3.416 1.00 0.00 H new ATOM 0 HD11 LEU A 285 -6.172 -7.419 -3.103 1.00 0.00 H new ATOM 0 HD12 LEU A 285 -6.489 -9.036 -2.432 1.00 0.00 H new ATOM 0 HD13 LEU A 285 -6.083 -7.686 -1.346 1.00 0.00 H new ATOM 0 HD21 LEU A 285 -3.929 -6.490 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 285 -3.787 -6.721 -1.372 1.00 0.00 H new ATOM 0 HD23 LEU A 285 -2.562 -7.413 -2.462 1.00 0.00 H new ATOM 1051 N PHE A 286 -1.997 -11.104 0.612 1.00 0.00 N ATOM 1052 CA PHE A 286 -1.233 -11.256 1.851 1.00 0.00 C ATOM 1053 C PHE A 286 0.252 -11.085 1.549 1.00 0.00 C ATOM 1054 O PHE A 286 0.962 -10.401 2.252 1.00 0.00 O ATOM 1055 CB PHE A 286 -1.482 -12.637 2.457 1.00 0.00 C ATOM 1056 CG PHE A 286 -0.723 -12.945 3.736 1.00 0.00 C ATOM 1057 CD1 PHE A 286 0.544 -13.513 3.694 1.00 0.00 C ATOM 1058 CD2 PHE A 286 -1.289 -12.689 4.969 1.00 0.00 C ATOM 1059 CE1 PHE A 286 1.225 -13.812 4.854 1.00 0.00 C ATOM 1060 CE2 PHE A 286 -0.610 -12.985 6.134 1.00 0.00 C ATOM 1061 CZ PHE A 286 0.647 -13.546 6.076 1.00 0.00 C ATOM 0 H PHE A 286 -2.588 -11.901 0.378 1.00 0.00 H new ATOM 0 HA PHE A 286 -1.552 -10.498 2.566 1.00 0.00 H new ATOM 0 HB2 PHE A 286 -2.549 -12.738 2.657 1.00 0.00 H new ATOM 0 HB3 PHE A 286 -1.224 -13.391 1.713 1.00 0.00 H new ATOM 0 HD1 PHE A 286 1.002 -13.723 2.739 1.00 0.00 H new ATOM 0 HD2 PHE A 286 -2.275 -12.252 5.023 1.00 0.00 H new ATOM 0 HE1 PHE A 286 2.209 -14.254 4.805 1.00 0.00 H new ATOM 0 HE2 PHE A 286 -1.064 -12.777 7.091 1.00 0.00 H new ATOM 0 HZ PHE A 286 1.179 -13.777 6.987 1.00 0.00 H new ATOM 1071 N ASP A 287 0.706 -11.689 0.476 1.00 0.00 N ATOM 1072 CA ASP A 287 2.097 -11.563 0.084 1.00 0.00 C ATOM 1073 C ASP A 287 2.458 -10.120 -0.177 1.00 0.00 C ATOM 1074 O ASP A 287 3.384 -9.631 0.398 1.00 0.00 O ATOM 1075 CB ASP A 287 2.472 -12.463 -1.108 1.00 0.00 C ATOM 1076 CG ASP A 287 2.691 -13.922 -0.731 1.00 0.00 C ATOM 1077 OD1 ASP A 287 3.831 -14.288 -0.413 1.00 0.00 O ATOM 1078 OD2 ASP A 287 1.742 -14.736 -0.768 1.00 0.00 O ATOM 0 H ASP A 287 0.139 -12.271 -0.141 1.00 0.00 H new ATOM 0 HA ASP A 287 2.690 -11.917 0.927 1.00 0.00 H new ATOM 0 HB2 ASP A 287 1.682 -12.406 -1.857 1.00 0.00 H new ATOM 0 HB3 ASP A 287 3.380 -12.077 -1.571 1.00 0.00 H new ATOM 1083 N VAL A 288 1.683 -9.408 -0.958 1.00 0.00 N ATOM 1084 CA VAL A 288 2.031 -8.028 -1.234 1.00 0.00 C ATOM 1085 C VAL A 288 1.908 -7.140 -0.008 1.00 0.00 C ATOM 1086 O VAL A 288 2.693 -6.242 0.161 1.00 0.00 O ATOM 1087 CB VAL A 288 1.274 -7.412 -2.421 1.00 0.00 C ATOM 1088 CG1 VAL A 288 1.575 -8.128 -3.697 1.00 0.00 C ATOM 1089 CG2 VAL A 288 -0.183 -7.360 -2.201 1.00 0.00 C ATOM 0 H VAL A 288 0.830 -9.744 -1.405 1.00 0.00 H new ATOM 0 HA VAL A 288 3.081 -8.071 -1.524 1.00 0.00 H new ATOM 0 HB VAL A 288 1.631 -6.385 -2.503 1.00 0.00 H new ATOM 0 HG11 VAL A 288 1.022 -7.664 -4.514 1.00 0.00 H new ATOM 0 HG12 VAL A 288 2.644 -8.070 -3.904 1.00 0.00 H new ATOM 0 HG13 VAL A 288 1.279 -9.173 -3.606 1.00 0.00 H new ATOM 0 HG21 VAL A 288 -0.667 -6.916 -3.071 1.00 0.00 H new ATOM 0 HG22 VAL A 288 -0.564 -8.370 -2.050 1.00 0.00 H new ATOM 0 HG23 VAL A 288 -0.396 -6.756 -1.319 1.00 0.00 H new ATOM 1099 N LEU A 289 0.937 -7.427 0.836 1.00 0.00 N ATOM 1100 CA LEU A 289 0.661 -6.644 2.031 1.00 0.00 C ATOM 1101 C LEU A 289 1.534 -7.019 3.232 1.00 0.00 C ATOM 1102 O LEU A 289 1.443 -6.389 4.293 1.00 0.00 O ATOM 1103 CB LEU A 289 -0.809 -6.755 2.380 1.00 0.00 C ATOM 1104 CG LEU A 289 -1.721 -6.199 1.296 1.00 0.00 C ATOM 1105 CD1 LEU A 289 -3.146 -6.552 1.531 1.00 0.00 C ATOM 1106 CD2 LEU A 289 -1.557 -4.707 1.171 1.00 0.00 C ATOM 0 H LEU A 289 0.308 -8.220 0.712 1.00 0.00 H new ATOM 0 HA LEU A 289 0.915 -5.610 1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 289 -1.057 -7.802 2.554 1.00 0.00 H new ATOM 0 HB3 LEU A 289 -0.996 -6.223 3.313 1.00 0.00 H new ATOM 0 HG LEU A 289 -1.422 -6.662 0.356 1.00 0.00 H new ATOM 0 HD11 LEU A 289 -3.761 -6.135 0.733 1.00 0.00 H new ATOM 0 HD12 LEU A 289 -3.255 -7.636 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A 289 -3.469 -6.144 2.489 1.00 0.00 H new ATOM 0 HD21 LEU A 289 -2.219 -4.332 0.390 1.00 0.00 H new ATOM 0 HD22 LEU A 289 -1.810 -4.232 2.119 1.00 0.00 H new ATOM 0 HD23 LEU A 289 -0.524 -4.475 0.913 1.00 0.00 H new ATOM 1118 N HIS A 290 2.351 -8.037 3.090 1.00 0.00 N ATOM 1119 CA HIS A 290 3.160 -8.511 4.217 1.00 0.00 C ATOM 1120 C HIS A 290 4.636 -8.758 3.871 1.00 0.00 C ATOM 1121 O HIS A 290 5.490 -8.812 4.767 1.00 0.00 O ATOM 1122 CB HIS A 290 2.551 -9.803 4.795 1.00 0.00 C ATOM 1123 CG HIS A 290 1.175 -9.625 5.428 1.00 0.00 C ATOM 1124 ND1 HIS A 290 -0.043 -9.492 4.849 1.00 0.00 N flip ATOM 1125 CD2 HIS A 290 0.939 -9.562 6.778 1.00 0.00 C flip ATOM 1126 CE1 HIS A 290 -1.009 -9.348 5.819 1.00 0.00 C flip ATOM 1127 NE2 HIS A 290 -0.377 -9.393 6.956 1.00 0.00 N flip ATOM 0 H HIS A 290 2.481 -8.555 2.221 1.00 0.00 H new ATOM 0 HA HIS A 290 3.143 -7.707 4.953 1.00 0.00 H new ATOM 0 HB2 HIS A 290 2.477 -10.543 3.998 1.00 0.00 H new ATOM 0 HB3 HIS A 290 3.232 -10.207 5.544 1.00 0.00 H new ATOM 0 HD1 HIS A 290 -0.218 -9.498 3.844 1.00 0.00 H new ATOM 0 HD2 HIS A 290 1.682 -9.636 7.558 1.00 0.00 H new ATOM 0 HE1 HIS A 290 -2.071 -9.223 5.668 1.00 0.00 H new ATOM 1135 N GLU A 291 4.938 -8.915 2.610 1.00 0.00 N ATOM 1136 CA GLU A 291 6.284 -9.268 2.184 1.00 0.00 C ATOM 1137 C GLU A 291 7.146 -8.000 2.123 1.00 0.00 C ATOM 1138 O GLU A 291 6.650 -6.933 1.762 1.00 0.00 O ATOM 1139 CB GLU A 291 6.191 -9.937 0.804 1.00 0.00 C ATOM 1140 CG GLU A 291 7.339 -10.816 0.379 1.00 0.00 C ATOM 1141 CD GLU A 291 7.544 -11.984 1.306 1.00 0.00 C ATOM 1142 OE1 GLU A 291 6.660 -12.858 1.381 1.00 0.00 O ATOM 1143 OE2 GLU A 291 8.595 -12.073 1.947 1.00 0.00 O ATOM 0 H GLU A 291 4.270 -8.805 1.847 1.00 0.00 H new ATOM 0 HA GLU A 291 6.746 -9.959 2.888 1.00 0.00 H new ATOM 0 HB2 GLU A 291 5.281 -10.537 0.782 1.00 0.00 H new ATOM 0 HB3 GLU A 291 6.074 -9.152 0.057 1.00 0.00 H new ATOM 0 HG2 GLU A 291 7.156 -11.185 -0.630 1.00 0.00 H new ATOM 0 HG3 GLU A 291 8.252 -10.222 0.340 1.00 0.00 H new ATOM 1150 N PRO A 292 8.435 -8.086 2.510 1.00 0.00 N ATOM 1151 CA PRO A 292 9.345 -6.953 2.458 1.00 0.00 C ATOM 1152 C PRO A 292 9.634 -6.553 1.024 1.00 0.00 C ATOM 1153 O PRO A 292 9.431 -7.340 0.098 1.00 0.00 O ATOM 1154 CB PRO A 292 10.624 -7.467 3.114 1.00 0.00 C ATOM 1155 CG PRO A 292 10.543 -8.943 2.982 1.00 0.00 C ATOM 1156 CD PRO A 292 9.093 -9.290 3.012 1.00 0.00 C ATOM 0 HA PRO A 292 8.930 -6.075 2.953 1.00 0.00 H new ATOM 0 HB2 PRO A 292 11.511 -7.072 2.618 1.00 0.00 H new ATOM 0 HB3 PRO A 292 10.683 -7.165 4.160 1.00 0.00 H new ATOM 0 HG2 PRO A 292 11.003 -9.275 2.051 1.00 0.00 H new ATOM 0 HG3 PRO A 292 11.077 -9.435 3.795 1.00 0.00 H new ATOM 0 HD2 PRO A 292 8.876 -10.155 2.385 1.00 0.00 H new ATOM 0 HD3 PRO A 292 8.761 -9.536 4.021 1.00 0.00 H new ATOM 1164 N PHE A 293 10.129 -5.363 0.831 1.00 0.00 N ATOM 1165 CA PHE A 293 10.395 -4.890 -0.507 1.00 0.00 C ATOM 1166 C PHE A 293 11.655 -5.501 -1.091 1.00 0.00 C ATOM 1167 O PHE A 293 11.670 -5.917 -2.231 1.00 0.00 O ATOM 1168 CB PHE A 293 10.504 -3.373 -0.551 1.00 0.00 C ATOM 1169 CG PHE A 293 9.289 -2.650 -0.112 1.00 0.00 C ATOM 1170 CD1 PHE A 293 8.163 -2.677 -0.877 1.00 0.00 C ATOM 1171 CD2 PHE A 293 9.280 -1.934 1.066 1.00 0.00 C ATOM 1172 CE1 PHE A 293 7.035 -2.012 -0.489 1.00 0.00 C ATOM 1173 CE2 PHE A 293 8.156 -1.262 1.457 1.00 0.00 C ATOM 1174 CZ PHE A 293 7.030 -1.305 0.671 1.00 0.00 C ATOM 0 H PHE A 293 10.357 -4.703 1.575 1.00 0.00 H new ATOM 0 HA PHE A 293 9.546 -5.205 -1.114 1.00 0.00 H new ATOM 0 HB2 PHE A 293 11.340 -3.065 0.077 1.00 0.00 H new ATOM 0 HB3 PHE A 293 10.742 -3.069 -1.570 1.00 0.00 H new ATOM 0 HD1 PHE A 293 8.162 -3.232 -1.803 1.00 0.00 H new ATOM 0 HD2 PHE A 293 10.166 -1.904 1.683 1.00 0.00 H new ATOM 0 HE1 PHE A 293 6.148 -2.048 -1.104 1.00 0.00 H new ATOM 0 HE2 PHE A 293 8.153 -0.700 2.379 1.00 0.00 H new ATOM 0 HZ PHE A 293 6.139 -0.776 0.976 1.00 0.00 H new ATOM 1184 N LEU A 294 12.696 -5.587 -0.304 1.00 0.00 N ATOM 1185 CA LEU A 294 13.998 -6.006 -0.827 1.00 0.00 C ATOM 1186 C LEU A 294 14.285 -7.445 -0.464 1.00 0.00 C ATOM 1187 O LEU A 294 15.404 -7.922 -0.673 1.00 0.00 O ATOM 1188 CB LEU A 294 15.106 -5.156 -0.199 1.00 0.00 C ATOM 1189 CG LEU A 294 14.789 -3.681 0.111 1.00 0.00 C ATOM 1190 CD1 LEU A 294 16.004 -2.999 0.677 1.00 0.00 C ATOM 1191 CD2 LEU A 294 14.291 -2.924 -1.104 1.00 0.00 C ATOM 0 H LEU A 294 12.683 -5.378 0.694 1.00 0.00 H new ATOM 0 HA LEU A 294 13.972 -5.887 -1.910 1.00 0.00 H new ATOM 0 HB2 LEU A 294 15.410 -5.636 0.731 1.00 0.00 H new ATOM 0 HB3 LEU A 294 15.967 -5.181 -0.867 1.00 0.00 H new ATOM 0 HG LEU A 294 13.985 -3.675 0.847 1.00 0.00 H new ATOM 0 HD11 LEU A 294 15.769 -1.957 0.893 1.00 0.00 H new ATOM 0 HD12 LEU A 294 16.307 -3.500 1.596 1.00 0.00 H new ATOM 0 HD13 LEU A 294 16.818 -3.045 -0.047 1.00 0.00 H new ATOM 0 HD21 LEU A 294 14.083 -1.890 -0.828 1.00 0.00 H new ATOM 0 HD22 LEU A 294 15.053 -2.946 -1.884 1.00 0.00 H new ATOM 0 HD23 LEU A 294 13.379 -3.391 -1.475 1.00 0.00 H new ATOM 1203 N LYS A 295 13.274 -8.135 0.051 1.00 0.00 N ATOM 1204 CA LYS A 295 13.456 -9.459 0.652 1.00 0.00 C ATOM 1205 C LYS A 295 14.277 -9.344 1.913 1.00 0.00 C ATOM 1206 O LYS A 295 13.736 -9.218 2.998 1.00 0.00 O ATOM 1207 CB LYS A 295 14.039 -10.531 -0.323 1.00 0.00 C ATOM 1208 CG LYS A 295 12.972 -11.288 -1.080 1.00 0.00 C ATOM 1209 CD LYS A 295 13.504 -12.287 -2.103 1.00 0.00 C ATOM 1210 CE LYS A 295 14.096 -11.601 -3.327 1.00 0.00 C ATOM 1211 NZ LYS A 295 14.381 -12.568 -4.409 1.00 0.00 N ATOM 0 H LYS A 295 12.311 -7.799 0.066 1.00 0.00 H new ATOM 0 HA LYS A 295 12.461 -9.827 0.901 1.00 0.00 H new ATOM 0 HB2 LYS A 295 14.704 -10.042 -1.035 1.00 0.00 H new ATOM 0 HB3 LYS A 295 14.644 -11.238 0.244 1.00 0.00 H new ATOM 0 HG2 LYS A 295 12.346 -11.820 -0.364 1.00 0.00 H new ATOM 0 HG3 LYS A 295 12.331 -10.571 -1.592 1.00 0.00 H new ATOM 0 HD2 LYS A 295 14.265 -12.912 -1.636 1.00 0.00 H new ATOM 0 HD3 LYS A 295 12.696 -12.949 -2.415 1.00 0.00 H new ATOM 0 HE2 LYS A 295 13.403 -10.842 -3.690 1.00 0.00 H new ATOM 0 HE3 LYS A 295 15.015 -11.086 -3.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 295 14.783 -12.066 -5.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 295 15.061 -13.278 -4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 295 13.499 -13.041 -4.693 1.00 0.00 H new ATOM 1488 N TYR B 833 14.424 -7.012 -5.907 1.00 0.00 N ATOM 1489 CA TYR B 833 13.334 -6.581 -5.042 1.00 0.00 C ATOM 1490 C TYR B 833 12.026 -7.288 -5.391 1.00 0.00 C ATOM 1491 O TYR B 833 11.780 -7.615 -6.558 1.00 0.00 O ATOM 1492 CB TYR B 833 13.163 -5.049 -5.078 1.00 0.00 C ATOM 1493 CG TYR B 833 14.372 -4.242 -4.592 1.00 0.00 C ATOM 1494 CD1 TYR B 833 15.475 -4.854 -3.991 1.00 0.00 C ATOM 1495 CD2 TYR B 833 14.408 -2.866 -4.752 1.00 0.00 C ATOM 1496 CE1 TYR B 833 16.566 -4.118 -3.569 1.00 0.00 C ATOM 1497 CE2 TYR B 833 15.502 -2.118 -4.337 1.00 0.00 C ATOM 1498 CZ TYR B 833 16.577 -2.752 -3.750 1.00 0.00 C ATOM 1499 OH TYR B 833 17.667 -2.026 -3.354 1.00 0.00 O ATOM 0 HA TYR B 833 13.598 -6.864 -4.023 1.00 0.00 H new ATOM 0 HB2 TYR B 833 12.935 -4.750 -6.101 1.00 0.00 H new ATOM 0 HB3 TYR B 833 12.300 -4.782 -4.468 1.00 0.00 H new ATOM 0 HD1 TYR B 833 15.475 -5.925 -3.853 1.00 0.00 H new ATOM 0 HD2 TYR B 833 13.568 -2.365 -5.209 1.00 0.00 H new ATOM 0 HE1 TYR B 833 17.405 -4.611 -3.100 1.00 0.00 H new ATOM 0 HE2 TYR B 833 15.511 -1.047 -4.473 1.00 0.00 H new ATOM 0 HH TYR B 833 17.394 -1.105 -3.161 1.00 0.00 H new ATOM 1509 N ASN B 834 11.214 -7.513 -4.371 1.00 0.00 N ATOM 1510 CA ASN B 834 9.928 -8.205 -4.483 1.00 0.00 C ATOM 1511 C ASN B 834 8.943 -7.331 -5.229 1.00 0.00 C ATOM 1512 O ASN B 834 8.479 -6.313 -4.698 1.00 0.00 O ATOM 1513 CB ASN B 834 9.383 -8.578 -3.081 1.00 0.00 C ATOM 1514 CG ASN B 834 10.198 -9.649 -2.401 1.00 0.00 C ATOM 1515 OD1 ASN B 834 10.773 -10.507 -3.051 1.00 0.00 O ATOM 1516 ND2 ASN B 834 10.261 -9.605 -1.088 1.00 0.00 N ATOM 0 H ASN B 834 11.430 -7.216 -3.419 1.00 0.00 H new ATOM 0 HA ASN B 834 10.070 -9.130 -5.041 1.00 0.00 H new ATOM 0 HB2 ASN B 834 9.368 -7.687 -2.454 1.00 0.00 H new ATOM 0 HB3 ASN B 834 8.352 -8.918 -3.176 1.00 0.00 H new ATOM 0 HD21 ASN B 834 10.804 -10.303 -0.580 1.00 0.00 H new ATOM 0 HD22 ASN B 834 9.767 -8.873 -0.578 1.00 0.00 H new ATOM 1523 N PRO B 835 8.591 -7.728 -6.468 1.00 0.00 N ATOM 1524 CA PRO B 835 7.786 -6.910 -7.378 1.00 0.00 C ATOM 1525 C PRO B 835 6.337 -6.721 -6.933 1.00 0.00 C ATOM 1526 O PRO B 835 5.646 -5.808 -7.416 1.00 0.00 O ATOM 1527 CB PRO B 835 7.853 -7.666 -8.705 1.00 0.00 C ATOM 1528 CG PRO B 835 8.130 -9.074 -8.327 1.00 0.00 C ATOM 1529 CD PRO B 835 8.961 -9.024 -7.083 1.00 0.00 C ATOM 0 HA PRO B 835 8.175 -5.893 -7.427 1.00 0.00 H new ATOM 0 HB2 PRO B 835 6.916 -7.582 -9.256 1.00 0.00 H new ATOM 0 HB3 PRO B 835 8.638 -7.267 -9.348 1.00 0.00 H new ATOM 0 HG2 PRO B 835 7.202 -9.619 -8.152 1.00 0.00 H new ATOM 0 HG3 PRO B 835 8.659 -9.593 -9.126 1.00 0.00 H new ATOM 0 HD2 PRO B 835 8.740 -9.860 -6.420 1.00 0.00 H new ATOM 0 HD3 PRO B 835 10.026 -9.070 -7.310 1.00 0.00 H new ATOM 1537 N GLY B 836 5.880 -7.561 -6.033 1.00 0.00 N ATOM 1538 CA GLY B 836 4.531 -7.452 -5.553 1.00 0.00 C ATOM 1539 C GLY B 836 4.344 -6.318 -4.543 1.00 0.00 C ATOM 1540 O GLY B 836 3.678 -5.326 -4.861 1.00 0.00 O ATOM 0 H GLY B 836 6.422 -8.321 -5.623 1.00 0.00 H new ATOM 0 HA2 GLY B 836 3.862 -7.291 -6.399 1.00 0.00 H new ATOM 0 HA3 GLY B 836 4.239 -8.395 -5.090 1.00 0.00 H new ATOM 1544 N PRO B 837 4.955 -6.401 -3.331 1.00 0.00 N ATOM 1545 CA PRO B 837 4.812 -5.358 -2.302 1.00 0.00 C ATOM 1546 C PRO B 837 5.334 -4.011 -2.771 1.00 0.00 C ATOM 1547 O PRO B 837 4.772 -2.954 -2.424 1.00 0.00 O ATOM 1548 CB PRO B 837 5.676 -5.858 -1.142 1.00 0.00 C ATOM 1549 CG PRO B 837 6.569 -6.883 -1.743 1.00 0.00 C ATOM 1550 CD PRO B 837 5.774 -7.521 -2.839 1.00 0.00 C ATOM 0 HA PRO B 837 3.765 -5.203 -2.042 1.00 0.00 H new ATOM 0 HB2 PRO B 837 6.251 -5.045 -0.699 1.00 0.00 H new ATOM 0 HB3 PRO B 837 5.063 -6.285 -0.348 1.00 0.00 H new ATOM 0 HG2 PRO B 837 7.479 -6.428 -2.133 1.00 0.00 H new ATOM 0 HG3 PRO B 837 6.874 -7.620 -1.000 1.00 0.00 H new ATOM 0 HD2 PRO B 837 6.415 -7.929 -3.621 1.00 0.00 H new ATOM 0 HD3 PRO B 837 5.159 -8.342 -2.470 1.00 0.00 H new ATOM 1558 N GLN B 838 6.406 -4.039 -3.582 1.00 0.00 N ATOM 1559 CA GLN B 838 6.999 -2.817 -4.066 1.00 0.00 C ATOM 1560 C GLN B 838 5.991 -2.049 -4.895 1.00 0.00 C ATOM 1561 O GLN B 838 5.918 -0.850 -4.793 1.00 0.00 O ATOM 1562 CB GLN B 838 8.287 -3.046 -4.896 1.00 0.00 C ATOM 1563 CG GLN B 838 8.062 -3.671 -6.255 1.00 0.00 C ATOM 1564 CD GLN B 838 9.290 -3.629 -7.148 1.00 0.00 C ATOM 1565 OE1 GLN B 838 10.446 -3.590 -6.554 1.00 0.00 O flip ATOM 1566 NE2 GLN B 838 9.183 -3.589 -8.372 1.00 0.00 N flip ATOM 0 H GLN B 838 6.863 -4.893 -3.903 1.00 0.00 H new ATOM 0 HA GLN B 838 7.288 -2.242 -3.186 1.00 0.00 H new ATOM 0 HB2 GLN B 838 8.791 -2.089 -5.031 1.00 0.00 H new ATOM 0 HB3 GLN B 838 8.962 -3.684 -4.325 1.00 0.00 H new ATOM 0 HG2 GLN B 838 7.753 -4.708 -6.123 1.00 0.00 H new ATOM 0 HG3 GLN B 838 7.242 -3.154 -6.753 1.00 0.00 H new ATOM 0 HE21 GLN B 838 8.260 -3.622 -8.805 1.00 0.00 H new ATOM 0 HE22 GLN B 838 10.017 -3.523 -8.955 1.00 0.00 H new ATOM 1575 N ASP B 839 5.137 -2.778 -5.636 1.00 0.00 N ATOM 1576 CA ASP B 839 4.199 -2.160 -6.580 1.00 0.00 C ATOM 1577 C ASP B 839 3.178 -1.400 -5.818 1.00 0.00 C ATOM 1578 O ASP B 839 2.776 -0.329 -6.225 1.00 0.00 O ATOM 1579 CB ASP B 839 3.496 -3.201 -7.441 1.00 0.00 C ATOM 1580 CG ASP B 839 2.854 -2.621 -8.695 1.00 0.00 C ATOM 1581 OD1 ASP B 839 3.568 -1.994 -9.512 1.00 0.00 O ATOM 1582 OD2 ASP B 839 1.643 -2.846 -8.925 1.00 0.00 O ATOM 0 H ASP B 839 5.080 -3.796 -5.596 1.00 0.00 H new ATOM 0 HA ASP B 839 4.767 -1.502 -7.238 1.00 0.00 H new ATOM 0 HB2 ASP B 839 4.216 -3.966 -7.732 1.00 0.00 H new ATOM 0 HB3 ASP B 839 2.729 -3.695 -6.845 1.00 0.00 H new ATOM 1587 N PHE B 840 2.776 -1.959 -4.674 1.00 0.00 N ATOM 1588 CA PHE B 840 1.826 -1.322 -3.806 1.00 0.00 C ATOM 1589 C PHE B 840 2.422 0.020 -3.325 1.00 0.00 C ATOM 1590 O PHE B 840 1.737 1.039 -3.286 1.00 0.00 O ATOM 1591 CB PHE B 840 1.533 -2.255 -2.614 1.00 0.00 C ATOM 1592 CG PHE B 840 0.171 -2.084 -1.987 1.00 0.00 C ATOM 1593 CD1 PHE B 840 -0.141 -0.980 -1.206 1.00 0.00 C ATOM 1594 CD2 PHE B 840 -0.802 -3.052 -2.184 1.00 0.00 C ATOM 1595 CE1 PHE B 840 -1.404 -0.850 -0.643 1.00 0.00 C ATOM 1596 CE2 PHE B 840 -2.060 -2.924 -1.623 1.00 0.00 C ATOM 1597 CZ PHE B 840 -2.362 -1.832 -0.858 1.00 0.00 C ATOM 0 H PHE B 840 3.108 -2.863 -4.338 1.00 0.00 H new ATOM 0 HA PHE B 840 0.890 -1.125 -4.330 1.00 0.00 H new ATOM 0 HB2 PHE B 840 1.635 -3.288 -2.947 1.00 0.00 H new ATOM 0 HB3 PHE B 840 2.291 -2.090 -1.849 1.00 0.00 H new ATOM 0 HD1 PHE B 840 0.604 -0.217 -1.035 1.00 0.00 H new ATOM 0 HD2 PHE B 840 -0.574 -3.920 -2.785 1.00 0.00 H new ATOM 0 HE1 PHE B 840 -1.641 0.013 -0.039 1.00 0.00 H new ATOM 0 HE2 PHE B 840 -2.805 -3.688 -1.790 1.00 0.00 H new ATOM 0 HZ PHE B 840 -3.345 -1.733 -0.421 1.00 0.00 H new ATOM 1607 N LEU B 841 3.722 0.016 -3.004 1.00 0.00 N ATOM 1608 CA LEU B 841 4.381 1.229 -2.544 1.00 0.00 C ATOM 1609 C LEU B 841 4.605 2.213 -3.703 1.00 0.00 C ATOM 1610 O LEU B 841 4.430 3.420 -3.568 1.00 0.00 O ATOM 1611 CB LEU B 841 5.672 0.917 -1.751 1.00 0.00 C ATOM 1612 CG LEU B 841 6.480 2.128 -1.265 1.00 0.00 C ATOM 1613 CD1 LEU B 841 5.586 3.153 -0.614 1.00 0.00 C ATOM 1614 CD2 LEU B 841 7.541 1.718 -0.285 1.00 0.00 C ATOM 0 H LEU B 841 4.325 -0.805 -3.056 1.00 0.00 H new ATOM 0 HA LEU B 841 3.715 1.728 -1.840 1.00 0.00 H new ATOM 0 HB2 LEU B 841 5.404 0.314 -0.883 1.00 0.00 H new ATOM 0 HB3 LEU B 841 6.319 0.303 -2.378 1.00 0.00 H new ATOM 0 HG LEU B 841 6.953 2.566 -2.144 1.00 0.00 H new ATOM 0 HD11 LEU B 841 6.186 3.999 -0.280 1.00 0.00 H new ATOM 0 HD12 LEU B 841 4.843 3.497 -1.333 1.00 0.00 H new ATOM 0 HD13 LEU B 841 5.082 2.705 0.242 1.00 0.00 H new ATOM 0 HD21 LEU B 841 8.096 2.598 0.040 1.00 0.00 H new ATOM 0 HD22 LEU B 841 7.075 1.243 0.578 1.00 0.00 H new ATOM 0 HD23 LEU B 841 8.224 1.014 -0.761 1.00 0.00 H new ATOM 1626 N LEU B 842 4.960 1.670 -4.841 1.00 0.00 N ATOM 1627 CA LEU B 842 5.216 2.424 -6.064 1.00 0.00 C ATOM 1628 C LEU B 842 3.965 3.089 -6.607 1.00 0.00 C ATOM 1629 O LEU B 842 4.044 3.884 -7.532 1.00 0.00 O ATOM 1630 CB LEU B 842 5.806 1.498 -7.127 1.00 0.00 C ATOM 1631 CG LEU B 842 7.233 1.004 -6.883 1.00 0.00 C ATOM 1632 CD1 LEU B 842 7.430 -0.341 -7.525 1.00 0.00 C ATOM 1633 CD2 LEU B 842 8.240 1.996 -7.439 1.00 0.00 C ATOM 0 H LEU B 842 5.085 0.664 -4.955 1.00 0.00 H new ATOM 0 HA LEU B 842 5.925 3.214 -5.815 1.00 0.00 H new ATOM 0 HB2 LEU B 842 5.155 0.629 -7.222 1.00 0.00 H new ATOM 0 HB3 LEU B 842 5.784 2.019 -8.084 1.00 0.00 H new ATOM 0 HG LEU B 842 7.390 0.912 -5.808 1.00 0.00 H new ATOM 0 HD11 LEU B 842 8.449 -0.684 -7.346 1.00 0.00 H new ATOM 0 HD12 LEU B 842 6.726 -1.055 -7.097 1.00 0.00 H new ATOM 0 HD13 LEU B 842 7.258 -0.261 -8.598 1.00 0.00 H new ATOM 0 HD21 LEU B 842 9.250 1.629 -7.257 1.00 0.00 H new ATOM 0 HD22 LEU B 842 8.083 2.111 -8.512 1.00 0.00 H new ATOM 0 HD23 LEU B 842 8.110 2.960 -6.948 1.00 0.00 H new ATOM 1645 N LYS B 843 2.820 2.776 -6.059 1.00 0.00 N ATOM 1646 CA LYS B 843 1.635 3.380 -6.537 1.00 0.00 C ATOM 1647 C LYS B 843 0.961 4.227 -5.462 1.00 0.00 C ATOM 1648 O LYS B 843 -0.151 4.729 -5.650 1.00 0.00 O ATOM 1649 CB LYS B 843 0.727 2.345 -7.170 1.00 0.00 C ATOM 1650 CG LYS B 843 0.149 1.325 -6.251 1.00 0.00 C ATOM 1651 CD LYS B 843 -0.672 0.348 -7.062 1.00 0.00 C ATOM 1652 CE LYS B 843 0.168 -0.346 -8.114 1.00 0.00 C ATOM 1653 NZ LYS B 843 -0.592 -1.318 -8.923 1.00 0.00 N ATOM 0 H LYS B 843 2.697 2.114 -5.293 1.00 0.00 H new ATOM 0 HA LYS B 843 1.892 4.083 -7.329 1.00 0.00 H new ATOM 0 HB2 LYS B 843 -0.094 2.866 -7.663 1.00 0.00 H new ATOM 0 HB3 LYS B 843 1.288 1.827 -7.947 1.00 0.00 H new ATOM 0 HG2 LYS B 843 0.944 0.801 -5.721 1.00 0.00 H new ATOM 0 HG3 LYS B 843 -0.474 1.806 -5.497 1.00 0.00 H new ATOM 0 HD2 LYS B 843 -1.113 -0.396 -6.399 1.00 0.00 H new ATOM 0 HD3 LYS B 843 -1.496 0.875 -7.543 1.00 0.00 H new ATOM 0 HE2 LYS B 843 0.603 0.404 -8.775 1.00 0.00 H new ATOM 0 HE3 LYS B 843 0.997 -0.859 -7.626 1.00 0.00 H new ATOM 0 HZ1 LYS B 843 0.009 -2.140 -9.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 843 -1.431 -1.629 -8.394 1.00 0.00 H new ATOM 0 HZ3 LYS B 843 -0.891 -0.871 -9.813 1.00 0.00 H new ATOM 1667 N MET B 844 1.670 4.425 -4.359 1.00 0.00 N ATOM 1668 CA MET B 844 1.230 5.315 -3.284 1.00 0.00 C ATOM 1669 C MET B 844 1.094 6.759 -3.797 1.00 0.00 C ATOM 1670 O MET B 844 1.842 7.176 -4.666 1.00 0.00 O ATOM 1671 CB MET B 844 2.206 5.254 -2.106 1.00 0.00 C ATOM 1672 CG MET B 844 2.064 4.017 -1.245 1.00 0.00 C ATOM 1673 SD MET B 844 0.545 4.050 -0.279 1.00 0.00 S ATOM 1674 CE MET B 844 0.628 2.454 0.521 1.00 0.00 C ATOM 0 H MET B 844 2.568 3.975 -4.181 1.00 0.00 H new ATOM 0 HA MET B 844 0.251 4.980 -2.940 1.00 0.00 H new ATOM 0 HB2 MET B 844 3.225 5.300 -2.490 1.00 0.00 H new ATOM 0 HB3 MET B 844 2.060 6.136 -1.482 1.00 0.00 H new ATOM 0 HG2 MET B 844 2.074 3.130 -1.878 1.00 0.00 H new ATOM 0 HG3 MET B 844 2.920 3.940 -0.575 1.00 0.00 H new ATOM 0 HE1 MET B 844 0.024 2.470 1.428 1.00 0.00 H new ATOM 0 HE2 MET B 844 0.248 1.688 -0.155 1.00 0.00 H new ATOM 0 HE3 MET B 844 1.663 2.229 0.778 1.00 0.00 H new ATOM 1684 N PRO B 845 0.145 7.535 -3.254 1.00 0.00 N ATOM 1685 CA PRO B 845 -0.163 8.899 -3.748 1.00 0.00 C ATOM 1686 C PRO B 845 0.993 9.896 -3.590 1.00 0.00 C ATOM 1687 O PRO B 845 1.422 10.543 -4.549 1.00 0.00 O ATOM 1688 CB PRO B 845 -1.343 9.327 -2.867 1.00 0.00 C ATOM 1689 CG PRO B 845 -1.228 8.483 -1.645 1.00 0.00 C ATOM 1690 CD PRO B 845 -0.717 7.160 -2.120 1.00 0.00 C ATOM 0 HA PRO B 845 -0.366 8.889 -4.819 1.00 0.00 H new ATOM 0 HB2 PRO B 845 -1.290 10.388 -2.622 1.00 0.00 H new ATOM 0 HB3 PRO B 845 -2.295 9.164 -3.373 1.00 0.00 H new ATOM 0 HG2 PRO B 845 -0.546 8.930 -0.922 1.00 0.00 H new ATOM 0 HG3 PRO B 845 -2.193 8.376 -1.150 1.00 0.00 H new ATOM 0 HD2 PRO B 845 -0.159 6.638 -1.342 1.00 0.00 H new ATOM 0 HD3 PRO B 845 -1.528 6.500 -2.428 1.00 0.00 H new ATOM 1698 N GLY B 846 1.479 10.011 -2.377 1.00 0.00 N ATOM 1699 CA GLY B 846 2.535 10.958 -2.076 1.00 0.00 C ATOM 1700 C GLY B 846 3.913 10.421 -2.363 1.00 0.00 C ATOM 1701 O GLY B 846 4.883 11.153 -2.344 1.00 0.00 O ATOM 0 H GLY B 846 1.162 9.461 -1.579 1.00 0.00 H new ATOM 0 HA2 GLY B 846 2.377 11.866 -2.659 1.00 0.00 H new ATOM 0 HA3 GLY B 846 2.473 11.239 -1.025 1.00 0.00 H new ATOM 1705 N VAL B 847 4.003 9.157 -2.621 1.00 0.00 N ATOM 1706 CA VAL B 847 5.289 8.558 -2.880 1.00 0.00 C ATOM 1707 C VAL B 847 5.533 8.445 -4.382 1.00 0.00 C ATOM 1708 O VAL B 847 4.730 7.888 -5.115 1.00 0.00 O ATOM 1709 CB VAL B 847 5.414 7.160 -2.237 1.00 0.00 C ATOM 1710 CG1 VAL B 847 6.816 6.647 -2.355 1.00 0.00 C ATOM 1711 CG2 VAL B 847 4.981 7.181 -0.797 1.00 0.00 C ATOM 0 H VAL B 847 3.211 8.515 -2.660 1.00 0.00 H new ATOM 0 HA VAL B 847 6.040 9.209 -2.432 1.00 0.00 H new ATOM 0 HB VAL B 847 4.750 6.485 -2.778 1.00 0.00 H new ATOM 0 HG11 VAL B 847 6.882 5.661 -1.896 1.00 0.00 H new ATOM 0 HG12 VAL B 847 7.090 6.576 -3.408 1.00 0.00 H new ATOM 0 HG13 VAL B 847 7.497 7.330 -1.848 1.00 0.00 H new ATOM 0 HG21 VAL B 847 5.081 6.182 -0.372 1.00 0.00 H new ATOM 0 HG22 VAL B 847 5.608 7.877 -0.239 1.00 0.00 H new ATOM 0 HG23 VAL B 847 3.940 7.500 -0.735 1.00 0.00 H new ATOM 1721 N ASN B 848 6.638 8.961 -4.802 1.00 0.00 N ATOM 1722 CA ASN B 848 7.070 8.925 -6.178 1.00 0.00 C ATOM 1723 C ASN B 848 8.197 7.976 -6.255 1.00 0.00 C ATOM 1724 O ASN B 848 8.769 7.674 -5.230 1.00 0.00 O ATOM 1725 CB ASN B 848 7.472 10.329 -6.693 1.00 0.00 C ATOM 1726 CG ASN B 848 8.129 11.219 -5.636 1.00 0.00 C ATOM 1727 OD1 ASN B 848 7.434 11.853 -4.842 1.00 0.00 O ATOM 1728 ND2 ASN B 848 9.435 11.352 -5.654 1.00 0.00 N ATOM 0 H ASN B 848 7.295 9.438 -4.184 1.00 0.00 