USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 537 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 387 TYR OH : rot 48:sc= -4.06! USER MOD Set 1.2: A 404 CYS SG : rot 107:sc= 0.0317 USER MOD Single : A 369 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 371 LYS NZ :NH3+ -99:sc=-0.00934 (180deg=-0.214) USER MOD Single : A 373 GLN :FLIP amide:sc= -1.4! C(o=-3.6!,f=-1.4!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -40:sc= 0.442 USER MOD Single : A 380 TYR OH : rot -135:sc= 1.02 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc=-0.00293 X(o=-0.0029,f=-0.075) USER MOD Single : A 389 THR OG1 : rot 2:sc= 1.03 USER MOD Single : A 399 ASN : amide:sc= -0.4 X(o=-0.4,f=-0.038) USER MOD Single : A 400 SER OG : rot -140:sc= 0 USER MOD Single : A 410 THR OG1 : rot 26:sc= 0.0852 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.16 USER MOD Single : A 419 ASN : amide:sc= -2.1 K(o=-2.1,f=-4.4!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -1.63 X(o=-1.6,f=-1.8!) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ -169:sc= -0.127 (180deg=-0.165) USER MOD Single : A 437 MET CE :methyl 140:sc= -0.402 (180deg=-2.06) USER MOD Single : A 441 TYR OH : rot 30:sc= -2.58! USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.348 X(o=-0.35,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.613 -2.298 8.864 1.00 0.00 N ATOM 103 CA ASN A 369 -2.537 -1.711 9.653 1.00 0.00 C ATOM 104 C ASN A 369 -1.570 -0.944 8.763 1.00 0.00 C ATOM 105 O ASN A 369 -1.369 0.258 8.935 1.00 0.00 O ATOM 106 CB ASN A 369 -1.780 -2.796 10.424 1.00 0.00 C ATOM 107 CG ASN A 369 -2.670 -3.557 11.386 1.00 0.00 C ATOM 108 OD1 ASN A 369 -3.064 -3.036 12.431 1.00 0.00 O ATOM 109 ND2 ASN A 369 -2.992 -4.798 11.040 1.00 0.00 N ATOM 0 HA ASN A 369 -2.985 -1.017 10.365 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -1.335 -3.495 9.716 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -0.961 -2.338 10.978 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -3.588 -5.359 11.649 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -2.644 -5.190 10.165 1.00 0.00 H new ATOM 116 N ALA A 370 -0.973 -1.650 7.815 1.00 0.00 N ATOM 117 CA ALA A 370 -0.022 -1.040 6.897 1.00 0.00 C ATOM 118 C ALA A 370 -0.696 0.021 6.033 1.00 0.00 C ATOM 119 O ALA A 370 -0.062 0.997 5.634 1.00 0.00 O ATOM 120 CB ALA A 370 0.635 -2.101 6.027 1.00 0.00 C ATOM 0 H ALA A 370 -1.130 -2.646 7.661 1.00 0.00 H new ATOM 0 HA ALA A 370 0.751 -0.550 7.489 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.343 -1.627 5.347 1.00 0.00 H new ATOM 0 HB2 ALA A 370 1.162 -2.815 6.660 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.129 -2.623 5.450 1.00 0.00 H new ATOM 126 N LYS A 371 -1.986 -0.160 5.756 1.00 0.00 N ATOM 127 CA LYS A 371 -2.718 0.809 4.949 1.00 0.00 C ATOM 128 C LYS A 371 -3.055 2.033 5.785 1.00 0.00 C ATOM 129 O LYS A 371 -2.997 3.162 5.300 1.00 0.00 O ATOM 130 CB LYS A 371 -3.993 0.195 4.365 1.00 0.00 C ATOM 131 CG LYS A 371 -3.922 -0.040 2.865 1.00 0.00 C ATOM 132 CD LYS A 371 -5.202 0.390 2.168 1.00 0.00 C ATOM 133 CE LYS A 371 -6.344 -0.572 2.456 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.219 -0.084 3.556 1.00 0.00 N ATOM 0 H LYS A 371 -2.538 -0.957 6.074 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.081 1.109 4.117 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.191 -0.753 4.864 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.835 0.852 4.582 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -3.078 0.511 2.450 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.739 -1.097 2.670 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.477 1.392 2.497 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.032 0.443 1.093 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.939 -0.709 1.553 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.938 -1.548 2.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -6.958 -0.558 4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.100 0.943 3.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.212 -0.296 3.330 1.00 0.00 H new ATOM 148 N ARG A 372 -3.381 1.806 7.053 1.00 0.00 N ATOM 149 CA ARG A 372 -3.696 2.903 7.954 1.00 0.00 C ATOM 150 C ARG A 372 -2.439 3.718 8.207 1.00 0.00 C ATOM 151 O ARG A 372 -2.487 4.940 8.336 1.00 0.00 O ATOM 152 CB ARG A 372 -4.260 2.377 9.276 1.00 0.00 C ATOM 153 CG ARG A 372 -5.670 1.822 9.161 1.00 0.00 C ATOM 154 CD ARG A 372 -6.311 1.645 10.528 1.00 0.00 C ATOM 155 NE ARG A 372 -5.675 0.580 11.299 1.00 0.00 N ATOM 156 CZ ARG A 372 -5.768 0.464 12.622 1.00 0.00 C ATOM 157 NH1 ARG A 372 -6.472 1.344 13.325 1.00 0.00 N ATOM 158 NH2 ARG A 372 -5.157 -0.534 13.245 1.00 0.00 N ATOM 0 H ARG A 372 -3.433 0.879 7.475 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.455 3.534 7.492 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.602 1.596 9.657 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -4.255 3.183 10.009 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -6.279 2.494 8.557 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -5.644 0.863 8.643 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -6.246 2.581 11.082 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -7.370 1.420 10.405 1.00 0.00 H new ATOM 0 HE ARG A 372 -5.127 -0.116 10.794 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -6.945 2.114 12.851 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -6.540 1.250 14.338 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -4.615 -1.213 12.711 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -5.229 -0.622 14.259 1.00 0.00 H new ATOM 170 N GLN A 373 -1.308 3.023 8.249 1.00 0.00 N ATOM 171 CA GLN A 373 -0.022 3.664 8.455 1.00 0.00 C ATOM 172 C GLN A 373 0.250 4.641 7.329 1.00 0.00 C ATOM 173 O GLN A 373 0.425 5.837 7.557 1.00 0.00 O ATOM 174 CB GLN A 373 1.088 2.604 8.528 1.00 0.00 C ATOM 175 CG GLN A 373 2.380 3.085 9.178 1.00 0.00 C ATOM 176 CD GLN A 373 2.148 3.965 10.393 1.00 0.00 C ATOM 177 OE1 GLN A 373 1.713 5.196 10.157 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 2.358 3.541 11.531 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.260 2.010 8.142 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.040 4.212 9.397 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.715 1.744 9.084 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.311 2.259 7.518 1.00 0.00 H new ATOM 0 HG2 GLN A 373 2.975 2.220 9.472 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.964 3.639 8.443 1.00 0.00 H new ATOM 0 HE21 GLN A 373 2.692 2.587 11.666 1.00 0.00 H new ATOM 0 HE22 GLN A 373 2.197 4.144 12.338 1.00 0.00 H new ATOM 187 N LEU A 374 0.273 4.129 6.111 1.00 0.00 N ATOM 188 CA LEU A 374 0.519 4.962 4.951 1.00 0.00 C ATOM 189 C LEU A 374 -0.529 6.059 4.832 1.00 0.00 C ATOM 190 O LEU A 374 -0.201 7.216 4.594 1.00 0.00 O ATOM 191 CB LEU A 374 0.531 4.109 3.686 1.00 0.00 C ATOM 192 CG LEU A 374 1.902 3.576 3.269 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.451 2.633 4.327 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.812 2.873 1.922 1.00 0.00 C ATOM 0 H LEU A 374 0.124 3.142 5.901 1.00 0.00 H new ATOM 0 HA LEU A 374 1.493 5.435 5.073 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.140 3.263 3.832 1.00 0.00 H new ATOM 0 HB3 LEU A 374 0.125 4.700 2.865 1.00 0.00 H new ATOM 0 HG LEU A 374 2.586 4.419 3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.427 2.263 4.014 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.551 3.166 5.273 1.00 0.00 H new ATOM 0 HD13 LEU A 374 1.769 1.793 4.455 1.00 0.00 H new ATOM 0 HD21 LEU A 374 2.796 2.500 1.640 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.114 2.039 1.993 1.00 0.00 H new ATOM 0 HD23 LEU A 374 1.461 3.577 1.167 1.00 0.00 H new ATOM 206 N TYR A 375 -1.790 5.698 4.996 1.00 0.00 N ATOM 207 CA TYR A 375 -2.863 6.675 4.894 1.00 0.00 C ATOM 208 C TYR A 375 -2.814 7.668 6.046 1.00 0.00 C ATOM 209 O TYR A 375 -3.265 8.805 5.914 1.00 0.00 O ATOM 210 CB TYR A 375 -4.224 5.978 4.852 1.00 0.00 C ATOM 211 CG TYR A 375 -5.198 6.604 3.880 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.642 7.908 4.054 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.672 5.890 2.788 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.532 8.483 3.167 