USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=13 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 -92:sc= -3.59 USER MOD Set 1.2: A 404 CYS SG : rot 112:sc= -0.0804 USER MOD Single : A 369 ASN : amide:sc= -0.587 K(o=-0.59,f=0) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN : amide:sc= -4.17! C(o=-4.2!,f=-6.8!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -26:sc= 0.828 USER MOD Single : A 380 TYR OH : rot -151:sc= 1.33 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HE2:sc= -2.13 K(o=-2.1,f=-6.2!) USER MOD Single : A 389 THR OG1 : rot -5:sc= 0.615 USER MOD Single : A 399 ASN : amide:sc= -0.446 X(o=-0.45,f=-0.074) USER MOD Single : A 400 SER OG : rot -150:sc= 0 USER MOD Single : A 410 THR OG1 : rot 28:sc= 0.108 USER MOD Single : A 414 THR OG1 : rot -20:sc= -2.07 USER MOD Single : A 419 ASN : amide:sc= -3.97 K(o=-4,f=-23!) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl -129:sc= -0.204 (180deg=-2.31!) USER MOD Single : A 441 TYR OH : rot 180:sc= -0.715 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.18 X(o=-0.18,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -4.373 -2.124 7.876 1.00 0.00 N ATOM 103 CA ASN A 369 -3.255 -1.835 8.762 1.00 0.00 C ATOM 104 C ASN A 369 -2.142 -1.135 7.997 1.00 0.00 C ATOM 105 O ASN A 369 -1.936 0.070 8.140 1.00 0.00 O ATOM 106 CB ASN A 369 -2.735 -3.128 9.389 1.00 0.00 C ATOM 107 CG ASN A 369 -1.542 -2.900 10.298 1.00 0.00 C ATOM 108 OD1 ASN A 369 -1.697 -2.649 11.493 1.00 0.00 O ATOM 109 ND2 ASN A 369 -0.344 -2.986 9.733 1.00 0.00 N ATOM 0 HA ASN A 369 -3.599 -1.173 9.557 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -3.536 -3.598 9.959 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.456 -3.824 8.598 1.00 0.00 H new ATOM 0 HD21 ASN A 369 0.496 -2.842 10.294 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -0.263 -3.196 8.738 1.00 0.00 H new ATOM 116 N ALA A 370 -1.434 -1.897 7.174 1.00 0.00 N ATOM 117 CA ALA A 370 -0.349 -1.348 6.373 1.00 0.00 C ATOM 118 C ALA A 370 -0.877 -0.264 5.441 1.00 0.00 C ATOM 119 O ALA A 370 -0.160 0.674 5.094 1.00 0.00 O ATOM 120 CB ALA A 370 0.336 -2.451 5.580 1.00 0.00 C ATOM 0 H ALA A 370 -1.592 -2.896 7.044 1.00 0.00 H new ATOM 0 HA ALA A 370 0.386 -0.900 7.041 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.145 -2.024 4.987 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.743 -3.194 6.266 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.388 -2.927 4.918 1.00 0.00 H new ATOM 126 N LYS A 371 -2.143 -0.395 5.049 1.00 0.00 N ATOM 127 CA LYS A 371 -2.770 0.581 4.170 1.00 0.00 C ATOM 128 C LYS A 371 -3.159 1.826 4.956 1.00 0.00 C ATOM 129 O LYS A 371 -3.070 2.944 4.452 1.00 0.00 O ATOM 130 CB LYS A 371 -4.003 -0.023 3.494 1.00 0.00 C ATOM 131 CG LYS A 371 -4.646 0.897 2.469 1.00 0.00 C ATOM 132 CD LYS A 371 -6.150 0.693 2.406 1.00 0.00 C ATOM 133 CE LYS A 371 -6.831 1.804 1.624 1.00 0.00 C ATOM 134 NZ LYS A 371 -8.190 1.407 1.161 1.00 0.00 N ATOM 0 H LYS A 371 -2.750 -1.166 5.327 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.053 0.863 3.399 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.719 -0.955 3.006 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.739 -0.274 4.257 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.429 1.935 2.722 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -4.211 0.711 1.487 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.369 -0.268 1.940 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.556 0.657 3.417 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.906 