H new ATOM 0 HA ASN B 848 6.252 8.599 -6.821 1.00 0.00 H new ATOM 0 HB2 ASN B 848 8.158 10.213 -7.532 1.00 0.00 H new ATOM 0 HB3 ASN B 848 6.584 10.832 -7.075 1.00 0.00 H new ATOM 0 HD21 ASN B 848 9.892 11.990 -5.002 1.00 0.00 H new ATOM 0 HD22 ASN B 848 9.993 10.817 -6.320 1.00 0.00 H new ATOM 1735 N ALA B 849 8.535 7.533 -7.451 1.00 0.00 N ATOM 1736 CA ALA B 849 9.564 6.501 -7.687 1.00 0.00 C ATOM 1737 C ALA B 849 10.831 6.719 -6.868 1.00 0.00 C ATOM 1738 O ALA B 849 11.331 5.797 -6.228 1.00 0.00 O ATOM 1739 CB ALA B 849 9.901 6.438 -9.157 1.00 0.00 C ATOM 0 H ALA B 849 8.104 7.877 -8.309 1.00 0.00 H new ATOM 0 HA ALA B 849 9.140 5.552 -7.359 1.00 0.00 H new ATOM 0 HB1 ALA B 849 10.661 5.674 -9.324 1.00 0.00 H new ATOM 0 HB2 ALA B 849 9.005 6.188 -9.725 1.00 0.00 H new ATOM 0 HB3 ALA B 849 10.281 7.406 -9.485 1.00 0.00 H new ATOM 1745 N LYS B 850 11.278 7.959 -6.837 1.00 0.00 N ATOM 1746 CA LYS B 850 12.515 8.348 -6.131 1.00 0.00 C ATOM 1747 C LYS B 850 12.368 8.055 -4.653 1.00 0.00 C ATOM 1748 O LYS B 850 13.171 7.346 -4.023 1.00 0.00 O ATOM 1749 CB LYS B 850 12.660 9.839 -6.255 1.00 0.00 C ATOM 1750 CG LYS B 850 12.571 10.360 -7.644 1.00 0.00 C ATOM 1751 CD LYS B 850 13.828 10.082 -8.434 1.00 0.00 C ATOM 1752 CE LYS B 850 13.725 10.621 -9.844 1.00 0.00 C ATOM 1753 NZ LYS B 850 13.466 12.074 -9.853 1.00 0.00 N ATOM 0 H LYS B 850 10.804 8.737 -7.296 1.00 0.00 H new ATOM 0 HA LYS B 850 13.363 7.807 -6.551 1.00 0.00 H new ATOM 0 HB2 LYS B 850 11.887 10.317 -5.653 1.00 0.00 H new ATOM 0 HB3 LYS B 850 13.621 10.133 -5.832 1.00 0.00 H new ATOM 0 HG2 LYS B 850 11.718 9.905 -8.148 1.00 0.00 H new ATOM 0 HG3 LYS B 850 12.390 11.434 -7.617 1.00 0.00 H new ATOM 0 HD2 LYS B 850 14.683 10.535 -7.931 1.00 0.00 H new ATOM 0 HD3 LYS B 850 14.009 9.008 -8.466 1.00 0.00 H new ATOM 0 HE2 LYS B 850 14.650 10.412 -10.382 1.00 0.00 H new ATOM 0 HE3 LYS B 850 12.924 10.105 -10.374 1.00 0.00 H new ATOM 0 HZ1 LYS B 850 13.619 12.448 -10.811 1.00 0.00 H new ATOM 0 HZ2 LYS B 850 12.483 12.253 -9.564 1.00 0.00 H new ATOM 0 HZ3 LYS B 850 14.113 12.546 -9.190 1.00 0.00 H new ATOM 1767 N ASN B 851 11.315 8.605 -4.119 1.00 0.00 N ATOM 1768 CA ASN B 851 10.958 8.423 -2.734 1.00 0.00 C ATOM 1769 C ASN B 851 10.643 6.988 -2.414 1.00 0.00 C ATOM 1770 O ASN B 851 11.005 6.518 -1.372 1.00 0.00 O ATOM 1771 CB ASN B 851 9.786 9.300 -2.347 1.00 0.00 C ATOM 1772 CG ASN B 851 10.142 10.756 -2.269 1.00 0.00 C ATOM 1773 OD1 ASN B 851 11.265 11.118 -1.953 1.00 0.00 O ATOM 1774 ND2 ASN B 851 9.202 11.602 -2.556 1.00 0.00 N ATOM 0 H ASN B 851 10.669 9.201 -4.637 1.00 0.00 H new ATOM 0 HA ASN B 851 11.830 8.718 -2.151 1.00 0.00 H new ATOM 0 HB2 ASN B 851 8.984 9.166 -3.073 1.00 0.00 H new ATOM 0 HB3 ASN B 851 9.399 8.974 -1.381 1.00 0.00 H new ATOM 0 HD21 ASN B 851 9.390 12.604 -2.522 1.00 0.00 H new ATOM 0 HD22 ASN B 851 8.275 11.265 -2.816 1.00 0.00 H new ATOM 1781 N CYS B 852 9.984 6.296 -3.331 1.00 0.00 N ATOM 1782 CA CYS B 852 9.602 4.903 -3.137 1.00 0.00 C ATOM 1783 C CYS B 852 10.832 4.043 -2.968 1.00 0.00 C ATOM 1784 O CYS B 852 10.873 3.171 -2.119 1.00 0.00 O ATOM 1785 CB CYS B 852 8.763 4.394 -4.308 1.00 0.00 C ATOM 1786 SG CYS B 852 8.141 2.725 -4.075 1.00 0.00 S ATOM 0 H CYS B 852 9.698 6.683 -4.231 1.00 0.00 H new ATOM 0 HA CYS B 852 8.997 4.842 -2.233 1.00 0.00 H new ATOM 0 HB2 CYS B 852 7.921 5.069 -4.461 1.00 0.00 H new ATOM 0 HB3 CYS B 852 9.365 4.425 -5.216 1.00 0.00 H new ATOM 0 HG CYS B 852 8.878 2.105 -3.201 1.00 0.00 H new ATOM 1792 N ARG B 853 11.826 4.331 -3.771 1.00 0.00 N ATOM 1793 CA ARG B 853 13.115 3.691 -3.740 1.00 0.00 C ATOM 1794 C ARG B 853 13.715 3.865 -2.362 1.00 0.00 C ATOM 1795 O ARG B 853 14.129 2.922 -1.709 1.00 0.00 O ATOM 1796 CB ARG B 853 13.974 4.414 -4.760 1.00 0.00 C ATOM 1797 CG ARG B 853 15.208 3.701 -5.192 1.00 0.00 C ATOM 1798 CD ARG B 853 16.271 3.583 -4.146 1.00 0.00 C ATOM 1799 NE ARG B 853 16.835 4.873 -3.768 1.00 0.00 N ATOM 1800 CZ ARG B 853 17.999 5.012 -3.153 1.00 0.00 C ATOM 1801 NH1 ARG B 853 18.774 3.941 -2.953 1.00 0.00 N ATOM 1802 NH2 ARG B 853 18.402 6.216 -2.775 1.00 0.00 N ATOM 0 H ARG B 853 11.755 5.048 -4.493 1.00 0.00 H new ATOM 0 HA ARG B 853 13.046 2.626 -3.963 1.00 0.00 H new ATOM 0 HB2 ARG B 853 13.366 4.615 -5.642 1.00 0.00 H new ATOM 0 HB3 ARG B 853 14.262 5.380 -4.345 1.00 0.00 H new ATOM 0 HG2 ARG B 853 14.933 2.700 -5.524 1.00 0.00 H new ATOM 0 HG3 ARG B 853 15.625 4.219 -6.055 1.00 0.00 H new ATOM 0 HD2 ARG B 853 15.853 3.101 -3.262 1.00 0.00 H new ATOM 0 HD3 ARG B 853 17.068 2.937 -4.515 1.00 0.00 H new ATOM 0 HE ARG B 853 16.303 5.715 -3.990 1.00 0.00 H new ATOM 0 HH11 ARG B 853 18.467 3.023 -3.274 1.00 0.00 H new ATOM 0 HH12 ARG B 853 19.672 4.042 -2.480 1.00 0.00 H new ATOM 0 HH21 ARG B 853 17.816 7.031 -2.958 1.00 0.00 H new ATOM 0 HH22 ARG B 853 19.298 6.328 -2.301 1.00 0.00 H new ATOM 1816 N SER B 854 13.724 5.062 -1.935 1.00 0.00 N ATOM 1817 CA SER B 854 14.292 5.420 -0.693 1.00 0.00 C ATOM 1818 C SER B 854 13.467 4.807 0.483 1.00 0.00 C ATOM 1819 O SER B 854 14.016 4.427 1.536 1.00 0.00 O ATOM 1820 CB SER B 854 14.333 6.926 -0.659 1.00 0.00 C ATOM 1821 OG SER B 854 15.088 7.431 -1.765 1.00 0.00 O ATOM 0 H SER B 854 13.326 5.847 -2.451 1.00 0.00 H new ATOM 0 HA SER B 854 15.301 5.025 -0.577 1.00 0.00 H new ATOM 0 HB2 SER B 854 13.319 7.324 -0.691 1.00 0.00 H new ATOM 0 HB3 SER B 854 14.778 7.263 0.277 1.00 0.00 H new ATOM 0 HG SER B 854 14.527 7.438 -2.568 1.00 0.00 H new ATOM 1827 N LEU B 855 12.169 4.627 0.246 1.00 0.00 N ATOM 1828 CA LEU B 855 11.299 4.068 1.229 1.00 0.00 C ATOM 1829 C LEU B 855 11.577 2.632 1.373 1.00 0.00 C ATOM 1830 O LEU B 855 11.872 2.199 2.442 1.00 0.00 O ATOM 1831 CB LEU B 855 9.825 4.260 0.917 1.00 0.00 C ATOM 1832 CG LEU B 855 9.247 5.670 1.032 1.00 0.00 C ATOM 1833 CD1 LEU B 855 7.759 5.611 0.982 1.00 0.00 C ATOM 1834 CD2 LEU B 855 9.706 6.363 2.287 1.00 0.00 C ATOM 0 H LEU B 855 11.712 4.869 -0.633 1.00 0.00 H new ATOM 0 HA LEU B 855 11.499 4.603 2.157 1.00 0.00 H new ATOM 0 HB2 LEU B 855 9.650 3.909 -0.100 1.00 0.00 H new ATOM 0 HB3 LEU B 855 9.255 3.610 1.581 1.00 0.00 H new ATOM 0 HG LEU B 855 9.614 6.254 0.188 1.00 0.00 H new ATOM 0 HD11 LEU B 855 7.352 6.619 1.064 1.00 0.00 H new ATOM 0 HD12 LEU B 855 7.444 5.169 0.037 1.00 0.00 H new ATOM 0 HD13 LEU B 855 7.391 5.002 1.808 1.00 0.00 H new ATOM 0 HD21 LEU B 855 9.273 7.362 2.330 1.00 0.00 H new ATOM 0 HD22 LEU B 855 9.385 5.790 3.157 1.00 0.00 H new ATOM 0 HD23 LEU B 855 10.793 6.439 2.284 1.00 0.00 H new ATOM 1846 N MET B 856 11.538 1.907 0.257 1.00 0.00 N ATOM 1847 CA MET B 856 11.793 0.475 0.231 1.00 0.00 C ATOM 1848 C MET B 856 13.130 0.117 0.893 1.00 0.00 C ATOM 1849 O MET B 856 13.296 -0.968 1.418 1.00 0.00 O ATOM 1850 CB MET B 856 11.670 -0.125 -1.196 1.00 0.00 C ATOM 1851 CG MET B 856 12.571 0.481 -2.250 1.00 0.00 C ATOM 1852 SD MET B 856 12.416 -0.288 -3.881 1.00 0.00 S ATOM 1853 CE MET B 856 10.722 0.108 -4.300 1.00 0.00 C ATOM 0 H MET B 856 11.327 2.303 -0.659 1.00 0.00 H new ATOM 0 HA MET B 856 11.008 0.011 0.828 1.00 0.00 H new ATOM 0 HB2 MET B 856 11.878 -1.193 -1.139 1.00 0.00 H new ATOM 0 HB3 MET B 856 10.636 -0.019 -1.525 1.00 0.00 H new ATOM 0 HG2 MET B 856 12.346 1.544 -2.338 1.00 0.00 H new ATOM 0 HG3 MET B 856 13.606 0.400 -1.918 1.00 0.00 H new ATOM 0 HE1 MET B 856 10.516 -0.209 -5.322 1.00 0.00 H new ATOM 0 HE2 MET B 856 10.048 -0.409 -3.617 1.00 0.00 H new ATOM 0 HE3 MET B 856 10.568 1.184 -4.216 1.00 0.00 H new ATOM 1863 N HIS B 857 14.079 1.048 0.836 1.00 0.00 N ATOM 1864 CA HIS B 857 15.382 0.877 1.478 1.00 0.00 C ATOM 1865 C HIS B 857 15.316 1.010 2.992 1.00 0.00 C ATOM 1866 O HIS B 857 16.048 0.320 3.717 1.00 0.00 O ATOM 1867 CB HIS B 857 16.425 1.834 0.901 1.00 0.00 C ATOM 1868 CG HIS B 857 17.075 1.322 -0.337 1.00 0.00 C ATOM 1869 ND1 HIS B 857 18.348 0.831 -0.363 1.00 0.00 N ATOM 1870 CD2 HIS B 857 16.621 1.248 -1.603 1.00 0.00 C ATOM 1871 CE1 HIS B 857 18.640 0.491 -1.612 1.00 