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.562 6.457 1.896 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.990 7.753 2.090 1.00 0.00 C ATOM 217 OH TYR A 375 -7.877 8.321 1.205 1.00 0.00 O ATOM 0 H TYR A 375 -2.095 4.746 5.198 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.724 7.227 3.964 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.078 4.932 4.583 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.661 5.993 5.851 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -5.286 8.482 4.896 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.340 4.874 2.633 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.867 9.499 3.316 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -6.921 5.888 1.051 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.099 7.674 0.503 1.00 0.00 H new ATOM 227 N SER A 376 -2.257 7.242 7.172 1.00 0.00 N ATOM 228 CA SER A 376 -2.150 8.112 8.330 1.00 0.00 C ATOM 229 C SER A 376 -0.756 8.726 8.424 1.00 0.00 C ATOM 230 O SER A 376 -0.447 9.424 9.391 1.00 0.00 O ATOM 231 CB SER A 376 -2.467 7.338 9.612 1.00 0.00 C ATOM 232 OG SER A 376 -2.620 8.216 10.714 1.00 0.00 O ATOM 0 H SER A 376 -1.875 6.306 7.306 1.00 0.00 H new ATOM 0 HA SER A 376 -2.875 8.917 8.213 1.00 0.00 H new ATOM 0 HB2 SER A 376 -3.381 6.759 9.475 1.00 0.00 H new ATOM 0 HB3 SER A 376 -1.667 6.627 9.818 1.00 0.00 H new ATOM 0 HG SER A 376 -1.948 8.927 10.661 1.00 0.00 H new ATOM 238 N LEU A 377 0.094 8.456 7.431 1.00 0.00 N ATOM 239 CA LEU A 377 1.437 8.972 7.435 1.00 0.00 C ATOM 240 C LEU A 377 1.768 9.685 6.120 1.00 0.00 C ATOM 241 O LEU A 377 2.608 10.581 6.098 1.00 0.00 O ATOM 242 CB LEU A 377 2.392 7.828 7.728 1.00 0.00 C ATOM 243 CG LEU A 377 2.849 7.055 6.520 1.00 0.00 C ATOM 244 CD1 LEU A 377 4.032 7.756 5.921 1.00 0.00 C ATOM 245 CD2 LEU A 377 3.176 5.618 6.895 1.00 0.00 C ATOM 0 H LEU A 377 -0.137 7.882 6.620 1.00 0.00 H new ATOM 0 HA LEU A 377 1.540 9.727 8.215 1.00 0.00 H new ATOM 0 HB2 LEU A 377 3.269 8.228 8.238 1.00 0.00 H new ATOM 0 HB3 LEU A 377 1.908 7.139 8.420 1.00 0.00 H new ATOM 0 HG LEU A 377 2.051 7.014 5.779 1.00 0.00 H new ATOM 0 HD11 LEU A 377 4.375 7.207 5.044 1.00 0.00 H new ATOM 0 HD12 LEU A 377 3.746 8.766 5.628 1.00 0.00 H new ATOM 0 HD13 LEU A 377 4.836 7.805 6.655 1.00 0.00 H new ATOM 0 HD21 LEU A 377 3.504 5.076 6.008 1.00 0.00 H new ATOM 0 HD22 LEU A 377 3.971 5.608 7.641 1.00 0.00 H new ATOM 0 HD23 LEU A 377 2.288 5.138 7.305 1.00 0.00 H new ATOM 257 N ILE A 378 1.096 9.305 5.027 1.00 0.00 N ATOM 258 CA ILE A 378 1.330 9.951 3.732 1.00 0.00 C ATOM 259 C ILE A 378 0.028 10.426 3.095 1.00 0.00 C ATOM 260 O ILE A 378 -0.020 11.493 2.482 1.00 0.00 O ATOM 261 CB ILE A 378 2.064 9.040 2.720 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.336 7.710 2.535 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.499 8.799 3.147 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.685 7.020 1.237 1.00 0.00 C ATOM 0 H ILE A 378 0.395 8.564 5.013 1.00 0.00 H new ATOM 0 HA ILE A 378 1.970 10.804 3.956 1.00 0.00 H new ATOM 0 HB ILE A 378 2.070 9.559 1.761 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.580 7.050 3.368 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.260 7.883 2.570 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.992 8.156 2.418 1.00 0.00 H new ATOM 0 HG22 ILE A 378 4.026 9.751 3.206 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.512 8.316 4.124 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.136 6.081 1.165 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.416 7.663 0.399 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.756 6.817 1.209 1.00 0.00 H new ATOM 276 N GLY A 379 -1.023 9.627 3.234 1.00 0.00 N ATOM 277 CA GLY A 379 -2.306 9.981 2.655 1.00 0.00 C ATOM 278 C GLY A 379 -2.933 11.198 3.307 1.00 0.00 C ATOM 279 O GLY A 379 -3.261 11.176 4.493 1.00 0.00 O ATOM 0 H GLY A 379 -1.010 8.740 3.737 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.178 10.172 1.590 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -2.986 9.135 2.748 1.00 0.00 H new ATOM 283 N TYR A 380 -3.109 12.263 2.527 1.00 0.00 N ATOM 284 CA TYR A 380 -3.712 13.488 3.037 1.00 0.00 C ATOM 285 C TYR A 380 -5.101 13.699 2.444 1.00 0.00 C ATOM 286 O TYR A 380 -5.981 14.268 3.091 1.00 0.00 O ATOM 287 CB TYR A 380 -2.827 14.708 2.746 1.00 0.00 C ATOM 288 CG TYR A 380 -1.966 14.581 1.506 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.535 14.426 0.248 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.581 14.624 1.598 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.747 14.314 -0.882 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.214 14.513 0.474 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.374 14.358 -0.763 1.00 0.00 C ATOM 294 OH TYR A 380 0.415 14.250 -1.885 1.00 0.00 O ATOM 0 H TYR A 380 -2.843 12.300 1.543 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.804 13.380 4.118 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.464 15.586 2.641 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.180 14.884 3.605 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.610 14.392 0.152 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.117 14.746 2.566 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -2.204 14.193 -1.853 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.290 14.547 0.564 1.00 0.00 H new ATOM 0 HH TYR A 380 1.151 13.627 -1.709 1.00 0.00 H new ATOM 304 N ALA A 381 -5.295 13.237 1.210 1.00 0.00 N ATOM 305 CA ALA A 381 -6.581 13.375 0.528 1.00 0.00 C ATOM 306 C ALA A 381 -6.465 13.007 -0.948 1.00 0.00 C ATOM 307 O ALA A 381 -6.997 11.987 -1.387 1.00 0.00 O ATOM 308 CB ALA A 381 -7.116 14.794 0.672 1.00 0.00 C ATOM 0 H ALA A 381 -4.577 12.763 0.661 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.281 12.685 0.999 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -8.073 14.876 0.158 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.251 15.027 1.728 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.407 15.496 0.233 1.00 0.00 H new ATOM 314 N SER A 382 -5.770 13.847 -1.708 1.00 0.00 N ATOM 315 CA SER A 382 -5.587 13.617 -3.138 1.00 0.00 C ATOM 316 C SER A 382 -5.006 12.232 -3.407 1.00 0.00 C ATOM 317 O SER A 382 -5.381 11.567 -4.372 1.00 0.00 O ATOM 318 CB SER A 382 -4.674 14.691 -3.735 1.00 0.00 C ATOM 319 OG SER A 382 -5.430 15.722 -4.345 1.00 0.00 O ATOM 0 H SER A 382 -5.323 14.694 -1.358 1.00 0.00 H new ATOM 0 HA SER A 382 -6.566 13.673 -3.613 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.043 15.113 -2.952 1.00 0.00 H new ATOM 0 HB3 SER A 382 -4.009 14.239 -4.471 1.00 0.00 H new ATOM 0 HG SER A 382 -4.824 16.396 -4.717 1.00 0.00 H new ATOM 325 N LEU A 383 -4.088 11.806 -2.549 1.00 0.00 N ATOM 326 CA LEU A 383 -3.455 10.500 -2.697 1.00 0.00 C ATOM 327 C LEU A 383 -4.355 9.394 -2.154 1.00 0.00 C ATOM 328 O LEU A 383 -4.115 8.859 -1.072 1.00 0.00 O ATOM 329 CB LEU A 383 -2.106 10.476 -1.977 1.00 0.00 C ATOM 330 CG LEU A 383 -1.091 9.482 -2.540 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.465 10.024 -3.815 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.020 9.171 -1.505 1.00 0.00 C ATOM 0 H LEU A 383 -3.765 12.344 -1.745 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.293 10.323 -3.760 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.673 11.476 -2.015 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.276 10.242 -0.926 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.612 8.556 -2.782 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.255 9.303 -4.202 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -1.243 10.194 -4.559 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.043 10.964 -3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.694 8.462 -1.923 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.499 10.090 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.485 8.739 -0.619 1.00 0.00 H new ATOM 344 N ARG A 384 -5.389 9.054 -2.916 1.00 0.00 N ATOM 345 CA ARG A 384 -6.323 8.010 -2.514 1.00 0.00 C ATOM 346 C ARG A 384 -5.629 6.652 -2.475 1.00 0.00 C ATOM 347 O ARG A 384 -5.742 5.860 -3.410 1.00 0.00 O ATOM 348 CB ARG A 384 -7.513 7.963 -3.474 1.00 0.00 C ATOM 349 CG ARG A 384 -8.314 9.254 -3.512 1.00 0.00 C ATOM 350 CD ARG A 384 -8.347 9.853 -4.910 1.00 