2.694 2.249 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -6.218 2.070 0.763 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -8.620 2.193 0.632 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.117 0.573 0.544 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -8.784 1.178 1.983 1.00 0.00 H new ATOM 148 N ARG A 372 -3.578 1.623 6.202 1.00 0.00 N ATOM 149 CA ARG A 372 -3.963 2.733 7.062 1.00 0.00 C ATOM 150 C ARG A 372 -2.735 3.555 7.437 1.00 0.00 C ATOM 151 O ARG A 372 -2.829 4.756 7.689 1.00 0.00 O ATOM 152 CB ARG A 372 -4.656 2.217 8.325 1.00 0.00 C ATOM 153 CG ARG A 372 -5.681 1.128 8.055 1.00 0.00 C ATOM 154 CD ARG A 372 -6.780 1.122 9.107 1.00 0.00 C ATOM 155 NE ARG A 372 -6.570 0.082 10.112 1.00 0.00 N ATOM 156 CZ ARG A 372 -7.225 0.027 11.270 1.00 0.00 C ATOM 157 NH1 ARG A 372 -8.129 0.950 11.573 1.00 0.00 N ATOM 158 NH2 ARG A 372 -6.975 -0.954 12.126 1.00 0.00 N ATOM 0 H ARG A 372 -3.659 0.703 6.635 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.662 3.368 6.517 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -3.902 1.832 9.012 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.148 3.051 8.826 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -6.121 1.278 7.069 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -5.186 0.157 8.039 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -6.820 2.096 9.596 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -7.745 0.969 8.623 1.00 0.00 H new ATOM 0 HE ARG A 372 -5.881 -0.644 9.915 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -8.325 1.706 10.917 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -8.628 0.903 12.461 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -6.281 -1.666 11.897 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -7.476 -0.997 13.013 1.00 0.00 H new ATOM 170 N GLN A 373 -1.581 2.894 7.461 1.00 0.00 N ATOM 171 CA GLN A 373 -0.327 3.554 7.793 1.00 0.00 C ATOM 172 C GLN A 373 0.054 4.555 6.710 1.00 0.00 C ATOM 173 O GLN A 373 0.329 5.720 6.996 1.00 0.00 O ATOM 174 CB GLN A 373 0.786 2.516 7.958 1.00 0.00 C ATOM 175 CG GLN A 373 1.427 2.526 9.335 1.00 0.00 C ATOM 176 CD GLN A 373 2.379 3.689 9.527 1.00 0.00 C ATOM 177 OE1 GLN A 373 2.035 4.691 10.153 1.00 0.00 O ATOM 178 NE2 GLN A 373 3.587 3.560 8.990 1.00 0.00 N ATOM 0 H GLN A 373 -1.491 1.899 7.254 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.458 4.090 8.733 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.378 1.524 7.763 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.555 2.697 7.207 1.00 0.00 H new ATOM 0 HG2 GLN A 373 0.646 2.571 10.095 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.966 1.591 9.487 1.00 0.00 H new ATOM 0 HE21 GLN A 373 3.830 2.711 8.479 1.00 0.00 H new ATOM 0 HE22 GLN A 373 4.272 4.310 9.089 1.00 0.00 H new ATOM 187 N LEU A 374 0.067 4.091 5.465 1.00 0.00 N ATOM 188 CA LEU A 374 0.417 4.943 4.337 1.00 0.00 C ATOM 189 C LEU A 374 -0.561 6.104 4.207 1.00 0.00 C ATOM 190 O LEU A 374 -0.167 7.230 3.909 1.00 0.00 O ATOM 191 CB LEU A 374 0.435 4.128 3.042 1.00 0.00 C ATOM 192 CG LEU A 374 1.709 3.317 2.806 1.00 0.00 C ATOM 193 CD1 LEU A 374 1.425 2.125 1.904 1.00 0.00 C ATOM 194 CD2 LEU A 374 2.796 4.196 2.204 1.00 0.00 C ATOM 0 H LEU A 374 -0.161 3.129 5.213 1.00 0.00 H new ATOM 0 HA LEU A 374 1.412 5.350 4.517 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.416 3.446 3.048 1.00 0.00 H new ATOM 0 HB3 LEU A 374 0.294 4.807 2.201 1.00 0.00 H new ATOM 0 HG LEU A 374 2.062 2.943 3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 