0.00 C ATOM 1872 NE2 HIS B 857 17.615 0.725 -2.417 1.00 0.00 N ATOM 0 H HIS B 857 13.969 1.937 0.347 1.00 0.00 H new ATOM 0 HA HIS B 857 15.692 -0.145 1.258 1.00 0.00 H new ATOM 0 HB2 HIS B 857 15.949 2.790 0.684 1.00 0.00 H new ATOM 0 HB3 HIS B 857 17.191 2.022 1.654 1.00 0.00 H new ATOM 0 HD1 HIS B 857 18.969 0.741 0.441 1.00 0.00 H new ATOM 0 HD2 HIS B 857 15.637 1.549 -1.933 1.00 0.00 H new ATOM 0 HE1 HIS B 857 19.586 0.079 -1.929 1.00 0.00 H new ATOM 1880 N HIS B 858 14.473 1.890 3.471 1.00 0.00 N ATOM 1881 CA HIS B 858 14.328 2.091 4.909 1.00 0.00 C ATOM 1882 C HIS B 858 13.245 1.211 5.549 1.00 0.00 C ATOM 1883 O HIS B 858 13.505 0.497 6.523 1.00 0.00 O ATOM 1884 CB HIS B 858 14.082 3.564 5.240 1.00 0.00 C ATOM 1885 CG HIS B 858 15.328 4.394 5.370 1.00 0.00 C ATOM 1886 ND1 HIS B 858 15.690 5.029 6.535 1.00 0.00 N ATOM 1887 CD2 HIS B 858 16.284 4.708 4.464 1.00 0.00 C ATOM 1888 CE1 HIS B 858 16.817 5.696 6.322 1.00 0.00 C ATOM 1889 NE2 HIS B 858 17.232 5.536 5.075 1.00 0.00 N ATOM 0 H HIS B 858 13.874 2.482 2.896 1.00 0.00 H new ATOM 0 HA HIS B 858 15.277 1.779 5.345 1.00 0.00 H new ATOM 0 HB2 HIS B 858 13.453 3.997 4.463 1.00 0.00 H new ATOM 0 HB3 HIS B 858 13.522 3.624 6.173 1.00 0.00 H new ATOM 0 HD2 HIS B 858 16.310 4.374 3.437 1.00 0.00 H new ATOM 0 HE1 HIS B 858 17.327 6.290 7.066 1.00 0.00 H new ATOM 0 HE2 HIS B 858 18.069 5.934 4.648 1.00 0.00 H new ATOM 1897 N VAL B 859 12.058 1.265 5.005 1.00 0.00 N ATOM 1898 CA VAL B 859 10.918 0.562 5.556 1.00 0.00 C ATOM 1899 C VAL B 859 10.885 -0.911 5.092 1.00 0.00 C ATOM 1900 O VAL B 859 11.189 -1.210 3.942 1.00 0.00 O ATOM 1901 CB VAL B 859 9.567 1.303 5.232 1.00 0.00 C ATOM 1902 CG1 VAL B 859 9.292 1.405 3.748 1.00 0.00 C ATOM 1903 CG2 VAL B 859 8.400 0.674 5.943 1.00 0.00 C ATOM 0 H VAL B 859 11.848 1.800 4.162 1.00 0.00 H new ATOM 0 HA VAL B 859 11.031 0.559 6.640 1.00 0.00 H new ATOM 0 HB VAL B 859 9.690 2.319 5.606 1.00 0.00 H new ATOM 0 HG11 VAL B 859 8.348 1.925 3.588 1.00 0.00 H new ATOM 0 HG12 VAL B 859 10.098 1.959 3.266 1.00 0.00 H new ATOM 0 HG13 VAL B 859 9.232 0.405 3.319 1.00 0.00 H new ATOM 0 HG21 VAL B 859 7.487 1.215 5.693 1.00 0.00 H new ATOM 0 HG22 VAL B 859 8.302 -0.366 5.632 1.00 0.00 H new ATOM 0 HG23 VAL B 859 8.564 0.717 7.020 1.00 0.00 H new ATOM 1913 N LYS B 860 10.513 -1.818 6.010 1.00 0.00 N ATOM 1914 CA LYS B 860 10.459 -3.233 5.734 1.00 0.00 C ATOM 1915 C LYS B 860 9.417 -3.525 4.664 1.00 0.00 C ATOM 1916 O LYS B 860 9.703 -4.216 3.687 1.00 0.00 O ATOM 1917 CB LYS B 860 10.198 -4.003 7.059 1.00 0.00 C ATOM 1918 CG LYS B 860 10.037 -5.514 6.935 1.00 0.00 C ATOM 1919 CD LYS B 860 8.583 -5.850 6.710 1.00 0.00 C ATOM 1920 CE LYS B 860 8.355 -7.255 6.242 1.00 0.00 C ATOM 1921 NZ LYS B 860 8.721 -8.272 7.234 1.00 0.00 N ATOM 0 H LYS B 860 10.243 -1.573 6.963 1.00 0.00 H new ATOM 0 HA LYS B 860 11.413 -3.577 5.335 1.00 0.00 H new ATOM 0 HB2 LYS B 860 11.023 -3.801 7.742 1.00 0.00 H new ATOM 0 HB3 LYS B 860 9.297 -3.598 7.519 1.00 0.00 H new ATOM 0 HG2 LYS B 860 10.640 -5.888 6.107 1.00 0.00 H new ATOM 0 HG3 LYS B 860 10.399 -6.004 7.839 1.00 0.00 H new ATOM 0 HD2 LYS B 860 8.035 -5.692 7.639 1.00 0.00 H new ATOM 0 HD3 LYS B 860 8.169 -5.160 5.975 1.00 0.00 H new ATOM 0 HE2 LYS B 860 7.304 -7.376 5.981 1.00 0.00 H new ATOM 0 HE3 LYS B 860 8.931 -7.424 5.332 1.00 0.00 H new ATOM 0 HZ1 LYS B 860 8.538 -9.219 6.844 1.00 0.00 H new ATOM 0 HZ2 LYS B 860 9.731 -8.183 7.466 1.00 0.00 H new ATOM 0 HZ3 LYS B 860 8.154 -8.137 8.095 1.00 0.00 H new ATOM 1935 N ASN B 861 8.218 -2.982 4.826 1.00 0.00 N ATOM 1936 CA ASN B 861 7.173 -3.215 3.843 1.00 0.00 C ATOM 1937 C ASN B 861 6.083 -2.186 3.959 1.00 0.00 C ATOM 1938 O ASN B 861 6.088 -1.369 4.882 1.00 0.00 O ATOM 1939 CB ASN B 861 6.566 -4.636 3.919 1.00 0.00 C ATOM 1940 CG ASN B 861 5.618 -4.902 5.090 1.00 0.00 C ATOM 1941 OD1 ASN B 861 5.881 -4.345 6.247 1.00 0.00 O flip ATOM 1942 ND2 ASN B 861 4.674 -5.634 4.949 1.00 0.00 N flip ATOM 0 H ASN B 861 7.950 -2.390 5.612 1.00 0.00 H new ATOM 0 HA ASN B 861 7.656 -3.126 2.870 1.00 0.00 H new ATOM 0 HB2 ASN B 861 6.027 -4.829 2.991 1.00 0.00 H new ATOM 0 HB3 ASN B 861 7.383 -5.356 3.969 1.00 0.00 H new ATOM 0 HD21 ASN B 861 4.488 -6.057 4.040 1.00 0.00 H new ATOM 0 HD22 ASN B 861 4.060 -5.832 5.739 1.00 0.00 H new ATOM 1949 N ILE B 862 5.152 -2.252 3.034 1.00 0.00 N ATOM 1950 CA ILE B 862 3.980 -1.385 2.979 1.00 0.00 C ATOM 1951 C ILE B 862 3.163 -1.424 4.294 1.00 0.00 C ATOM 1952 O ILE B 862 2.585 -0.428 4.714 1.00 0.00 O ATOM 1953 CB ILE B 862 3.061 -1.696 1.726 1.00 0.00 C ATOM 1954 CG1 ILE B 862 3.172 -3.145 1.261 1.00 0.00 C ATOM 1955 CG2 ILE B 862 3.358 -0.792 0.559 1.00 0.00 C ATOM 1956 CD1 ILE B 862 2.799 -4.152 2.279 1.00 0.00 C ATOM 0 H ILE B 862 5.184 -2.929 2.272 1.00 0.00 H new ATOM 0 HA ILE B 862 4.358 -0.370 2.859 1.00 0.00 H new ATOM 0 HB ILE B 862 2.044 -1.513 2.072 1.00 0.00 H new ATOM 0 HG12 ILE B 862 2.537 -3.281 0.386 1.00 0.00 H new ATOM 0 HG13 ILE B 862 4.198 -3.333 0.943 1.00 0.00 H new ATOM 0 HG21 ILE B 862 2.702 -1.046 -0.274 1.00 0.00 H new ATOM 0 HG22 ILE B 862 3.191 0.245 0.850 1.00 0.00 H new ATOM 0 HG23 ILE B 862 4.397 -0.920 0.255 1.00 0.00 H new ATOM 0 HD11 ILE B 862 2.909 -5.152 1.859 1.00 0.00 H new ATOM 0 HD12 ILE B 862 3.450 -4.050 3.147 1.00 0.00 H new ATOM 0 HD13 ILE B 862 1.763 -3.997 2.581 1.00 0.00 H new ATOM 1968 N ALA B 863 3.193 -2.554 4.970 1.00 0.00 N ATOM 1969 CA ALA B 863 2.480 -2.714 6.198 1.00 0.00 C ATOM 1970 C ALA B 863 3.105 -1.861 7.283 1.00 0.00 C ATOM 1971 O ALA B 863 2.421 -1.314 8.127 1.00 0.00 O ATOM 1972 CB ALA B 863 2.447 -4.173 6.597 1.00 0.00 C ATOM 0 H ALA B 863 3.714 -3.380 4.675 1.00 0.00 H new ATOM 0 HA ALA B 863 1.452 -2.380 6.059 1.00 0.00 H new ATOM 0 HB1 ALA B 863 1.901 -4.282 7.534 1.00 0.00 H new ATOM 0 HB2 ALA B 863 1.950 -4.752 5.818 1.00 0.00 H new ATOM 0 HB3 ALA B 863 3.466 -4.538 6.726 1.00 0.00 H new ATOM 1978 N GLU B 864 4.405 -1.694 7.195 1.00 0.00 N ATOM 1979 CA GLU B 864 5.141 -0.933 8.143 1.00 0.00 C ATOM 1980 C GLU B 864 4.929 0.524 7.983 1.00 0.00 C ATOM 1981 O GLU B 864 4.774 1.204 8.942 1.00 0.00 O ATOM 1982 CB GLU B 864 6.577 -1.243 8.054 1.00 0.00 C ATOM 1983 CG GLU B 864 6.957 -2.480 8.791 1.00 0.00 C ATOM 1984 CD GLU B 864 6.727 -2.388 10.278 1.00 0.00 C ATOM 1985 OE1 GLU B 864 7.474 -1.658 10.962 1.00 0.00 O ATOM 1986 OE2 GLU B 864 5.828 -3.087 10.786 1.00 0.00 O ATOM 0 H GLU B 864 4.975 -2.093 6.449 1.00 0.00 H new ATOM 0 HA GLU B 864 4.770 -1.213 9.129 1.00 0.00 H new ATOM 0 HB2 GLU B 864 6.854 -1.353 7.006 1.00 0.00 H new ATOM 0 HB3 GLU B 864 7.149 -0.403 8.448 1.00 0.00 H new ATOM 0 HG2 GLU B 864 6.386 -3.320 8.394 1.00 0.00 H new ATOM 0 HG3 GLU B 864 8.010 -2.695 8.607 1.00 0.00 H new ATOM 1993 N LEU B 865 4.906 1.005 6.756 1.00 0.00 N ATOM 1994 CA LEU B 865 4.672 2.427 6.524 1.00 0.00 C ATOM 1995 C LEU B 865 3.287 2.823 7.012 1.00 0.00 C ATOM 1996 O LEU B 865 3.060 3.944 7.449 1.00 0.00 O ATOM 1997 CB LEU B 865 4.975 2.842 5.061 1.00 0.00 C ATOM 1998 CG LEU B 865 4.285 2.067 3.934 1.00 0.00 C ATOM 1999 CD1 LEU B 865 2.829 2.461 3.759 1.00 0.00 C ATOM 2000 CD2 LEU B 865 5.045 2.209 2.644 1.00 0.00 C ATOM 0 H LEU B 865 5.043 0.448 5.913 1.00 0.00 H new ATOM 0 HA LEU B 865 5.384 2.999 7.119 1.00 0.00 H new ATOM 0 HB2 LEU B 865 4.712 3.894 4.952 1.00 0.00 H new ATOM 0 HB3 LEU B 865 6.052 2.765 4.908 1.00 0.00 H new ATOM 0 HG LEU B 865 4.289 1.016 4.224 1.00 0.00 H new ATOM 0 HD11 LEU B 865 2.390 1.881 2.947 1.00 0.00 H new ATOM 0 HD12 LEU B 865 2.285 2.263 4.682 1.00 0.00 H new ATOM 0 HD13 LEU B 865 2.765 3.523 3.521 1.00 0.00 H new ATOM 0 HD21 LEU B 865 4.536 1.650 1.859 1.00 0.00 H new ATOM 0 HD22 LEU B 865 5.096 3.262 2.366 1.00 0.00 H new ATOM 0 HD23 LEU B 865 6.054 1.818 2.772 1.00 0.00 H new ATOM 2012 N ALA B 866 2.387 1.855 6.969 1.00 0.00 N ATOM 2013 CA ALA B 866 1.028 2.046 7.452 1.00 0.00 C ATOM 2014 C ALA B 866 0.976 1.880 8.974 1.00 0.00 C ATOM 2015 O ALA B 866 0.028 