0.00 C ATOM 351 NE ARG A 384 -9.465 10.777 -5.082 1.00 0.00 N ATOM 352 CZ ARG A 384 -9.933 11.162 -6.268 1.00 0.00 C ATOM 353 NH1 ARG A 384 -9.382 10.707 -7.386 1.00 0.00 N ATOM 354 NH2 ARG A 384 -10.955 12.004 -6.336 1.00 0.00 N ATOM 0 H ARG A 384 -5.601 9.486 -3.815 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.685 8.243 -1.513 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -7.151 7.740 -4.478 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -8.172 7.145 -3.183 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -9.332 9.061 -3.174 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -7.879 9.973 -2.818 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -7.411 10.377 -5.102 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -8.421 9.052 -5.646 1.00 0.00 H new ATOM 0 HE ARG A 384 -9.914 11.149 -4.245 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -8.596 10.059 -7.340 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -9.745 11.005 -8.291 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -11.383 12.357 -5.480 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -11.313 12.299 -7.244 1.00 0.00 H new ATOM 366 N LEU A 385 -4.910 6.392 -1.388 1.00 0.00 N ATOM 367 CA LEU A 385 -4.195 5.131 -1.228 1.00 0.00 C ATOM 368 C LEU A 385 -5.137 3.941 -1.390 1.00 0.00 C ATOM 369 O LEU A 385 -6.009 3.707 -0.553 1.00 0.00 O ATOM 370 CB LEU A 385 -3.515 5.074 0.143 1.00 0.00 C ATOM 371 CG LEU A 385 -2.588 3.874 0.352 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.132 4.298 0.246 1.00 0.00 C ATOM 373 CD2 LEU A 385 -2.857 3.217 1.699 1.00 0.00 C ATOM 0 H LEU A 385 -4.807 7.038 -0.605 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.434 5.076 -2.007 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.939 5.989 0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.285 5.059 0.914 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.791 3.144 -0.432 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -0.489 3.431 0.397 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.947 4.719 -0.742 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -0.915 5.048 1.007 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -2.188 2.366 1.829 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.685 3.939 2.497 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -3.891 2.875 1.737 1.00 0.00 H new ATOM 385 N HIS A 386 -4.954 3.193 -2.473 1.00 0.00 N ATOM 386 CA HIS A 386 -5.783 2.027 -2.749 1.00 0.00 C ATOM 387 C HIS A 386 -4.919 0.839 -3.157 1.00 0.00 C ATOM 388 O HIS A 386 -3.848 1.011 -3.739 1.00 0.00 O ATOM 389 CB HIS A 386 -6.796 2.342 -3.852 1.00 0.00 C ATOM 390 CG HIS A 386 -7.904 1.341 -3.954 1.00 0.00 C ATOM 391 ND1 HIS A 386 -8.700 0.985 -2.885 1.00 0.00 N ATOM 392 CD2 HIS A 386 -8.349 0.616 -5.008 1.00 0.00 C ATOM 393 CE1 HIS A 386 -9.586 0.087 -3.277 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.395 -0.154 -4.561 1.00 0.00 N ATOM 0 H HIS A 386 -4.237 3.375 -3.175 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.323 1.768 -1.838 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.224 3.328 -3.669 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.275 2.393 -4.808 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.955 0.639 -6.013 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -10.339 -0.372 -2.653 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.936 -0.806 -5.129 1.00 0.00 H new ATOM 403 N TYR A 387 -5.384 -0.366 -2.846 1.00 0.00 N ATOM 404 CA TYR A 387 -4.644 -1.575 -3.179 1.00 0.00 C ATOM 405 C TYR A 387 -5.401 -2.429 -4.187 1.00 0.00 C ATOM 406 O TYR A 387 -6.555 -2.797 -3.968 1.00 0.00 O ATOM 407 CB TYR A 387 -4.352 -2.382 -1.915 1.00 0.00 C ATOM 408 CG TYR A 387 -3.217 -1.811 -1.102 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.306 -0.537 -0.560 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.052 -2.537 -0.888 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.268 -0.001 0.176 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.010 -2.008 -0.155 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.122 -0.740 0.375 1.00 0.00 C ATOM 414 OH TYR A 387 -0.085 -0.206 1.103 1.00 0.00 O ATOM 0 H TYR A 387 -6.268 -0.530 -2.365 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.701 -1.275 -3.635 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.250 -2.420 -1.299 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.113 -3.408 -2.193 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.202 0.045 -0.716 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.961 -3.530 -1.302 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.354 0.991 0.593 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.110 -2.584 0.003 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.433 0.178 1.935 1.00 0.00 H new ATOM 424 N VAL A 388 -4.736 -2.741 -5.294 1.00 0.00 N ATOM 425 CA VAL A 388 -5.332 -3.551 -6.343 1.00 0.00 C ATOM 426 C VAL A 388 -4.665 -4.921 -6.414 1.00 0.00 C ATOM 427 O VAL A 388 -3.519 -5.043 -6.847 1.00 0.00 O ATOM 428 CB VAL A 388 -5.215 -2.861 -7.715 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.922 -3.674 -8.789 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.778 -1.448 -7.650 1.00 0.00 C ATOM 0 H VAL A 388 -3.780 -2.442 -5.486 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.387 -3.674 -6.097 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.159 -2.798 -7.979 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.827 -3.168 -9.750 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.469 -4.663 -8.853 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.977 -3.774 -8.534 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.687 -0.975 -8.628 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.829 -1.488 -7.362 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.222 -0.868 -6.913 1.00 0.00 H new ATOM 440 N THR A 389 -5.388 -5.949 -5.984 1.00 0.00 N ATOM 441 CA THR A 389 -4.865 -7.309 -5.996 1.00 0.00 C ATOM 442 C THR A 389 -5.074 -7.964 -7.357 1.00 0.00 C ATOM 443 O THR A 389 -6.198 -8.296 -7.732 1.00 0.00 O ATOM 444 CB THR A 389 -5.536 -8.146 -4.906 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.860 -8.486 -5.279 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.603 -7.445 -3.566 1.00 0.00 C ATOM 0 H THR A 389 -6.338 -5.866 -5.623 1.00 0.00 H new ATOM 0 HA THR A 389 -3.794 -7.259 -5.799 1.00 0.00 H new ATOM 0 HB THR A 389 -4.913 -9.034 -4.801 1.00 0.00 H new ATOM 0 HG1 THR A 389 -7.047 -8.138 -6.176 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.091 -8.095 -2.839 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.594 -7.213 -3.226 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.173 -6.521 -3.667 1.00 0.00 H new ATOM 594 N ASN A 399 1.133 -16.799 -6.823 1.00 0.00 N ATOM 595 CA ASN A 399 0.910 -16.333 -5.459 1.00 0.00 C ATOM 596 C ASN A 399 -0.075 -15.167 -5.431 1.00 0.00 C ATOM 597 O ASN A 399 -0.813 -14.941 -6.390 1.00 0.00 O ATOM 598 CB ASN A 399 2.235 -15.903 -4.822 1.00 0.00 C ATOM 599 CG ASN A 399 3.430 -16.652 -5.379 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.931 -17.593 -4.764 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.891 -16.233 -6.550 1.00 0.00 N ATOM 0 HA ASN A 399 0.485 -17.159 -4.888 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.378 -14.834 -4.979 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.183 -16.062 -3.745 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.693 -16.696 -6.977 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.443 -15.448 -7.023 1.00 0.00 H new ATOM 608 N SER A 400 -0.077 -14.425 -4.324 1.00 0.00 N ATOM 609 CA SER A 400 -0.962 -13.280 -4.168 1.00 0.00 C ATOM 610 C SER A 400 -0.208 -11.979 -4.420 1.00 0.00 C ATOM 611 O SER A 400 0.416 -11.427 -3.514 1.00 0.00 O ATOM 612 CB SER A 400 -1.575 -13.267 -2.767 1.00 0.00 C ATOM 613 OG SER A 400 -2.377 -14.415 -2.548 1.00 0.00 O ATOM 0 H SER A 400 0.528 -14.600 -3.522 1.00 0.00 H new ATOM 0 HA SER A 400 -1.763 -13.366 -4.903 1.00 0.00 H new ATOM 0 HB2 SER A 400 -0.782 -13.226 -2.020 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.179 -12.369 -2.640 1.00 0.00 H new ATOM 0 HG SER A 400 -3.184 -14.161 -2.053 1.00 0.00 H new ATOM 619 N ILE A 401 -0.261 -11.498 -5.657 1.00 0.00 N ATOM 