374 2.344 1.560 1.748 1.00 0.00 H new ATOM 0 HD12 LEU A 374 0.680 1.483 2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 374 1.048 2.477 0.944 1.00 0.00 H new ATOM 0 HD21 LEU A 374 3.696 3.603 2.043 1.00 0.00 H new ATOM 0 HD22 LEU A 374 2.452 4.600 1.252 1.00 0.00 H new ATOM 0 HD23 LEU A 374 3.020 5.016 2.886 1.00 0.00 H new ATOM 206 N TYR A 375 -1.837 5.826 4.433 1.00 0.00 N ATOM 207 CA TYR A 375 -2.864 6.856 4.336 1.00 0.00 C ATOM 208 C TYR A 375 -2.717 7.877 5.457 1.00 0.00 C ATOM 209 O TYR A 375 -3.050 9.050 5.289 1.00 0.00 O ATOM 210 CB TYR A 375 -4.257 6.224 4.375 1.00 0.00 C ATOM 211 CG TYR A 375 -5.130 6.601 3.199 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.420 7.931 2.924 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.661 5.627 2.363 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.217 8.279 1.850 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.458 5.967 1.287 1.00 0.00 C ATOM 216 CZ TYR A 375 -6.734 7.294 1.035 1.00 0.00 C ATOM 217 OH TYR A 375 -7.528 7.637 -0.035 1.00 0.00 O ATOM 0 H TYR A 375 -2.186 4.901 4.684 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.738 7.373 3.384 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.153 5.139 4.406 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.756 6.523 5.297 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -5.016 8.705 3.559 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.447 4.586 2.557 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -6.434 9.318 1.650 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -6.863 5.197 0.647 1.00 0.00 H new ATOM 0 HH TYR A 375 -7.809 6.826 -0.507 1.00 0.00 H new ATOM 227 N SER A 376 -2.213 7.425 6.598 1.00 0.00 N ATOM 228 CA SER A 376 -2.018 8.301 7.744 1.00 0.00 C ATOM 229 C SER A 376 -0.627 8.933 7.726 1.00 0.00 C ATOM 230 O SER A 376 -0.339 9.834 8.513 1.00 0.00 O ATOM 231 CB SER A 376 -2.222 7.524 9.046 1.00 0.00 C ATOM 232 OG SER A 376 -1.160 6.610 9.266 1.00 0.00 O ATOM 0 H SER A 376 -1.932 6.457 6.754 1.00 0.00 H new ATOM 0 HA SER A 376 -2.757 9.100 7.684 1.00 0.00 H new ATOM 0 HB2 SER A 376 -2.286 8.220 9.882 1.00 0.00 H new ATOM 0 HB3 SER A 376 -3.168 6.984 9.007 1.00 0.00 H new ATOM 0 HG SER A 376 -0.758 6.363 8.407 1.00 0.00 H new ATOM 238 N LEU A 377 0.239 8.452 6.833 1.00 0.00 N ATOM 239 CA LEU A 377 1.595 8.974 6.736 1.00 0.00 C ATOM 240 C LEU A 377 1.824 9.732 5.429 1.00 0.00 C ATOM 241 O LEU A 377 2.715 10.575 5.349 1.00 0.00 O ATOM 242 CB LEU A 377 2.613 7.837 6.862 1.00 0.00 C ATOM 243 CG LEU A 377 3.244 7.690 8.246 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.198 7.273 9.268 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.384 6.683 8.206 1.00 0.00 C ATOM 0 H LEU A 377 0.024 7.706 6.172 1.00 0.00 H new ATOM 0 HA LEU A 377 1.731 9.677 7.557 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.123 6.899 6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.406 7.996 6.132 1.00 0.00 H new ATOM 0 HG LEU A 377 3.649 8.657 8.545 1.00 0.00 H new ATOM 0 HD11 LEU A 377 2.666 7.173 10.247 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.414 8.029 9.316 1.00 0.00 H new ATOM 0 HD13 LEU A 377 1.763 6.317 8.975 1.00 0.00 H new ATOM 0 HD21 LEU A 377 4.822 6.590 9.200 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.002 5.714 7.886 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.145 7.023 7.504 1.00 0.00 H new ATOM 257 N ILE A 378 1.032 9.431 4.400 1.00 0.00 N ATOM 258 CA ILE A 378 1.195 10.105 3.116 1.00 0.00 C ATOM 259 C ILE A 378 -0.144 10.457 