2.311 9.623 1.00 0.00 O ATOM 2016 CB ALA B 866 0.071 1.069 6.778 1.00 0.00 C ATOM 0 H ALA B 866 2.574 0.922 6.602 1.00 0.00 H new ATOM 0 HA ALA B 866 0.715 3.059 7.199 1.00 0.00 H new ATOM 0 HB1 ALA B 866 -0.939 1.231 7.155 1.00 0.00 H new ATOM 0 HB2 ALA B 866 0.086 1.230 5.700 1.00 0.00 H new ATOM 0 HB3 ALA B 866 0.381 0.047 6.997 1.00 0.00 H new ATOM 2022 N ALA B 867 1.977 1.221 9.530 1.00 0.00 N ATOM 2023 CA ALA B 867 2.066 1.025 10.975 1.00 0.00 C ATOM 2024 C ALA B 867 2.898 2.132 11.644 1.00 0.00 C ATOM 2025 O ALA B 867 2.788 2.366 12.847 1.00 0.00 O ATOM 2026 CB ALA B 867 2.650 -0.348 11.291 1.00 0.00 C ATOM 0 H ALA B 867 2.747 0.808 9.003 1.00 0.00 H new ATOM 0 HA ALA B 867 1.056 1.079 11.381 1.00 0.00 H new ATOM 0 HB1 ALA B 867 2.710 -0.478 12.372 1.00 0.00 H new ATOM 0 HB2 ALA B 867 2.010 -1.122 10.867 1.00 0.00 H new ATOM 0 HB3 ALA B 867 3.648 -0.427 10.861 1.00 0.00 H new ATOM 2032 N LEU B 868 3.717 2.804 10.861 1.00 0.00 N ATOM 2033 CA LEU B 868 4.576 3.867 11.353 1.00 0.00 C ATOM 2034 C LEU B 868 3.811 5.156 11.620 1.00 0.00 C ATOM 2035 O LEU B 868 2.580 5.223 11.489 1.00 0.00 O ATOM 2036 CB LEU B 868 5.728 4.145 10.369 1.00 0.00 C ATOM 2037 CG LEU B 868 6.759 3.031 10.175 1.00 0.00 C ATOM 2038 CD1 LEU B 868 7.806 3.444 9.156 1.00 0.00 C ATOM 2039 CD2 LEU B 868 7.413 2.662 11.495 1.00 0.00 C ATOM 0 H LEU B 868 3.808 2.629 9.860 1.00 0.00 H new ATOM 0 HA LEU B 868 4.985 3.518 12.301 1.00 0.00 H new ATOM 0 HB2 LEU B 868 5.294 4.378 9.397 1.00 0.00 H new ATOM 0 HB3 LEU B 868 6.254 5.038 10.706 1.00 0.00 H new ATOM 0 HG LEU B 868 6.240 2.150 9.797 1.00 0.00 H new ATOM 0 HD11 LEU B 868 8.530 2.639 9.032 1.00 0.00 H new ATOM 0 HD12 LEU B 868 7.323 3.648 8.200 1.00 0.00 H new ATOM 0 HD13 LEU B 868 8.317 4.342 9.503 1.00 0.00 H new ATOM 0 HD21 LEU B 868 8.142 1.868 11.331 1.00 0.00 H new ATOM 0 HD22 LEU B 868 7.916 3.536 11.909 1.00 0.00 H new ATOM 0 HD23 LEU B 868 6.652 2.316 12.194 1.00 0.00 H new ATOM 2051 N SER B 869 4.552 6.153 12.018 1.00 0.00 N ATOM 2052 CA SER B 869 4.047 7.456 12.309 1.00 0.00 C ATOM 2053 C SER B 869 4.239 8.387 11.106 1.00 0.00 C ATOM 2054 O SER B 869 5.104 8.144 10.238 1.00 0.00 O ATOM 2055 CB SER B 869 4.769 7.990 13.563 1.00 0.00 C ATOM 2056 OG SER B 869 4.568 9.370 13.769 1.00 0.00 O ATOM 0 H SER B 869 5.560 6.072 12.152 1.00 0.00 H new ATOM 0 HA SER B 869 2.976 7.410 12.507 1.00 0.00 H new ATOM 0 HB2 SER B 869 4.418 7.443 14.438 1.00 0.00 H new ATOM 0 HB3 SER B 869 5.837 7.794 13.472 1.00 0.00 H new ATOM 0 HG SER B 869 5.046 9.653 14.576 1.00 0.00 H new ATOM 2062 N GLN B 870 3.451 9.465 11.074 1.00 0.00 N ATOM 2063 CA GLN B 870 3.495 10.467 10.029 1.00 0.00 C ATOM 2064 C GLN B 870 4.849 11.189 10.102 1.00 0.00 C ATOM 2065 O GLN B 870 5.359 11.706 9.129 1.00 0.00 O ATOM 2066 CB GLN B 870 2.312 11.429 10.245 1.00 0.00 C ATOM 2067 CG GLN B 870 1.744 12.143 9.004 1.00 0.00 C ATOM 2068 CD GLN B 870 2.506 13.339 8.495 1.00 0.00 C ATOM 2069 OE1 GLN B 870 2.301 14.454 8.935 1.00 0.00 O ATOM 2070 NE2 GLN B 870 3.308 13.134 7.506 1.00 0.00 N ATOM 0 H GLN B 870 2.754 9.661 11.792 1.00 0.00 H new ATOM 0 HA GLN B 870 3.405 10.027 9.036 1.00 0.00 H new ATOM 0 HB2 GLN B 870 1.502 10.868 10.711 1.00 0.00 H new ATOM 0 HB3 GLN B 870 2.624 12.191 10.959 1.00 0.00 H new ATOM 0 HG2 GLN B 870 1.676 11.415 8.196 1.00 0.00 H new ATOM 0 HG3 GLN B 870 0.727 12.461 9.232 1.00 0.00 H new ATOM 0 HE21 GLN B 870 3.459 12.187 7.160 1.00 0.00 H new ATOM 0 HE22 GLN B 870 3.791 13.919 7.070 1.00 0.00 H new ATOM 2079 N ASP B 871 5.434 11.177 11.250 1.00 0.00 N ATOM 2080 CA ASP B 871 6.742 11.767 11.443 1.00 0.00 C ATOM 2081 C ASP B 871 7.834 10.924 10.790 1.00 0.00 C ATOM 2082 O ASP B 871 8.805 11.459 10.252 1.00 0.00 O ATOM 2083 CB ASP B 871 7.037 11.954 12.926 1.00 0.00 C ATOM 2084 CG ASP B 871 6.192 13.017 13.593 1.00 0.00 C ATOM 2085 OD1 ASP B 871 4.949 12.892 13.621 1.00 0.00 O ATOM 2086 OD2 ASP B 871 6.768 14.004 14.089 1.00 0.00 O ATOM 0 H ASP B 871 5.031 10.762 12.090 1.00 0.00 H new ATOM 0 HA ASP B 871 6.735 12.745 10.961 1.00 0.00 H new ATOM 0 HB2 ASP B 871 6.881 11.005 13.439 1.00 0.00 H new ATOM 0 HB3 ASP B 871 8.089 12.212 13.047 1.00 0.00 H new ATOM 2091 N GLU B 872 7.638 9.610 10.789 1.00 0.00 N ATOM 2092 CA GLU B 872 8.645 8.681 10.270 1.00 0.00 C ATOM 2093 C GLU B 872 8.794 8.842 8.782 1.00 0.00 C ATOM 2094 O GLU B 872 9.881 9.111 8.282 1.00 0.00 O ATOM 2095 CB GLU B 872 8.260 7.237 10.571 1.00 0.00 C ATOM 2096 CG GLU B 872 8.055 6.947 12.033 1.00 0.00 C ATOM 2097 CD GLU B 872 9.279 7.216 12.856 1.00 0.00 C ATOM 2098 OE1 GLU B 872 10.227 6.404 12.821 1.00 0.00 O ATOM 2099 OE2 GLU B 872 9.325 8.253 13.549 1.00 0.00 O ATOM 0 H GLU B 872 6.793 9.161 11.141 1.00 0.00 H new ATOM 0 HA GLU B 872 9.590 8.913 10.762 1.00 0.00 H new ATOM 0 HB2 GLU B 872 7.343 6.997 10.032 1.00 0.00 H new ATOM 0 HB3 GLU B 872 9.038 6.577 10.186 1.00 0.00 H new ATOM 0 HG2 GLU B 872 7.231 7.554 12.407 1.00 0.00 H new ATOM 0 HG3 GLU B 872 7.763 5.904 12.154 1.00 0.00 H new ATOM 2106 N LEU B 873 7.686 8.755 8.080 1.00 0.00 N ATOM 2107 CA LEU B 873 7.703 8.902 6.646 1.00 0.00 C ATOM 2108 C LEU B 873 8.078 10.301 6.210 1.00 0.00 C ATOM 2109 O LEU B 873 8.698 10.472 5.176 1.00 0.00 O ATOM 2110 CB LEU B 873 6.421 8.372 5.987 1.00 0.00 C ATOM 2111 CG LEU B 873 5.108 8.540 6.757 1.00 0.00 C ATOM 2112 CD1 LEU B 873 4.763 9.961 6.880 1.00 0.00 C ATOM 2113 CD2 LEU B 873 3.995 7.836 6.060 1.00 0.00 C ATOM 0 H LEU B 873 6.764 8.583 8.481 1.00 0.00 H new ATOM 0 HA LEU B 873 8.504 8.263 6.275 1.00 0.00 H new ATOM 0 HB2 LEU B 873 6.310 8.866 5.022 1.00 0.00 H new ATOM 0 HB3 LEU B 873 6.560 7.310 5.787 1.00 0.00 H new ATOM 0 HG LEU B 873 5.247 8.108 7.748 1.00 0.00 H new ATOM 0 HD11 LEU B 873 3.827 10.062 7.430 1.00 0.00 H new ATOM 0 HD12 LEU B 873 5.556 10.483 7.415 1.00 0.00 H new ATOM 0 HD13 LEU B 873 4.649 10.395 5.887 1.00 0.00 H new ATOM 0 HD21 LEU B 873 3.071 7.968 6.624 1.00 0.00 H new ATOM 0 HD22 LEU B 873 3.872 8.251 5.060 1.00 0.00 H new ATOM 0 HD23 LEU B 873 4.226 6.773 5.986 1.00 0.00 H new ATOM 2125 N THR B 874 7.740 11.290 7.023 1.00 0.00 N ATOM 2126 CA THR B 874 8.148 12.659 6.753 1.00 0.00 C ATOM 2127 C THR B 874 9.675 12.757 6.741 1.00 0.00 C ATOM 2128 O THR B 874 10.262 13.343 5.827 1.00 0.00 O ATOM 2129 CB THR B 874 7.535 13.665 7.773 1.00 0.00 C ATOM 2130 OG1 THR B 874 6.114 13.702 7.611 1.00 0.00 O ATOM 2131 CG2 THR B 874 8.100 15.071 7.604 1.00 0.00 C ATOM 0 H THR B 874 7.187 11.171 7.872 1.00 0.00 H new ATOM 0 HA THR B 874 7.765 12.933 5.770 1.00 0.00 H new ATOM 0 HB THR B 874 7.796 13.321 8.774 1.00 0.00 H new ATOM 0 HG1 THR B 874 5.688 13.212 8.345 1.00 0.00 H new ATOM 0 HG21 THR B 874 7.643 15.737 8.336 1.00 0.00 H new ATOM 0 HG22 THR B 874 9.179 15.050 7.756 1.00 0.00 H new ATOM 0 HG23 THR B 874 7.882 15.432 6.599 1.00 0.00 H new ATOM 2139 N SER B 875 10.297 12.104 7.699 1.00 0.00 N ATOM 2140 CA SER B 875 11.725 12.108 7.825 1.00 0.00 C ATOM 2141 C SER B 875 12.381 11.331 6.660 1.00 0.00 C ATOM 2142 O SER B 875 13.386 11.780 6.085 1.00 0.00 O ATOM 2143 CB SER B 875 12.120 11.507 9.186 1.00 0.00 C ATOM 2144 OG SER B 875 13.510 11.628 9.434 1.00 0.00 O ATOM 0 H SER B 875 9.817 11.555 8.412 1.00 0.00 H new ATOM 0 HA SER B 875 12.087 13.135 7.776 1.00 0.00 H new ATOM 0 HB2 SER B 875 11.565 12.008 9.979 1.00 0.00 H new ATOM 0 HB3 SER B 875 11.836 10.455 9.214 1.00 0.00 H new ATOM 0 HG SER B 875 13.722 11.237 10.307 1.00 0.00 H new ATOM 2150 N ILE B 876 11.790 10.199 6.283 1.00 0.00 N ATOM 2151 CA ILE B 876 12.372 9.358 5.233 1.00 0.00 C ATOM 2152 C ILE B 876 12.193 10.005 3.842 1.00 0.00 C ATOM 2153 O ILE B 876 13.135 10.064 3.044 1.00 0.00 O ATOM 2154 CB ILE B 876 11.762 7.925 5.234 1.00 0.00 C ATOM 2155 CG1 ILE B 876 11.849 7.310 6.640 1.00 0.00 C ATOM 2156 CG2 ILE B 876 12.524 7.031 4.244 1.00 0.00 C ATOM 2157 CD1 ILE B 876 11.108 5.992 6.788 1.00 0.00 C ATOM 0 H ILE B 876 10.920 9.844 6.681 1.00 0.00 H new ATOM 0 HA ILE B 876 13.437 9.273 