620 CA ILE A 401 0.426 -10.268 -6.027 1.00 0.00 C ATOM 621 C ILE A 401 -0.490 -9.050 -5.883 1.00 0.00 C ATOM 622 O ILE A 401 -1.604 -9.031 -6.409 1.00 0.00 O ATOM 623 CB ILE A 401 0.967 -10.352 -7.474 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.200 -9.465 -7.634 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.105 -9.972 -8.489 1.00 0.00 C ATOM 626 CD1 ILE A 401 1.949 -8.010 -7.305 1.00 0.00 C ATOM 0 H ILE A 401 -0.773 -11.942 -6.420 1.00 0.00 H new ATOM 0 HA ILE A 401 1.266 -10.148 -5.342 1.00 0.00 H new ATOM 0 HB ILE A 401 1.254 -11.386 -7.667 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.994 -9.842 -6.990 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.560 -9.540 -8.660 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.307 -10.041 -9.496 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.952 -10.652 -8.396 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.437 -8.951 -8.302 1.00 0.00 H new ATOM 0 HD11 ILE A 401 2.869 -7.442 -7.441 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.178 -7.615 -7.966 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.619 -7.923 -6.270 1.00 0.00 H new ATOM 638 N VAL A 402 -0.011 -8.033 -5.169 1.00 0.00 N ATOM 639 CA VAL A 402 -0.784 -6.815 -4.961 1.00 0.00 C ATOM 640 C VAL A 402 0.042 -5.578 -5.292 1.00 0.00 C ATOM 641 O VAL A 402 1.271 -5.609 -5.247 1.00 0.00 O ATOM 642 CB VAL A 402 -1.292 -6.708 -3.512 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.246 -5.532 -3.364 1.00 0.00 C ATOM 644 CG2 VAL A 402 -1.961 -8.005 -3.084 1.00 0.00 C ATOM 0 H VAL A 402 0.908 -8.030 -4.726 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.641 -6.868 -5.632 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.437 -6.535 -2.859 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.594 -5.473 -2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.729 -4.609 -3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.100 -5.670 -4.028 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.314 -7.911 -2.057 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -2.806 -8.212 -3.740 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.243 -8.823 -3.147 1.00 0.00 H new ATOM 654 N GLU A 403 -0.642 -4.491 -5.626 1.00 0.00 N ATOM 655 CA GLU A 403 0.029 -3.243 -5.967 1.00 0.00 C ATOM 656 C GLU A 403 -0.728 -2.038 -5.416 1.00 0.00 C ATOM 657 O GLU A 403 -1.857 -1.762 -5.821 1.00 0.00 O ATOM 658 CB GLU A 403 0.173 -3.115 -7.485 1.00 0.00 C ATOM 659 CG GLU A 403 0.771 -4.347 -8.146 1.00 0.00 C ATOM 660 CD GLU A 403 -0.273 -5.204 -8.833 1.00 0.00 C ATOM 661 OE1 GLU A 403 -1.469 -5.066 -8.500 1.00 0.00 O ATOM 662 OE2 GLU A 403 0.104 -6.014 -9.706 1.00 0.00 O ATOM 0 H GLU A 403 -1.660 -4.448 -5.668 1.00 0.00 H new ATOM 0 HA GLU A 403 1.019 -3.262 -5.511 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.807 -2.920 -7.919 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.799 -2.252 -7.711 1.00 0.00 H new ATOM 0 HG2 GLU A 403 1.519 -4.036 -8.876 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.288 -4.943 -7.394 1.00 0.00 H new ATOM 669 N CYS A 404 -0.093 -1.324 -4.493 1.00 0.00 N ATOM 670 CA CYS A 404 -0.695 -0.142 -3.886 1.00 0.00 C ATOM 671 C CYS A 404 -0.684 1.025 -4.866 1.00 0.00 C ATOM 672 O CYS A 404 0.374 1.563 -5.188 1.00 0.00 O ATOM 673 CB CYS A 404 0.060 0.240 -2.611 1.00 0.00 C ATOM 674 SG CYS A 404 -0.543 1.747 -1.814 1.00 0.00 S ATOM 0 H CYS A 404 0.841 -1.544 -4.148 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.729 -0.374 -3.630 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.008 -0.585 -1.901 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.115 0.367 -2.852 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.185 1.436 -0.727 1.00 0.00 H new ATOM 680 N ARG A 405 -1.865 1.415 -5.333 1.00 0.00 N ATOM 681 CA ARG A 405 -1.984 2.519 -6.273 1.00 0.00 C ATOM 682 C ARG A 405 -2.616 3.732 -5.606 1.00 0.00 C ATOM 683 O ARG A 405 -3.552 3.603 -4.817 1.00 0.00 O ATOM 684 CB ARG A 405 -2.813 2.101 -7.487 1.00 0.00 C ATOM 685 CG ARG A 405 -2.345 0.805 -8.128 1.00 0.00 C ATOM 686 CD ARG A 405 -3.033 0.561 -9.461 1.00 0.00 C ATOM 687 NE ARG A 405 -2.304 -0.401 -10.285 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.798 -0.954 -11.391 1.00 0.00 C ATOM 689 NH1 ARG A 405 -4.019 -0.647 -11.808 1.00 0.00 N ATOM 690 NH2 ARG A 405 -2.065 -1.818 -12.083 1.00 0.00 N ATOM 0 H ARG A 405 -2.752 0.982 -5.075 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.981 2.788 -6.605 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.854 1.991 -7.185 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.779 2.897 -8.231 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.266 0.840 -8.276 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -2.547 -0.028 -7.455 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -4.045 0.195 -9.285 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -3.124 1.504 -10.000 1.00 0.00 H new ATOM 0 HE ARG A 405 -1.362 -0.664 -9.996 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -4.586 0.017 -11.281 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -4.391 -1.075 -12.656 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.125 -2.057 -11.767 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -2.442 -2.243 -12.930 1.00 0.00 H new ATOM 702 N VAL A 406 -2.098 4.910 -5.927 1.00 0.00 N ATOM 703 CA VAL A 406 -2.613 6.147 -5.356 1.00 0.00 C ATOM 704 C VAL A 406 -3.724 6.733 -6.221 1.00 0.00 C ATOM 705 O VAL A 406 -3.976 6.263 -7.331 1.00 0.00 O ATOM 706 CB VAL A 406 -1.499 7.198 -5.183 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.423 6.686 -4.239 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.900 7.573 -6.532 1.00 0.00 C ATOM 0 H VAL A 406 -1.323 5.035 -6.578 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.016 5.896 -4.375 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.938 8.095 -4.745 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.355 7.442 -4.130 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.864 6.475 -3.265 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.013 5.773 -4.645 1.00 0.00 H new ATOM 0 HG21 VAL A 406 -0.116 8.316 -6.388 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.477 6.685 -7.002 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.678 7.987 -7.173 1.00 0.00 H new ATOM 744 N THR A 410 -0.277 5.823 -10.003 1.00 0.00 N ATOM 745 CA THR A 410 1.114 5.488 -9.723 1.00 0.00 C ATOM 746 C THR A 410 1.218 4.566 -8.512 1.00 0.00 C ATOM 747 O THR A 410 0.783 4.915 -7.414 1.00 0.00 O ATOM 748 CB THR A 410 1.927 6.761 -9.481 1.00 0.00 C ATOM 749 OG1 THR A 410 1.853 7.623 -10.602 1.00 0.00 O ATOM 750 CG2 THR A 410 3.391 6.494 -9.203 1.00 0.00 C ATOM 0 HA THR A 410 1.518 4.966 -10.590 1.00 0.00 H new ATOM 0 HB THR A 410 1.485 7.222 -8.598 1.00 0.00 H new ATOM 0 HG1 THR A 410 1.020 7.455 -11.090 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.909 7.439 -9.041 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.485 5.871 -8.313 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.835 5.979 -10.055 1.00 0.00 H new ATOM 758 N VAL A 411 1.797 3.388 -8.719 1.00 0.00 N ATOM 759 CA VAL A 411 1.958 2.419 -7.642 1.00 0.00 C ATOM 760 C VAL A 411 3.125 2.793 -6.738 1.00 0.00 C ATOM 761 O VAL A 411 4.275 2.845 -7.177 1.00 0.00 O ATOM 762 CB VAL A 411 2.181 0.996 -8.191 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.156 -0.022 -7.063 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.138 0.658 -9.246 1.00 0.00 C ATOM 0 H VAL A 411 2.162 3.082 -9.621 1.00 0.00 H new ATOM 0 HA VAL A 411 1.034 2.434 -7.064 1.00 0.00 H new ATOM 0 HB VAL A 411 3.164 0.960 -8.661 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.315 -1.020 -7.470 1.00 0.00 H new ATOM 0 HG12 VAL A 411 2.946 0.208 -6.348 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.189 0.015 -6.561 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.313 -0.350 -9.621 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.143 0.713 -8.805 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.210 1.369 -10.069 1.00 0.00 H new ATOM 774 N LEU A 412 2.820 3.058 -5.473 1.00 0.00 N ATOM 775 CA LEU A 412 3.837 3.435 -4.501 1.00 0.00 C ATOM 776 C LEU A 412 4.361 2.215 -3.746 1.00 0.00 C ATOM 777 O LEU A 412 5.457 2.248 -3.185 1.00 0.00 O ATOM 778 CB LEU A 412 3.265 4.450 -3.510 1.00 0.00 C ATOM 779 CG LEU A 412 4.224 5.571 -3.109 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.084 6.754 -4.055 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.969 6.002 -1.673 1.00 0.00 C ATOM 0 H LEU A 412 1.873 3.018 -5.096 1.00 0.00 H new ATOM 0 HA LEU A 412 4.669 3.885 -5.043 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.370 4.896 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.952 3.920 -2.610 1.00 0.00 H new ATOM 0 HG LEU A 412 5.244 5.194 -3.178 1.00 0.00 H new ATOM 0 HD11 LEU A 412 4.774 7.543 -3.755 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.316 6.436 -5.072 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.062 7.131 -4.017 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.661 6.801 -1.405 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.945 6.362 -1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.119 5.153 -1.006 1.00 0.00 H new ATOM 793 N GLY A 413 3.575 1.143 -3.727 1.00 0.00 N ATOM 794 CA GLY A 413 3.987 -0.060 -3.024 1.00 0.00 C ATOM 795 C GLY A 413 3.557 -1.335 -3.725 1.00 0.00 C ATOM 796 O GLY A 413 2.368 -1.635 -3.806 1.00 0.00 O ATOM 0 H GLY A 413 2.665 1.085 -4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.072 -0.059 -2.918 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.569 -0.047 -2.018 1.00 0.00 H new ATOM 800 N THR A 414 4.531 -2.090 -4.226 1.00 0.00 N ATOM 801 CA THR A 414 4.254 -3.341 -4.917 1.00 0.00 C ATOM 802 C THR A 414 4.897 -4.512 -4.178 1.00 0.00 C ATOM 803 O THR A 414 6.095 -4.491 -3.893 1.00 0.00 O ATOM 804 CB THR A 414 4.777 -3.273 -6.350 1.00 0.00 C ATOM 805 OG1 THR A 414 4.097 -2.271 -7.085 1.00 0.00 O ATOM 806 CG2 THR A 414 4.635 -4.575 -7.111 1.00 0.00 C ATOM 0 H THR A 414 5.521 -1.854 -4.165 1.00 0.00 H new ATOM 0 HA THR A 414 3.175 -3.496 -4.940 1.00 0.00 H new ATOM 0 HB THR A 414 5.839 -3.045 -6.254 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.447 -2.242 -8.000 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.027 -4.451 -8.120 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.193 -5.359 -6.599 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.582 -4.853 -7.162 1.00 0.00 H new ATOM 814 N GLY A 415 4.101 -5.531 -3.868 1.00 0.00 N ATOM 815 CA GLY A 415 4.627 -6.685 -3.165 1.00 0.00 C ATOM 816 C GLY A 415 3.709 -7.890 -3.237 1.00 0.00 C ATOM 817 O GLY A 415 2.487 -7.755 -3.160 1.00 0.00 O ATOM 0 H GLY A 415 3.107 -5.578 -4.090 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.598 -6.949 -3.585 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.793 -6.423 -2.120 1.00 0.00 H new ATOM 821 N VAL A 416 4.302 -9.070 -3.380 1.00 0.00 N ATOM 822 CA VAL A 416 3.540 -10.306 -3.458 1.00 0.00 C ATOM 823 C VAL A 416 3.309 -10.893 -2.075 1.00 0.00 C ATOM 824 O VAL A 416 3.727 -10.328 -1.065 1.00 0.00 O ATOM 825 CB VAL A 416 4.251 -11.349 -4.350 1.00 0.00 C ATOM 826 CG1 VAL A 416 5.362 -12.065 -3.594 1.00 0.00 C ATOM 827 CG2 VAL A 416 3.256 -12.347 -4.923 1.00 0.00 C ATOM 0 H VAL A 416 5.312 -9.194 -3.444 1.00 0.00 H new ATOM 0 HA VAL A 416 2.577 -10.062 -3.905 1.00 0.00 H new ATOM 0 HB VAL A 416 4.709 -10.811 -5.180 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.840 -12.791 -4.252 1.00 0.00 H new ATOM 0 HG12 VAL A 416 6.101 -11.338 -3.258 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.941 -12.580 -2.730 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.783 -13.069 -5.546 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.754 -12.869 -4.108 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.517 -11.819 -5.525 1.00 0.00 H new ATOM 837 N GLY A 417 2.640 -12.029 -2.048 1.00 0.00 N ATOM 838 CA GLY A 417 2.352 -12.696 -0.791 1.00 0.00 C ATOM 839 C GLY A 417 1.605 -14.000 -0.980 1.00 0.00 C ATOM 840 O GLY A 417 1.188 -14.330 -2.090 1.00 0.00 O ATOM 0 H GLY A 417 2.287 -12.508 -2.876 1.00 0.00 H new ATOM 0 HA2 GLY A 417 3.287 -12.890 -0.265 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.762 -12.032 -0.159 1.00 0.00 H new ATOM 844 N ARG A 418 1.434 -14.745 0.107 1.00 0.00 N ATOM 845 CA ARG A 418 0.730 -16.021 0.059 1.00 0.00 C ATOM 846 C ARG A 418 -0.780 -15.807 0.075 1.00 0.00 C ATOM 847 O ARG A 418 -1.538 -16.608 -0.473 1.00 0.00 O ATOM 848 CB ARG A 418 1.143 -16.901 1.239 1.00 0.00 C ATOM 849 CG ARG A 418 1.097 -16.184 2.578 1.00 0.00 C ATOM 850 CD ARG A 418 0.742 -17.135 3.710 1.00 0.00 C ATOM 851 NE ARG A 418 1.818 -18.083 3.986 1.00 0.00 N ATOM 852 CZ ARG A 418 1.934 -18.762 5.126 1.00 0.00 C ATOM 853 NH1 ARG A 418 1.043 -18.602 6.096 1.00 0.00 N ATOM 854 NH2 ARG A 418 2.944 -19.605 5.294 1.00 0.00 N ATOM 0 H ARG A 418 1.774 -14.486 1.033 1.00 0.00 H new ATOM 0 HA ARG A 418 1.000 -16.522 -0.870 1.00 0.00 H new ATOM 0 HB2 ARG A 418 0.488 -17.771 1.279 1.00 0.00 H new ATOM 0 HB3 ARG A 418 2.154 -17.271 1.069 1.00 0.00 H new ATOM 0 HG2 ARG A 418 2.065 -15.724 2.778 1.00 0.00 H new ATOM 0 HG3 ARG A 418 0.364 -15.379 2.535 1.00 0.00 H new ATOM 0 HD2 ARG A 418 0.525 -16.561 4.611 1.00 0.00 H new ATOM 0 HD3 ARG A 418 -0.166 -17.681 3.453 1.00 0.00 H new ATOM 0 HE ARG A 418 2.522 -18.234 3.263 1.00 0.00 H new ATOM 0 HH11 ARG A 418 0.264 -17.956 5.971 1.00 0.00 H new ATOM 0 HH12 ARG A 418 1.137 -19.125 6.967 1.00 0.00 H new ATOM 0 HH21 ARG A 418 3.631 -19.733 4.551 1.00 0.00 H new ATOM 0 HH22 ARG A 418 3.034 -20.126 6.167 1.00 0.00 H new ATOM 866 N ASN A 419 -1.210 -14.720 0.709 1.00 0.00 N ATOM 867 CA ASN A 419 -2.628 -14.397 0.801 1.00 0.00 C ATOM 868 C ASN A 419 -2.853 -12.898 0.616 1.00 0.00 C ATOM 869 O ASN A 419 -1.925 -12.100 0.743 1.00 0.00 O ATOM 870 CB ASN A 419 -3.185 -14.855 2.152 1.00 0.00 C ATOM 871 CG ASN A 419 -4.629 -14.444 2.362 1.00 0.00 C ATOM 872 OD1 ASN A 419 -5.467 -14.600 1.474 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.927 -13.915 3.542 1.00 0.00 N ATOM 0 H ASN A 419 -0.595 -14.048 1.167 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.155 -14.923 0.005 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -3.107 -15.940 2.223 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -2.573 -14.438 2.952 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -5.883 -13.619 3.742 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -4.201 -13.804 4.249 1.00 0.00 H new ATOM 880 N ILE A 420 -4.092 -12.523 0.310 1.00 0.00 N ATOM 881 CA ILE A 420 -4.441 -11.121 0.103 1.00 0.00 C ATOM 882 C ILE A 420 -4.024 -10.261 1.294 1.00 0.00 C ATOM 883 O ILE A 420 -3.599 -9.117 1.127 1.00 0.00 O ATOM 884 CB ILE A 420 -5.955 -10.950 -0.141 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.282 -9.492 -0.472 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.746 -11.416 1.073 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.393 -9.336 -1.488 1.00 0.00 C ATOM 0 H ILE A 420 -4.872 -13.171 0.200 1.00 0.00 H new ATOM 0 HA ILE A 420 -3.898 -10.789 -0.782 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.241 -11.567 -0.993 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -6.564 -8.974 0.445 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.384 -9.004 -0.850 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -7.812 -11.288 0.884 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.535 -12.468 1.263 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.459 -10.825 1.943 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -7.570 -8.277 -1.674 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -7.106 -9.824 -2.419 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.304 -9.795 -1.104 1.00 0.00 H new ATOM 899 N LYS A 421 -4.146 -10.820 2.492 1.00 0.00 N ATOM 900 CA LYS A 421 -3.779 -10.104 3.709 1.00 0.00 C ATOM 901 C LYS A 421 -2.269 -9.913 3.793 1.00 0.00 C ATOM 902 O LYS A 421 -1.786 -8.845 4.171 1.00 0.00 O ATOM 903 CB LYS A 421 -4.279 -10.862 4.941 1.00 0.00 C ATOM 904 CG LYS A 421 -5.607 -10.353 5.476 1.00 0.00 C ATOM 905 CD LYS A 421 -5.807 -10.743 6.932 1.00 0.00 C ATOM 906 CE LYS A 421 -6.756 -11.925 7.069 1.00 0.00 C ATOM 907 NZ LYS A 421 -8.025 -11.541 7.747 1.00 0.00 N ATOM 0 H LYS A 421 -4.496 -11.766 2.647 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.250 -9.121 3.679 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.379 -11.918 4.690 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.529 -10.791 5.729 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -5.647 -9.268 5.380 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -6.422 -10.757 4.875 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -4.845 -10.995 7.378 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -6.202 -9.892 7.486 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -6.979 -12.328 6.081 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -6.268 -12.719 7.634 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -8.645 -12.373 7.