5.449 1.00 0.00 H new ATOM 0 HB ILE B 876 10.716 7.994 4.935 1.00 0.00 H new ATOM 0 HG12 ILE B 876 12.898 7.155 6.893 1.00 0.00 H new ATOM 0 HG13 ILE B 876 11.449 8.022 7.362 1.00 0.00 H new ATOM 0 HG21 ILE B 876 12.092 6.030 4.250 1.00 0.00 H new ATOM 0 HG22 ILE B 876 12.449 7.452 3.241 1.00 0.00 H new ATOM 0 HG23 ILE B 876 13.572 6.975 4.537 1.00 0.00 H new ATOM 0 HD11 ILE B 876 11.219 5.625 7.808 1.00 0.00 H new ATOM 0 HD12 ILE B 876 10.051 6.142 6.569 1.00 0.00 H new ATOM 0 HD13 ILE B 876 11.522 5.262 6.093 1.00 0.00 H new ATOM 2169 N LEU B 877 10.995 10.507 3.578 1.00 0.00 N ATOM 2170 CA LEU B 877 10.680 11.142 2.300 1.00 0.00 C ATOM 2171 C LEU B 877 11.357 12.473 2.172 1.00 0.00 C ATOM 2172 O LEU B 877 11.823 12.834 1.108 1.00 0.00 O ATOM 2173 CB LEU B 877 9.176 11.347 2.155 1.00 0.00 C ATOM 2174 CG LEU B 877 8.348 10.085 2.079 1.00 0.00 C ATOM 2175 CD1 LEU B 877 6.891 10.418 2.115 1.00 0.00 C ATOM 2176 CD2 LEU B 877 8.647 9.348 0.817 1.00 0.00 C ATOM 0 H LEU B 877 10.217 10.488 4.237 1.00 0.00 H new ATOM 0 HA LEU B 877 11.041 10.477 1.515 1.00 0.00 H new ATOM 0 HB2 LEU B 877 8.825 11.940 3.000 1.00 0.00 H new ATOM 0 HB3 LEU B 877 8.993 11.935 1.256 1.00 0.00 H new ATOM 0 HG LEU B 877 8.599 9.459 2.935 1.00 0.00 H new ATOM 0 HD11 LEU B 877 6.306 9.500 2.060 1.00 0.00 H new ATOM 0 HD12 LEU B 877 6.660 10.940 3.044 1.00 0.00 H new ATOM 0 HD13 LEU B 877 6.643 11.058 1.268 1.00 0.00 H new ATOM 0 HD21 LEU B 877 8.044 8.441 0.774 1.00 0.00 H new ATOM 0 HD22 LEU B 877 8.412 9.981 -0.039 1.00 0.00 H new ATOM 0 HD23 LEU B 877 9.704 9.083 0.792 1.00 0.00 H new ATOM 2188 N GLY B 878 11.378 13.211 3.250 1.00 0.00 N ATOM 2189 CA GLY B 878 11.971 14.526 3.234 1.00 0.00 C ATOM 2190 C GLY B 878 10.958 15.584 2.871 1.00 0.00 C ATOM 2191 O GLY B 878 11.286 16.760 2.748 1.00 0.00 O ATOM 0 H GLY B 878 10.992 12.926 4.150 1.00 0.00 H new ATOM 0 HA2 GLY B 878 12.395 14.747 4.214 1.00 0.00 H new ATOM 0 HA3 GLY B 878 12.793 14.547 2.519 1.00 0.00 H new ATOM 2195 N ASN B 879 9.718 15.172 2.673 1.00 0.00 N ATOM 2196 CA ASN B 879 8.672 16.111 2.347 1.00 0.00 C ATOM 2197 C ASN B 879 7.503 15.857 3.235 1.00 0.00 C ATOM 2198 O ASN B 879 6.920 14.762 3.198 1.00 0.00 O ATOM 2199 CB ASN B 879 8.200 15.953 0.912 1.00 0.00 C ATOM 2200 CG ASN B 879 7.474 17.176 0.383 1.00 0.00 C ATOM 2201 OD1 ASN B 879 6.833 17.909 1.130 1.00 0.00 O ATOM 2202 ND2 ASN B 879 7.576 17.409 -0.897 1.00 0.00 N ATOM 0 H ASN B 879 9.417 14.199 2.733 1.00 0.00 H new ATOM 0 HA ASN B 879 9.074 17.115 2.480 1.00 0.00 H new ATOM 0 HB2 ASN B 879 9.059 15.745 0.275 1.00 0.00 H new ATOM 0 HB3 ASN B 879 7.538 15.089 0.847 1.00 0.00 H new ATOM 0 HD21 ASN B 879 7.115 18.222 -1.306 1.00 0.00 H new ATOM 0 HD22 ASN B 879 8.117 16.778 -1.489 1.00 0.00 H new ATOM 2209 N ALA B 880 7.140 16.856 3.999 1.00 0.00 N ATOM 2210 CA ALA B 880 6.007 16.778 4.891 1.00 0.00 C ATOM 2211 C ALA B 880 4.710 16.614 4.102 1.00 0.00 C ATOM 2212 O ALA B 880 3.771 15.992 4.576 1.00 0.00 O ATOM 2213 CB ALA B 880 5.949 18.013 5.777 1.00 0.00 C ATOM 0 H ALA B 880 7.625 17.753 4.021 1.00 0.00 H new ATOM 0 HA ALA B 880 6.126 15.902 5.528 1.00 0.00 H new ATOM 0 HB1 ALA B 880 5.090 17.942 6.445 1.00 0.00 H new ATOM 0 HB2 ALA B 880 6.863 18.081 6.367 1.00 0.00 H new ATOM 0 HB3 ALA B 880 5.852 18.903 5.155 1.00 0.00 H new ATOM 2219 N ALA B 881 4.685 17.144 2.879 1.00 0.00 N ATOM 2220 CA ALA B 881 3.513 17.065 2.022 1.00 0.00 C ATOM 2221 C ALA B 881 3.293 15.637 1.560 1.00 0.00 C ATOM 2222 O ALA B 881 2.241 15.061 1.797 1.00 0.00 O ATOM 2223 CB ALA B 881 3.686 17.966 0.813 1.00 0.00 C ATOM 0 H ALA B 881 5.474 17.636 2.461 1.00 0.00 H new ATOM 0 HA ALA B 881 2.646 17.393 2.595 1.00 0.00 H new ATOM 0 HB1 ALA B 881 2.802 17.898 0.179 1.00 0.00 H new ATOM 0 HB2 ALA B 881 3.818 18.996 1.143 1.00 0.00 H new ATOM 0 HB3 ALA B 881 4.563 17.651 0.247 1.00 0.00 H new ATOM 2229 N ASN B 882 4.331 15.055 0.956 1.00 0.00 N ATOM 2230 CA ASN B 882 4.271 13.685 0.432 1.00 0.00 C ATOM 2231 C ASN B 882 3.907 12.706 1.514 1.00 0.00 C ATOM 2232 O ASN B 882 3.020 11.851 1.341 1.00 0.00 O ATOM 2233 CB ASN B 882 5.604 13.269 -0.193 1.00 0.00 C ATOM 2234 CG ASN B 882 5.900 13.971 -1.502 1.00 0.00 C ATOM 2235 OD1 ASN B 882 4.991 14.342 -2.247 1.00 0.00 O ATOM 2236 ND2 ASN B 882 7.157 14.160 -1.801 1.00 0.00 N ATOM 0 H ASN B 882 5.231 15.514 0.816 1.00 0.00 H new ATOM 0 HA ASN B 882 3.499 13.673 -0.337 1.00 0.00 H new ATOM 0 HB2 ASN B 882 6.408 13.478 0.512 1.00 0.00 H new ATOM 0 HB3 ASN B 882 5.598 12.192 -0.360 1.00 0.00 H new ATOM 0 HD21 ASN B 882 7.409 14.626 -2.672 1.00 0.00 H new ATOM 0 HD22 ASN B 882 7.886 13.841 -1.163 1.00 0.00 H new ATOM 2243 N ALA B 883 4.584 12.851 2.627 1.00 0.00 N ATOM 2244 CA ALA B 883 4.375 12.022 3.795 1.00 0.00 C ATOM 2245 C ALA B 883 2.952 12.125 4.322 1.00 0.00 C ATOM 2246 O ALA B 883 2.314 11.108 4.611 1.00 0.00 O ATOM 2247 CB ALA B 883 5.332 12.448 4.850 1.00 0.00 C ATOM 0 H ALA B 883 5.308 13.559 2.751 1.00 0.00 H new ATOM 0 HA ALA B 883 4.541 10.982 3.515 1.00 0.00 H new ATOM 0 HB1 ALA B 883 5.190 11.834 5.739 1.00 0.00 H new ATOM 0 HB2 ALA B 883 6.352 12.328 4.486 1.00 0.00 H new ATOM 0 HB3 ALA B 883 5.156 13.494 5.099 1.00 0.00 H new ATOM 2253 N LYS B 884 2.456 13.338 4.433 1.00 0.00 N ATOM 2254 CA LYS B 884 1.117 13.583 4.949 1.00 0.00 C ATOM 2255 C LYS B 884 0.082 12.993 4.029 1.00 0.00 C ATOM 2256 O LYS B 884 -0.942 12.493 4.472 1.00 0.00 O ATOM 2257 CB LYS B 884 0.909 15.111 5.206 1.00 0.00 C ATOM 2258 CG LYS B 884 -0.535 15.612 5.401 1.00 0.00 C ATOM 2259 CD LYS B 884 -1.218 15.869 4.050 1.00 0.00 C ATOM 2260 CE LYS B 884 -2.643 16.433 4.179 1.00 0.00 C ATOM 2261 NZ LYS B 884 -3.560 15.521 4.895 1.00 0.00 N ATOM 0 H LYS B 884 2.963 14.183 4.170 1.00 0.00 H new ATOM 0 HA LYS B 884 0.998 13.083 5.910 1.00 0.00 H new ATOM 0 HB2 LYS B 884 1.482 15.383 6.093 1.00 0.00 H new ATOM 0 HB3 LYS B 884 1.343 15.655 4.367 1.00 0.00 H new ATOM 0 HG2 LYS B 884 -1.106 14.875 5.966 1.00 0.00 H new ATOM 0 HG3 LYS B 884 -0.529 16.530 5.989 1.00 0.00 H new ATOM 0 HD2 LYS B 884 -0.611 16.566 3.472 1.00 0.00 H new ATOM 0 HD3 LYS B 884 -1.255 14.936 3.487 1.00 0.00 H new ATOM 0 HE2 LYS B 884 -2.604 17.387 4.704 1.00 0.00 H new ATOM 0 HE3 LYS B 884 -3.041 16.633 3.184 1.00 0.00 H new ATOM 0 HZ1 LYS B 884 -4.513 15.937 4.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 884 -3.596 14.607 4.401 1.00 0.00 H new ATOM 0 HZ3 LYS B 884 -3.218 15.377 5.866 1.00 0.00 H new ATOM 2275 N GLN B 885 0.397 12.982 2.766 1.00 0.00 N ATOM 2276 CA GLN B 885 -0.521 12.529 1.765 1.00 0.00 C ATOM 2277 C GLN B 885 -0.709 11.063 1.818 1.00 0.00 C ATOM 2278 O GLN B 885 -1.829 10.611 1.828 1.00 0.00 O ATOM 2279 CB GLN B 885 -0.108 12.965 0.381 1.00 0.00 C ATOM 2280 CG GLN B 885 -0.265 14.449 0.152 1.00 0.00 C ATOM 2281 CD GLN B 885 0.141 14.884 -1.232 1.00 0.00 C ATOM 2282 OE1 GLN B 885 1.162 14.279 -1.785 1.00 0.00 O flip ATOM 2283 NE2 GLN B 885 -0.432 15.811 -1.772 1.00 0.00 N flip ATOM 0 H GLN B 885 1.299 13.288 2.402 1.00 0.00 H new ATOM 0 HA GLN B 885 -1.479 12.998 1.987 1.00 0.00 H new ATOM 0 HB2 GLN B 885 0.933 12.687 0.215 1.00 0.00 H new ATOM 0 HB3 GLN B 885 -0.704 12.425 -0.355 1.00 0.00 H new ATOM 0 HG2 GLN B 885 -1.305 14.728 0.323 1.00 0.00 H new ATOM 0 HG3 GLN B 885 0.334 14.988 0.885 1.00 0.00 H new ATOM 0 HE21 GLN B 885 -1.224 16.259 -1.311 1.00 0.00 H new ATOM 0 HE22 GLN B 885 -0.120 16.141 -2.686 1.00 0.00 H new ATOM 2292 N LEU B 886 0.374 10.314 1.869 1.00 0.00 N ATOM 2293 CA LEU B 886 0.244 8.885 1.904 1.00 0.00 C ATOM 2294 C LEU B 886 -0.317 8.433 3.257 1.00 0.00 C ATOM 2295 O LEU B 886 -1.156 7.562 3.298 1.00 0.00 O ATOM 2296 CB LEU B 886 1.580 8.196 1.559 1.00 0.00 C ATOM 2297 CG LEU B 886 2.565 7.965 2.700 1.00 0.00 C ATOM 2298 CD1 LEU B 886 2.459 6.532 3.208 1.00 0.00 C ATOM 2299 CD2 LEU B 886 3.976 8.293 2.283 1.00 0.00 C ATOM 0 H LEU B 886 1.331 10.667 1.887 1.00 0.00 H new ATOM 0 HA LEU B 886 -0.469 8.579 1.138 1.00 0.00 H new ATOM 0 HB2 