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -7.814 -11.180 8.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -8.504 -10.801 7.195 1.00 0.00 H new ATOM 921 N ILE A 422 -1.533 -10.957 3.438 1.00 0.00 N ATOM 922 CA ILE A 422 -0.076 -10.916 3.472 1.00 0.00 C ATOM 923 C ILE A 422 0.473 -10.025 2.362 1.00 0.00 C ATOM 924 O ILE A 422 1.263 -9.114 2.617 1.00 0.00 O ATOM 925 CB ILE A 422 0.525 -12.336 3.349 1.00 0.00 C ATOM 926 CG1 ILE A 422 0.347 -13.104 4.663 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.999 -12.271 2.973 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.084 -13.155 5.154 1.00 0.00 C ATOM 0 H ILE A 422 -1.921 -11.846 3.122 1.00 0.00 H new ATOM 0 HA ILE A 422 0.215 -10.496 4.435 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.007 -12.863 2.557 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.712 -14.123 4.530 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.968 -12.641 5.430 1.00 0.00 H new ATOM 0 HG21 ILE A 422 2.399 -13.282 2.893 1.00 0.00 H new ATOM 0 HG22 ILE A 422 2.108 -11.760 2.016 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.547 -11.724 3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.128 -13.715 6.088 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -1.448 -12.141 5.321 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.708 -13.646 4.407 1.00 0.00 H new ATOM 940 N ALA A 423 0.053 -10.293 1.133 1.00 0.00 N ATOM 941 CA ALA A 423 0.504 -9.515 -0.016 1.00 0.00 C ATOM 942 C ALA A 423 0.285 -8.027 0.216 1.00 0.00 C ATOM 943 O ALA A 423 1.118 -7.200 -0.155 1.00 0.00 O ATOM 944 CB ALA A 423 -0.212 -9.966 -1.281 1.00 0.00 C ATOM 0 H ALA A 423 -0.599 -11.043 0.905 1.00 0.00 H new ATOM 0 HA ALA A 423 1.573 -9.687 -0.142 1.00 0.00 H new ATOM 0 HB1 ALA A 423 0.137 -9.375 -2.127 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.000 -11.020 -1.463 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.286 -9.827 -1.160 1.00 0.00 H new ATOM 950 N GLY A 424 -0.838 -7.695 0.840 1.00 0.00 N ATOM 951 CA GLY A 424 -1.143 -6.308 1.123 1.00 0.00 C ATOM 952 C GLY A 424 -0.142 -5.693 2.078 1.00 0.00 C ATOM 953 O GLY A 424 0.408 -4.625 1.810 1.00 0.00 O ATOM 0 H GLY A 424 -1.542 -8.362 1.155 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.152 -5.741 0.192 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.143 -6.236 1.550 1.00 0.00 H new ATOM 957 N ILE A 425 0.102 -6.377 3.193 1.00 0.00 N ATOM 958 CA ILE A 425 1.050 -5.899 4.188 1.00 0.00 C ATOM 959 C ILE A 425 2.442 -5.757 3.582 1.00 0.00 C ATOM 960 O ILE A 425 3.208 -4.872 3.962 1.00 0.00 O ATOM 961 CB ILE A 425 1.115 -6.855 5.396 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.262 -6.980 6.049 1.00 0.00 C ATOM 963 CG2 ILE A 425 2.143 -6.371 6.409 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.456 -8.276 6.807 1.00 0.00 C ATOM 0 H ILE A 425 -0.345 -7.263 3.427 1.00 0.00 H new ATOM 0 HA ILE A 425 0.704 -4.923 4.528 1.00 0.00 H new ATOM 0 HB ILE A 425 1.422 -7.839 5.041 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.409 -6.143 6.732 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.029 -6.901 5.279 1.00 0.00 H new ATOM 0 HG21 ILE A 425 2.173 -7.059 7.254 1.00 0.00 H new ATOM 0 HG22 ILE A 425 3.126 -6.330 5.939 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.867 -5.377 6.761 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.454 -8.296 7.244 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.342 -9.118 6.124 1.00 0.00 H new ATOM 0 HD13 ILE A 425 0.288 -8.349 7.600 1.00 0.00 H new ATOM 976 N ARG A 426 2.761 -6.635 2.637 1.00 0.00 N ATOM 977 CA ARG A 426 4.061 -6.605 1.977 1.00 0.00 C ATOM 978 C ARG A 426 4.153 -5.416 1.029 1.00 0.00 C ATOM 979 O ARG A 426 5.159 -4.707 1.002 1.00 0.00 O ATOM 980 CB ARG A 426 4.306 -7.910 1.218 1.00 0.00 C ATOM 981 CG ARG A 426 5.080 -8.941 2.023 1.00 0.00 C ATOM 982 CD ARG A 426 5.446 -10.150 1.176 1.00 0.00 C ATOM 983 NE ARG A 426 6.057 -9.765 -0.094 1.00 0.00 N ATOM 984 CZ ARG A 426 7.333 -9.411 -0.226 1.00 0.00 C ATOM 985 NH1 ARG A 426 8.137 -9.389 0.830 1.00 0.00 N ATOM 986 NH2 ARG A 426 7.807 -9.077 -1.419 1.00 0.00 N ATOM 0 H ARG A 426 2.139 -7.375 2.312 1.00 0.00 H new ATOM 0 HA ARG A 426 4.831 -6.498 2.741 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.347 -8.336 0.923 1.00 0.00 H new ATOM 0 HB3 ARG A 426 4.853 -7.691 0.301 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.987 -8.487 2.421 1.00 0.00 H new ATOM 0 HG3 ARG A 426 4.482 -9.261 2.877 1.00 0.00 H new ATOM 0 HD2 ARG A 426 6.135 -10.786 1.731 1.00 0.00 H new ATOM 0 HD3 ARG A 426 4.551 -10.742 0.983 1.00 0.00 H new ATOM 0 HE ARG A 426 5.471 -9.768 -0.929 1.00 0.00 H new ATOM 0 HH11 ARG A 426 7.778 -9.644 1.750 1.00 0.00 H new ATOM 0 HH12 ARG A 426 9.114 -9.117 0.722 1.00 0.00 H new ATOM 0 HH21 ARG A 426 7.194 -9.092 -2.234 1.00 0.00 H new ATOM 0 HH22 ARG A 426 8.785 -8.805 -1.522 1.00 0.00 H new ATOM 998 N ALA A 427 3.093 -5.197 0.261 1.00 0.00 N ATOM 999 CA ALA A 427 3.052 -4.086 -0.682 1.00 0.00 C ATOM 1000 C ALA A 427 3.162 -2.758 0.056 1.00 0.00 C ATOM 1001 O ALA A 427 3.957 -1.894 -0.312 1.00 0.00 O ATOM 1002 CB ALA A 427 1.776 -4.134 -1.509 1.00 0.00 C ATOM 0 H ALA A 427 2.251 -5.773 0.272 1.00 0.00 H new ATOM 0 HA ALA A 427 3.902 -4.176 -1.358 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.763 -3.297 -2.207 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.738 -5.071 -2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.912 -4.069 -0.848 1.00 0.00 H new ATOM 1008 N ALA A 428 2.371 -2.613 1.112 1.00 0.00 N ATOM 1009 CA ALA A 428 2.392 -1.401 1.920 1.00 0.00 C ATOM 1010 C ALA A 428 3.768 -1.208 2.532 1.00 0.00 C ATOM 1011 O ALA A 428 4.323 -0.109 2.520 1.00 0.00 O ATOM 1012 CB ALA A 428 1.332 -1.468 3.008 1.00 0.00 C ATOM 0 H ALA A 428 1.707 -3.320 1.428 1.00 0.00 H new ATOM 0 HA ALA A 428 2.170 -0.548 1.278 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.362 -0.555 3.602 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.348 -1.572 2.551 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.525 -2.326 3.652 1.00 0.00 H new ATOM 1018 N GLU A 429 4.322 -2.297 3.050 1.00 0.00 N ATOM 1019 CA GLU A 429 5.647 -2.262 3.647 1.00 0.00 C ATOM 1020 C GLU A 429 6.670 -1.847 2.599 1.00 0.00 C ATOM 1021 O GLU A 429 7.646 -1.161 2.901 1.00 0.00 O ATOM 1022 CB GLU A 429 6.009 -3.628 4.232 1.00 0.00 C ATOM 1023 CG GLU A 429 5.455 -3.851 5.628 1.00 0.00 C ATOM 1024 CD GLU A 429 5.794 -5.223 6.178 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.731 -6.203 5.407 1.00 0.00 O ATOM 1026 OE2 GLU A 429 6.122 -5.316 7.380 1.00 0.00 O ATOM 0 H GLU A 429 3.874 -3.213 3.068 1.00 0.00 H new ATOM 0 HA GLU A 429 5.650 -1.533 4.457 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.634 -4.409 3.571 1.00 0.00 H new ATOM 0 HB3 GLU A 429 7.094 -3.727 4.259 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.850 -3.087 6.298 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.372 -3.729 5.609 1.00 0.00 H new ATOM 1033 N ASN A 430 6.417 -2.249 1.356 1.00 0.00 N ATOM 1034 CA ASN A 430 7.291 -1.901 0.247 1.00 0.00 C ATOM 1035 C ASN A 430 7.296 -0.391 0.064 1.00 0.00 C ATOM 1036 O ASN A 430 8.324 0.209 -0.252 1.00 0.00 O ATOM 1037 CB ASN A 430 6.823 -2.589 -1.039 1.00 0.00 C ATOM 1038 CG ASN A 430 7.842 -2.480 -2.156 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.282 -1.385 -2.506 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.224 -3.620 -2.723 1.00 0.00 N ATOM 0 H ASN A 430 5.611 -2.817 1.095 1.00 0.00 H new ATOM 0 HA ASN A 430 8.303 -2.242 0.468 1.00 0.00 H new ATOM 0 HB2 ASN A 430 6.624 -3.641 -0.834 1.00 0.00 H new ATOM 0 HB3 ASN A 430 5.882 -2.144 -1.364 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.908 -3.609 -3.480 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.833 -4.506 -2.401 1.00 0.00 H new ATOM 1047 N ALA A 431 6.136 0.215 0.291 1.00 0.00 N ATOM 1048 CA ALA A 431 5.990 1.656 0.181 1.00 0.00 C ATOM 1049 C ALA A 431 6.762 2.349 1.299 1.00 0.00 C ATOM 1050 O ALA A 431 7.256 3.464 1.130 1.00 0.00 O ATOM 1051 CB ALA A 431 4.517 2.040 0.228 1.00 0.00 C ATOM 0 H ALA A 431 5.281 -0.275 0.553 1.00 0.00 H new ATOM 0 HA ALA A 431 6.400 1.981 -0.775 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.420 3.123 0.145 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.990 1.564 -0.599 1.00 0.00 H new ATOM 0 HB3 ALA A 431 4.085 1.709 1.172 1.00 0.00 H new ATOM 1057 N LEU A 432 6.867 1.671 2.440 1.00 0.00 N ATOM 1058 CA LEU A 432 7.585 2.208 3.590 1.00 0.00 C ATOM 1059 C LEU A 432 9.083 2.268 3.309 1.00 0.00 C ATOM 1060 O LEU A 432 9.775 3.180 3.760 1.00 0.00 O ATOM 1061 CB LEU A 432 7.319 1.347 4.828 1.00 0.00 C ATOM 1062 CG LEU A 432 6.555 2.048 5.952 1.00 0.00 C ATOM 1063 CD1 LEU A 432 5.072 2.112 5.626 1.00 0.00 C ATOM 1064 CD2 LEU A 432 6.783 1.332 7.275 1.00 0.00 C ATOM 0 H LEU A 432 6.462 0.747 2.591 1.00 0.00 H new ATOM 0 HA LEU A 432 7.226 3.220 3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.758 0.464 4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 432 8.274 0.998 5.221 1.00 0.00 H new ATOM 0 HG LEU A 432 6.930 3.067 6.044 1.00 0.00 H new ATOM 0 HD11 LEU A 432 4.543 2.614 6.436 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.927 2.667 4.699 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.681 1.101 5.509 1.00 0.00 H new ATOM 0 HD21 LEU A 432 6.233 1.843 8.065 1.00 0.00 H new ATOM 0 HD22 LEU A 432 6.433 0.303 7.197 1.00 0.00 H new ATOM 0 HD23 LEU A 432 7.847 1.337 7.513 1.00 0.00 H new ATOM 1076 N ARG A 433 9.576 1.285 2.560 1.00 0.00 N ATOM 1077 CA ARG A 433 10.993 1.218 2.216 1.00 0.00 C ATOM 1078 C ARG A 433 11.451 2.506 1.541 1.00 0.00 C ATOM 1079 O ARG A 433 12.536 3.014 1.820 1.00 0.00 O ATOM 1080 CB ARG A 433 11.261 0.024 1.298 1.00 0.00 C ATOM 1081 CG ARG A 433 10.814 -1.305 1.886 1.00 0.00 C ATOM 1082 CD ARG A 433 11.722 -2.442 1.447 1.00 0.00 C ATOM 1083 NE ARG A 433 11.009 -3.714 1.370 1.00 0.00 N ATOM 1084 CZ ARG A 433 10.549 -4.373 2.432 1.00 0.00 C ATOM 1085 NH1 ARG A 433 10.727 -3.883 3.653 1.00 0.00 N ATOM 1086 NH2 ARG A 433 9.912 -5.525 2.273 1.00 0.00 N ATOM 0 H ARG A 433 9.014 0.523 2.180 1.00 0.00 H new ATOM 0 HA ARG A 433 11.559 1.092 3.139 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.749 0.183 0.349 1.00 0.00 H new ATOM 0 HB3 ARG A 433 12.328 -0.025 1.080 1.00 0.00 H new ATOM 0 HG2 ARG A 433 10.811 -1.240 2.974 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.790 -1.515 1.576 1.00 0.00 H new ATOM 0 HD2 ARG A 433 12.151 -2.208 0.473 1.00 0.00 H new ATOM 0 HD3 ARG A 433 12.552 -2.534 2.147 1.00 0.00 H new ATOM 0 HE ARG A 433 10.854 -4.122 0.448 1.00 0.00 H new ATOM 0 HH11 ARG A 433 11.218 -2.998 3.781 1.00 0.00 H new ATOM 0 HH12 ARG A 433 10.373 -4.391 4.463 1.00 0.00 H new ATOM 0 HH21 ARG A 433 9.774 -5.907 1.337 1.00 0.00 H new ATOM 0 HH22 ARG A 433 9.560 -6.030 3.087 1.00 0.00 H new ATOM 1098 N ASP A 434 10.612 3.029 0.655 1.00 0.00 N ATOM 1099 CA ASP A 434 10.925 4.263 -0.058 1.00 0.00 C ATOM 1100 C ASP A 434 10.913 5.451 0.898 1.00 0.00 C ATOM 1101 O ASP A 434 10.015 6.292 0.852 1.00 0.00 O ATOM 1102 CB ASP A 434 9.923 4.491 -1.192 1.00 0.00 C ATOM 1103 CG ASP A 434 9.856 3.318 -2.150 1.00 0.00 C ATOM 1104 OD1 ASP A 434 9.187 2.318 -1.819 1.00 0.00 O ATOM 1105 OD2 ASP A 434 10.475 3.399 -3.232 1.00 0.00 O ATOM 0 H ASP A 434 9.710 2.619 0.413 1.00 0.00 H new ATOM 0 HA ASP A 434 11.924 4.169 -0.484 1.00 0.00 H new ATOM 0 HB2 ASP A 434 8.934 4.668 -0.769 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.200 5.390 -1.742 1.00 0.00 H new ATOM 1110 N LYS A 435 11.916 5.509 1.770 1.00 0.00 N ATOM 1111 CA LYS A 435 12.030 6.586 2.749 1.00 0.00 C ATOM 1112 C LYS A 435 11.878 7.952 2.091 1.00 0.00 C ATOM 1113 O LYS A 435 11.228 8.845 2.635 1.00 0.00 O ATOM 1114 CB LYS A 435 13.373 6.505 3.476 1.00 0.00 C ATOM 1115 CG LYS A 435 13.454 5.362 4.476 1.00 0.00 C ATOM 1116 CD LYS A 435 13.890 5.848 5.850 1.00 0.00 C ATOM 1117 CE LYS A 435 14.083 4.691 6.817 1.00 0.00 C ATOM 1118 NZ LYS A 435 13.453 4.962 8.140 1.00 0.00 N ATOM 0 H LYS A 435 12.665 4.819 1.818 1.00 0.00 H new ATOM 0 HA LYS A 435 11.223 6.464 3.471 1.00 0.00 H new ATOM 0 HB2 LYS A 435 14.169 6.391 2.740 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.553 7.446 3.996 1.00 0.00 H new ATOM 0 HG2 LYS A 435 12.481 4.876 4.553 1.00 0.00 H new ATOM 0 HG3 LYS A 435 14.157 4.612 4.115 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.821 6.407 5.760 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.143 6.535 6.248 1.00 0.00 H new ATOM 0 HE2 LYS A 435 13.654 3.785 6.389 1.00 0.00 H new ATOM 0 HE3 LYS A 435 15.148 4.506 6.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 13.607 4.149 8.771 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 13.880 5.812 8.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 12.432 5.114 8.014 1.00 0.00 H new ATOM 1132 N LYS A 436 12.474 8.108 0.916 1.00 0.00 N ATOM 1133 CA LYS A 436 12.393 9.367 0.188 1.00 0.00 C ATOM 1134 C LYS A 436 10.948 9.683 -0.162 1.00 0.00 C ATOM 1135 O LYS A 436 10.384 10.673 0.301 1.00 0.00 O ATOM 1136 CB LYS A 436 13.240 9.309 -1.084 1.00 0.00 C ATOM 1137 CG LYS A 436 14.268 10.423 -1.180 1.00 0.00 C ATOM 1138 CD LYS A 436 13.616 11.793 -1.059 1.00 0.00 C ATOM 1139 CE LYS A 436 14.389 12.697 -0.111 1.00 0.00 C ATOM 1140 NZ LYS A 436 14.256 12.260 1.307 1.00 0.00 N ATOM 0 H LYS A 436 13.017 7.382 0.449 1.00 0.00 H new ATOM 0 HA LYS A 436 12.782 10.158 0.829 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.753 8.348 -1.126 1.00 0.00 H new ATOM 0 HB3 LYS A 436 12.582 9.357 -1.952 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.012 10.302 -0.393 1.00 0.00 H new ATOM 0 HG3 LYS A 436 14.796 10.352 -2.131 1.00 0.00 H new ATOM 0 HD2 LYS A 436 13.560 12.259 -2.043 1.00 0.00 H new ATOM 0 HD3 LYS A 436 12.593 11.680 -0.702 1.00 0.00 H new ATOM 0 HE2 LYS A 436 15.442 12.702 -0.392 1.00 0.00 H new ATOM 0 HE3 LYS A 436 14.028 13.721 -0.211 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 14.636 12.997 1.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 13.252 12.100 1.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 14.787 11.377 1.449 1.00 0.00 H new ATOM 1154 N MET A 437 10.353 8.821 -0.975 1.00 0.00 N ATOM 1155 CA MET A 437 8.965 8.988 -1.384 1.00 0.00 C ATOM 1156 C MET A 437 8.055 9.043 -0.161 1.00 0.00 C ATOM 1157 O MET A 437 6.983 9.648 -0.197 1.00 0.00 O ATOM 1158 CB MET A 437 8.545 7.839 -2.304 1.00 0.00 C ATOM 1159 CG MET A 437 7.091 7.906 -2.743 1.00 0.00 C ATOM 1160 SD MET A 437 6.908 8.393 -4.470 1.00 0.00 S ATOM 1161 CE MET A 437 7.083 6.811 -5.291 1.00 0.00 C ATOM 0 H MET A 437 10.811 7.997 -1.365 1.00 0.00 H new ATOM 0 HA MET A 437 8.872 9.927 -1.929 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.182 7.842 -3.188 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.717 6.893 -1.790 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.625 6.932 -2.593 1.00 0.00 H new ATOM 0 HG3 MET A 437 6.557 8.616 -2.111 1.00 0.00 H new ATOM 0 HE1 MET A 437 6.370 6.747 -6.113 1.00 0.00 H new ATOM 0 HE2 MET A 437 8.096 6.714 -5.681 1.00 0.00 H new ATOM 0 HE3 MET A 437 6.890 6.008 -4.579 1.00 0.00 H new ATOM 1171 N LEU A 438 8.496 8.413 0.925 1.00 0.00 N ATOM 1172 CA LEU A 438 7.730 8.396 2.161 1.00 0.00 C ATOM 1173 C LEU A 438 7.762 9.762 2.830 1.00 0.00 C ATOM 1174 O LEU A 438 6.731 10.286 3.252 1.00 0.00 O ATOM 1175 CB LEU A 438 8.283 7.335 3.114 1.00 0.00 C ATOM 1176 CG LEU A 438 7.307 6.864 4.188 1.00 0.00 C ATOM 1177 CD1 LEU A 438 6.886 8.029 5.070 1.00 0.00 C ATOM 1178 CD2 LEU A 438 6.093 6.209 3.547 1.00 0.00 C ATOM 0 H LEU A 438 9.381 7.908 0.971 1.00 0.00 H new ATOM 0 HA LEU A 438 6.696 8.150 1.919 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.600 6.472 2.529 1.00 0.00 H new ATOM 0 HB3 LEU A 438 9.172 7.734 3.602 1.00 0.00 H new ATOM 0 HG LEU A 438 7.807 6.125 4.814 1.00 0.00 H new ATOM 0 HD11 LEU A 438 6.190 7.676 5.831 1.00 0.00 H new ATOM 0 HD12 LEU A 438 7.765 8.456 5.553 1.00 0.00 H new ATOM 0 HD13 LEU A 438 6.401 8.791 4.460 1.00 