LEU B 886 1.354 7.230 1.108 1.00 0.00 H new ATOM 0 HB3 LEU B 886 2.081 8.794 0.797 1.00 0.00 H new ATOM 0 HG LEU B 886 2.305 8.639 3.516 1.00 0.00 H new ATOM 0 HD11 LEU B 886 3.168 6.381 4.022 1.00 0.00 H new ATOM 0 HD12 LEU B 886 1.447 6.348 3.569 1.00 0.00 H new ATOM 0 HD13 LEU B 886 2.686 5.841 2.397 1.00 0.00 H new ATOM 0 HD21 LEU B 886 4.653 8.117 3.119 1.00 0.00 H new ATOM 0 HD22 LEU B 886 4.264 7.660 1.444 1.00 0.00 H new ATOM 0 HD23 LEU B 886 4.033 9.340 1.984 1.00 0.00 H new ATOM 2311 N TYR B 887 0.091 9.098 4.353 1.00 0.00 N ATOM 2312 CA TYR B 887 -0.354 8.683 5.689 1.00 0.00 C ATOM 2313 C TYR B 887 -1.853 8.932 5.852 1.00 0.00 C ATOM 2314 O TYR B 887 -2.598 8.064 6.289 1.00 0.00 O ATOM 2315 CB TYR B 887 0.437 9.426 6.773 1.00 0.00 C ATOM 2316 CG TYR B 887 0.198 8.943 8.201 1.00 0.00 C ATOM 2317 CD1 TYR B 887 0.952 7.903 8.736 1.00 0.00 C ATOM 2318 CD2 TYR B 887 -0.754 9.546 9.018 1.00 0.00 C ATOM 2319 CE1 TYR B 887 0.766 7.481 10.038 1.00 0.00 C ATOM 2320 CE2 TYR B 887 -0.949 9.122 10.321 1.00 0.00 C ATOM 2321 CZ TYR B 887 -0.184 8.091 10.827 1.00 0.00 C ATOM 2322 OH TYR B 887 -0.369 7.669 12.134 1.00 0.00 O ATOM 0 H TYR B 887 0.713 9.906 4.340 1.00 0.00 H new ATOM 0 HA TYR B 887 -0.168 7.615 5.800 1.00 0.00 H new ATOM 0 HB2 TYR B 887 1.500 9.336 6.550 1.00 0.00 H new ATOM 0 HB3 TYR B 887 0.188 10.486 6.719 1.00 0.00 H new ATOM 0 HD1 TYR B 887 1.696 7.417 8.122 1.00 0.00 H new ATOM 0 HD2 TYR B 887 -1.350 10.358 8.629 1.00 0.00 H new ATOM 0 HE1 TYR B 887 1.364 6.675 10.436 1.00 0.00 H new ATOM 0 HE2 TYR B 887 -1.697 9.596 10.939 1.00 0.00 H new ATOM 0 HH TYR B 887 -1.076 8.203 12.553 1.00 0.00 H new ATOM 2332 N ASP B 888 -2.291 10.105 5.443 1.00 0.00 N ATOM 2333 CA ASP B 888 -3.693 10.488 5.547 1.00 0.00 C ATOM 2334 C ASP B 888 -4.543 9.603 4.674 1.00 0.00 C ATOM 2335 O ASP B 888 -5.621 9.213 5.068 1.00 0.00 O ATOM 2336 CB ASP B 888 -3.873 11.944 5.145 1.00 0.00 C ATOM 2337 CG ASP B 888 -5.315 12.401 5.131 1.00 0.00 C ATOM 2338 OD1 ASP B 888 -5.950 12.463 6.202 1.00 0.00 O ATOM 2339 OD2 ASP B 888 -5.820 12.737 4.040 1.00 0.00 O ATOM 0 H ASP B 888 -1.692 10.820 5.030 1.00 0.00 H new ATOM 0 HA ASP B 888 -4.009 10.367 6.583 1.00 0.00 H new ATOM 0 HB2 ASP B 888 -3.309 12.573 5.833 1.00 0.00 H new ATOM 0 HB3 ASP B 888 -3.445 12.093 4.154 1.00 0.00 H new ATOM 2344 N PHE B 889 -3.972 9.222 3.537 1.00 0.00 N ATOM 2345 CA PHE B 889 -4.600 8.381 2.524 1.00 0.00 C ATOM 2346 C PHE B 889 -4.841 7.008 3.089 1.00 0.00 C ATOM 2347 O PHE B 889 -5.892 6.413 2.897 1.00 0.00 O ATOM 2348 CB PHE B 889 -3.649 8.329 1.302 1.00 0.00 C ATOM 2349 CG PHE B 889 -3.822 7.206 0.307 1.00 0.00 C ATOM 2350 CD1 PHE B 889 -3.163 5.994 0.491 1.00 0.00 C ATOM 2351 CD2 PHE B 889 -4.589 7.371 -0.824 1.00 0.00 C ATOM 2352 CE1 PHE B 889 -3.279 4.973 -0.422 1.00 0.00 C ATOM 2353 CE2 PHE B 889 -4.703 6.353 -1.752 1.00 0.00 C ATOM 2354 CZ PHE B 889 -4.049 5.150 -1.549 1.00 0.00 C ATOM 0 H PHE B 889 -3.024 9.501 3.286 1.00 0.00 H new ATOM 0 HA PHE B 889 -5.565 8.785 2.217 1.00 0.00 H new ATOM 0 HB2 PHE B 889 -3.750 9.270 0.762 1.00 0.00 H new ATOM 0 HB3 PHE B 889 -2.627 8.286 1.678 1.00 0.00 H new ATOM 0 HD1 PHE B 889 -2.549 5.853 1.368 1.00 0.00 H new ATOM 0 HD2 PHE B 889 -5.107 8.305 -0.988 1.00 0.00 H new ATOM 0 HE1 PHE B 889 -2.768 4.036 -0.256 1.00 0.00 H new ATOM 0 HE2 PHE B 889 -5.304 6.497 -2.638 1.00 0.00 H new ATOM 0 HZ PHE B 889 -4.143 4.353 -2.272 1.00 0.00 H new ATOM 2364 N ILE B 890 -3.876 6.536 3.808 1.00 0.00 N ATOM 2365 CA ILE B 890 -3.942 5.255 4.397 1.00 0.00 C ATOM 2366 C ILE B 890 -4.985 5.199 5.506 1.00 0.00 C ATOM 2367 O ILE B 890 -5.812 4.283 5.555 1.00 0.00 O ATOM 2368 CB ILE B 890 -2.544 4.813 4.890 1.00 0.00 C ATOM 2369 CG1 ILE B 890 -1.640 4.589 3.676 1.00 0.00 C ATOM 2370 CG2 ILE B 890 -2.612 3.582 5.776 1.00 0.00 C ATOM 2371 CD1 ILE B 890 -0.263 4.113 4.004 1.00 0.00 C ATOM 0 H ILE B 890 -3.012 7.042 4.001 1.00 0.00 H new ATOM 0 HA ILE B 890 -4.264 4.546 3.634 1.00 0.00 H new ATOM 0 HB ILE B 890 -2.123 5.603 5.512 1.00 0.00 H new ATOM 0 HG12 ILE B 890 -2.114 3.862 3.016 1.00 0.00 H new ATOM 0 HG13 ILE B 890 -1.564 5.523 3.119 1.00 0.00 H new ATOM 0 HG21 ILE B 890 -1.607 3.309 6.098 1.00 0.00 H new ATOM 0 HG22 ILE B 890 -3.227 3.796 6.650 1.00 0.00 H new ATOM 0 HG23 ILE B 890 -3.051 2.755 5.217 1.00 0.00 H new ATOM 0 HD11 ILE B 890 0.306 3.982 3.083 1.00 0.00 H new ATOM 0 HD12 ILE B 890 0.235 4.848 4.636 1.00 0.00 H new ATOM 0 HD13 ILE B 890 -0.323 3.161 4.532 1.00 0.00 H new ATOM 2383 N HIS B 891 -5.008 6.212 6.330 1.00 0.00 N ATOM 2384 CA HIS B 891 -5.868 6.191 7.498 1.00 0.00 C ATOM 2385 C HIS B 891 -7.231 6.852 7.263 1.00 0.00 C ATOM 2386 O HIS B 891 -7.981 7.087 8.208 1.00 0.00 O ATOM 2387 CB HIS B 891 -5.149 6.792 8.715 1.00 0.00 C ATOM 2388 CG HIS B 891 -3.869 6.077 9.061 1.00 0.00 C ATOM 2389 ND1 HIS B 891 -3.796 4.897 9.764 1.00 0.00 N ATOM 2390 CD2 HIS B 891 -2.599 6.387 8.744 1.00 0.00 C ATOM 2391 CE1 HIS B 891 -2.513 4.547 9.841 1.00 0.00 C ATOM 2392 NE2 HIS B 891 -1.748 5.420 9.235 1.00 0.00 N ATOM 0 H HIS B 891 -4.449 7.058 6.222 1.00 0.00 H new ATOM 0 HA HIS B 891 -6.083 5.143 7.706 1.00 0.00 H new ATOM 0 HB2 HIS B 891 -4.930 7.841 8.518 1.00 0.00 H new ATOM 0 HB3 HIS B 891 -5.818 6.763 9.575 1.00 0.00 H new ATOM 0 HD1 HIS B 891 -4.584 4.382 10.156 1.00 0.00 H new ATOM 0 HD2 HIS B 891 -2.292 7.261 8.189 1.00 0.00 H new ATOM 0 HE1 HIS B 891 -2.151 3.659 10.338 1.00 0.00 H new ATOM 2400 N THR B 892 -7.569 7.124 6.027 1.00 0.00 N ATOM 2401 CA THR B 892 -8.876 7.671 5.715 1.00 0.00 C ATOM 2402 C THR B 892 -9.721 6.586 5.036 1.00 0.00 C ATOM 2403 O THR B 892 -9.177 5.577 4.541 1.00 0.00 O ATOM 2404 CB THR B 892 -8.797 8.974 4.836 1.00 0.00 C ATOM 2405 OG1 THR B 892 -10.103 9.529 4.599 1.00 0.00 O ATOM 2406 CG2 THR B 892 -8.114 8.724 3.518 1.00 0.00 C ATOM 0 H THR B 892 -6.963 6.978 5.220 1.00 0.00 H new ATOM 0 HA THR B 892 -9.351 7.975 6.648 1.00 0.00 H new ATOM 0 HB THR B 892 -8.203 9.690 5.403 1.00 0.00 H new ATOM 0 HG1 THR B 892 -10.020 10.338 4.052 1.00 0.00 H new ATOM 0 HG21 THR B 892 -8.081 9.650 2.944 1.00 0.00 H new ATOM 0 HG22 THR B 892 -7.098 8.371 3.696 1.00 0.00 H new ATOM 0 HG23 THR B 892 -8.667 7.969 2.959 1.00 0.00 H new ATOM 2414 N SER B 893 -11.019 6.747 5.040 1.00 0.00 N ATOM 2415 CA SER B 893 -11.876 5.775 4.451 1.00 0.00 C ATOM 2416 C SER B 893 -12.588 6.368 3.248 1.00 0.00 C ATOM 2417 O SER B 893 -13.194 7.417 3.326 1.00 0.00 O ATOM 2418 CB SER B 893 -12.903 5.317 5.469 1.00 0.00 C ATOM 2419 OG SER B 893 -12.296 5.083 6.736 1.00 0.00 O ATOM 0 H SER B 893 -11.499 7.549 5.449 1.00 0.00 H new ATOM 0 HA SER B 893 -11.276 4.924 4.128 1.00 0.00 H new ATOM 0 HB2 SER B 893 -13.683 6.072 5.569 1.00 0.00 H new ATOM 0 HB3 SER B 893 -13.386 4.405 5.119 1.00 0.00 H new ATOM 0 HG SER B 893 -12.978 4.790 7.376 1.00 0.00 H new ATOM 2425 N PHE B 894 -12.478 5.725 2.140 1.00 0.00 N ATOM 2426 CA PHE B 894 -13.195 6.136 0.957 1.00 0.00 C ATOM 2427 C PHE B 894 -14.675 5.840 1.103 1.00 0.00 C ATOM 2428 O PHE B 894 -15.529 6.658 0.761 1.00 0.00 O ATOM 2429 CB PHE B 894 -12.585 5.514 -0.292 1.00 0.00 C ATOM 2430 CG PHE B 894 -12.161 4.077 -0.131 1.00 0.00 C ATOM 2431 CD1 PHE B 894 -13.063 3.057 -0.287 1.00 0.00 C ATOM 2432 CD2 PHE B 894 -10.847 3.760 0.192 1.00 0.00 C ATOM 2433 CE1 PHE B 894 -12.676 1.754 -0.130 1.00 0.00 C ATOM 2434 CE2 PHE B 894 -10.450 2.457 0.351 1.00 0.00 C ATOM 2435 CZ PHE B 894 -11.365 1.450 0.189 1.00 0.00 C ATOM 0 H PHE B 894 -11.893 4.899 2.015 1.00 0.00 H new ATOM 0 HA PHE B 894 -13.099 7.216 0.841 1.00 0.00 H new ATOM 0 HB2 PHE B 894 -13.309 5.577 -1.105 1.00 0.00 H new ATOM 0 HB3 PHE B 894 -11.718 6.104 -0.590 1.00 0.00 H new ATOM 0 HD1 PHE B 894 -14.089 3.284 -0.536 1.00 0.00 H new ATOM 0 HD2 PHE B 894 -10.126 4.554 0.320 1.00 0.00 H new ATOM 0 HE1 PHE B 894 -13.397 0.960 -0.256 1.00 0.00 H new ATOM 0 HE2 PHE B 894 -9.425 2.227 0.602 1.00 0.00 H new ATOM 0 HZ PHE B 894 -11.063 0.420 0.310 1.00 0.00 H new