0.00 H new ATOM 0 HD21 LEU A 438 5.405 5.878 4.325 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.590 6.928 2.900 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.412 5.351 2.956 1.00 0.00 H new ATOM 1190 N ASP A 439 8.955 10.335 2.918 1.00 0.00 N ATOM 1191 CA ASP A 439 9.129 11.645 3.530 1.00 0.00 C ATOM 1192 C ASP A 439 8.403 12.713 2.724 1.00 0.00 C ATOM 1193 O ASP A 439 7.799 13.627 3.283 1.00 0.00 O ATOM 1194 CB ASP A 439 10.615 11.990 3.638 1.00 0.00 C ATOM 1195 CG ASP A 439 11.201 11.608 4.984 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.543 11.871 6.014 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.317 11.047 5.009 1.00 0.00 O ATOM 0 H ASP A 439 9.817 9.913 2.573 1.00 0.00 H new ATOM 0 HA ASP A 439 8.701 11.613 4.532 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.163 11.477 2.848 1.00 0.00 H new ATOM 0 HB3 ASP A 439 10.750 13.060 3.477 1.00 0.00 H new ATOM 1202 N PHE A 440 8.464 12.587 1.403 1.00 0.00 N ATOM 1203 CA PHE A 440 7.811 13.541 0.511 1.00 0.00 C ATOM 1204 C PHE A 440 6.353 13.761 0.908 1.00 0.00 C ATOM 1205 O PHE A 440 5.861 14.890 0.897 1.00 0.00 O ATOM 1206 CB PHE A 440 7.882 13.042 -0.932 1.00 0.00 C ATOM 1207 CG PHE A 440 8.590 13.986 -1.861 1.00 0.00 C ATOM 1208 CD1 PHE A 440 7.958 15.130 -2.322 1.00 0.00 C ATOM 1209 CD2 PHE A 440 9.888 13.730 -2.273 1.00 0.00 C ATOM 1210 CE1 PHE A 440 8.606 15.999 -3.177 1.00 0.00 C ATOM 1211 CE2 PHE A 440 10.541 14.596 -3.129 1.00 0.00 C ATOM 1212 CZ PHE A 440 9.900 15.733 -3.581 1.00 0.00 C ATOM 0 H PHE A 440 8.959 11.834 0.925 1.00 0.00 H new ATOM 0 HA PHE A 440 8.336 14.493 0.594 1.00 0.00 H new ATOM 0 HB2 PHE A 440 8.391 12.078 -0.950 1.00 0.00 H new ATOM 0 HB3 PHE A 440 6.870 12.875 -1.300 1.00 0.00 H new ATOM 0 HD1 PHE A 440 6.947 15.344 -2.009 1.00 0.00 H new ATOM 0 HD2 PHE A 440 10.395 12.844 -1.921 1.00 0.00 H new ATOM 0 HE1 PHE A 440 8.101 16.886 -3.530 1.00 0.00 H new ATOM 0 HE2 PHE A 440 11.552 14.384 -3.444 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.409 16.412 -4.249 1.00 0.00 H new ATOM 1222 N TYR A 441 5.668 12.677 1.259 1.00 0.00 N ATOM 1223 CA TYR A 441 4.270 12.755 1.657 1.00 0.00 C ATOM 1224 C TYR A 441 4.155 13.030 3.145 1.00 0.00 C ATOM 1225 O TYR A 441 3.432 13.932 3.563 1.00 0.00 O ATOM 1226 CB TYR A 441 3.541 11.464 1.301 1.00 0.00 C ATOM 1227 CG TYR A 441 3.129 11.382 -0.150 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.002 10.894 -1.114 1.00 0.00 C ATOM 1229 CD2 TYR A 441 1.868 11.796 -0.558 1.00 0.00 C ATOM 1230 CE1 TYR A 441 3.630 10.819 -2.443 1.00 0.00 C ATOM 1231 CE2 TYR A 441 1.488 11.725 -1.884 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.372 11.236 -2.823 1.00 0.00 C ATOM 1233 OH TYR A 441 1.998 11.164 -4.145 1.00 0.00 O ATOM 0 H TYR A 441 6.060 11.735 1.275 1.00 0.00 H new ATOM 0 HA TYR A 441 3.805 13.578 1.115 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.185 10.616 1.535 1.00 0.00 H new ATOM 0 HB3 TYR A 441 2.654 11.373 1.928 1.00 0.00 H new ATOM 0 HD1 TYR A 441 4.989 10.568 -0.820 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.173 12.180 0.174 1.00 0.00 H new ATOM 0 HE1 TYR A 441 4.321 10.436 -3.180 1.00 0.00 H new ATOM 0 HE2 TYR A 441 0.503 12.051 -2.184 1.00 0.00 H new ATOM 0 HH TYR A 441 2.464 10.418 -4.577 1.00 0.00 H new ATOM 1243 N ALA A 442 4.873 12.254 3.944 1.00 0.00 N ATOM 1244 CA ALA A 442 4.847 12.433 5.387 1.00 0.00 C ATOM 1245 C ALA A 442 5.202 13.868 5.760 1.00 0.00 C ATOM 1246 O ALA A 442 4.757 14.380 6.787 1.00 0.00 O ATOM 1247 CB ALA A 442 5.789 11.451 6.066 1.00 0.00 C ATOM 0 H ALA A 442 5.477 11.499 3.619 1.00 0.00 H new ATOM 0 HA ALA A 442 3.835 12.232 5.737 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.755 11.601 7.145 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.483 10.432 5.832 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.806 11.616 5.709 1.00 0.00 H new ATOM 1253 N LYS A 443 5.988 14.522 4.908 1.00 0.00 N ATOM 1254 CA LYS A 443 6.374 15.907 5.146 1.00 0.00 C ATOM 1255 C LYS A 443 5.349 16.858 4.531 1.00 0.00 C ATOM 1256 O LYS A 443 5.536 18.075 4.531 1.00 0.00 O ATOM 1257 CB LYS A 443 7.765 16.184 4.569 1.00 0.00 C ATOM 1258 CG LYS A 443 8.535 17.255 5.326 1.00 0.00 C ATOM 1259 CD LYS A 443 9.557 16.643 6.272 1.00 0.00 C ATOM 1260 CE LYS A 443 10.584 15.810 5.522 1.00 0.00 C ATOM 1261 NZ LYS A 443 11.930 15.884 6.154 1.00 0.00 N ATOM 0 H LYS A 443 6.367 14.117 4.052 1.00 0.00 H new ATOM 0 HA LYS A 443 6.405 16.075 6.223 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.343 15.260 4.576 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.663 16.489 3.527 1.00 0.00 H new ATOM 0 HG2 LYS A 443 9.041 17.911 4.617 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.839 17.874 5.892 1.00 0.00 H new ATOM 0 HD2 LYS A 443 10.063 17.435 6.824 1.00 0.00 H new ATOM 0 HD3 LYS A 443 9.047 16.019 7.006 1.00 0.00 H new ATOM 0 HE2 LYS A 443 10.255 14.771 5.490 1.00 0.00 H new ATOM 0 HE3 LYS A 443 10.648 16.156 4.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 12.600 15.302 5.612 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 12.256 16.872 6.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 11.875 15.530 7.130 1.00 0.00 H new ATOM 1275 N GLN A 444 4.260 16.289 4.014 1.00 0.00 N ATOM 1276 CA GLN A 444 3.197 17.069 3.403 1.00 0.00 C ATOM 1277 C GLN A 444 1.872 16.806 4.105 1.00 0.00 C ATOM 1278 O GLN A 444 1.163 17.740 4.478 1.00 0.00 O ATOM 1279 CB GLN A 444 3.077 16.738 1.914 1.00 0.00 C ATOM 1280 CG GLN A 444 4.273 17.183 1.091 1.00 0.00 C ATOM 1281 CD GLN A 444 4.093 18.571 0.505 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.881 18.726 -0.697 1.00 0.00 O ATOM 1283 NE2 GLN A 444 4.177 19.587 1.355 1.00 0.00 N ATOM 0 H GLN A 444 4.095 15.282 4.009 1.00 0.00 H new ATOM 0 HA GLN A 444 3.445 18.125 3.507 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.949 15.662 1.799 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.178 17.210 1.517 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.165 17.170 1.717 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.439 16.470 0.283 1.00 0.00 H new ATOM 0 HE21 GLN A 444 4.354 19.411 2.344 1.00 0.00 H new ATOM 0 HE22 GLN A 444 4.064 20.544 1.019 1.00 0.00 H new ATOM 1292 N ARG A 445 1.543 15.530 4.291 1.00 0.00 N ATOM 1293 CA ARG A 445 0.299 15.166 4.962 1.00 0.00 C ATOM 1294 C ARG A 445 0.357 15.543 6.438 1.00 0.00 C ATOM 1295 O ARG A 445 -0.636 15.986 7.016 1.00 0.00 O ATOM 1296 CB ARG A 445 0.014 13.666 4.802 1.00 0.00 C ATOM 1297 CG ARG A 445 0.786 12.779 5.765 1.00 0.00 C ATOM 1298 CD ARG A 445 0.011 12.539 7.051 1.00 0.00 C ATOM 1299 NE ARG A 445 0.897 12.286 8.185 1.00 0.00 N ATOM 1300 CZ ARG A 445 0.474 12.123 9.436 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -0.822 12.183 9.719 1.00 0.00 N ATOM 1302 NH2 ARG A 445 1.348 11.897 10.407 1.00 0.00 N ATOM 0 H ARG A 445 2.113 14.739 3.990 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.515 15.721 4.495 1.00 0.00 H new ATOM 0 HB2 ARG A 445 -1.053 13.493 4.943 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.253 13.369 3.781 1.00 0.00 H new ATOM 0 HG2 ARG A 445 1.002 11.824 5.287 1.00 0.00 H new ATOM 0 HG3 ARG A 445 1.744 13.243 5.999 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -0.613 13.406 7.265 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -0.659 11.689 6.918 1.00 0.00 H new ATOM 0 HE ARG A 445 1.900 12.231 8.007 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -1.499 12.355 8.976 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -1.141 12.057 10.680 1.00 0.00 H new ATOM 0 HH21 ARG A 445 2.345 11.848 10.195 1.00 0.00 H new ATOM 0 HH22 ARG A 445 1.024 11.772 11.366 1.00 0.00 H new ATOM 1314 N ALA A 446 1.531 15.376 7.037 1.00 0.00 N ATOM 1315 CA ALA A 446 1.726 15.710 8.441 1.00 0.00 C ATOM 1316 C ALA A 446 2.006 17.199 8.600 1.00 0.00 C ATOM 1317 O ALA A 446 1.707 17.792 9.636 1.00 0.00 O ATOM 1318 CB ALA A 446 2.865 14.889 9.028 1.00 0.00 C ATOM 0 H ALA A 446 2.362 15.011 6.571 1.00 0.00 H new ATOM 0 HA ALA A 446 0.812 15.471 8.984 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.998 15.150 10.078 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.629 13.828 8.945 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.785 15.100 8.482 1.00 0.00 H new