2.471 1.00 0.00 C ATOM 260 O ILE A 378 -0.261 11.481 1.798 1.00 0.00 O ATOM 261 CB ILE A 378 2.040 9.261 2.137 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.331 7.953 1.781 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.406 8.973 2.737 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.771 7.376 0.455 1.00 0.00 C ATOM 0 H ILE A 378 0.285 8.738 4.430 1.00 0.00 H new ATOM 0 HA ILE A 378 1.723 11.035 3.327 1.00 0.00 H new ATOM 0 HB ILE A 378 2.169 9.835 1.219 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.517 7.221 2.567 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.255 8.126 1.755 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.992 8.377 2.037 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.922 9.913 2.935 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.285 8.422 3.670 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.230 6.449 0.264 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.560 8.090 -0.341 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.841 7.171 0.484 1.00 0.00 H new ATOM 276 N GLY A 379 -1.153 9.616 2.674 1.00 0.00 N ATOM 277 CA GLY A 379 -2.458 9.880 2.097 1.00 0.00 C ATOM 278 C GLY A 379 -3.145 11.070 2.741 1.00 0.00 C ATOM 279 O GLY A 379 -3.714 10.950 3.826 1.00 0.00 O ATOM 0 H GLY A 379 -1.091 8.760 3.225 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.350 10.061 1.028 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.087 8.997 2.208 1.00 0.00 H new ATOM 283 N TYR A 380 -3.089 12.221 2.076 1.00 0.00 N ATOM 284 CA TYR A 380 -3.711 13.433 2.603 1.00 0.00 C ATOM 285 C TYR A 380 -5.019 13.749 1.882 1.00 0.00 C ATOM 286 O TYR A 380 -5.968 14.243 2.491 1.00 0.00 O ATOM 287 CB TYR A 380 -2.758 14.631 2.502 1.00 0.00 C ATOM 288 CG TYR A 380 -1.812 14.582 1.321 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.283 14.690 0.019 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.445 14.429 1.512 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.417 14.649 -1.058 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.426 14.388 0.443 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.064 14.497 -0.842 1.00 0.00 C ATOM 294 OH TYR A 380 0.800 14.456 -1.911 1.00 0.00 O ATOM 0 H TYR A 380 -2.622 12.340 1.177 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.933 13.248 3.654 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.349 15.545 2.441 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.172 14.691 3.419 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.342 14.808 -0.155 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.057 14.340 2.516 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.799 14.736 -2.064 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.486 14.271 0.611 1.00 0.00 H new ATOM 0 HH TYR A 380 1.582 13.913 -1.679 1.00 0.00 H new ATOM 304 N ALA A 381 -5.064 13.465 0.585 1.00 0.00 N ATOM 305 CA ALA A 381 -6.260 13.725 -0.209 1.00 0.00 C ATOM 306 C ALA A 381 -6.110 13.171 -1.622 1.00 0.00 C ATOM 307 O ALA A 381 -6.593 12.080 -1.923 1.00 0.00 O ATOM 308 CB ALA A 381 -6.553 15.218 -0.248 1.00 0.00 C ATOM 0 H ALA A 381 -4.289 13.056 0.062 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.100 13.216 0.263 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.448 15.398 -0.844 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -6.713 15.584 0.766 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -5.708 15.743 -0.694 1.00 0.00 H new ATOM 314 N SER A 382 -5.431 13.924 -2.485 1.00 0.00 N ATOM 315 CA SER A 382 -5.215 13.496 -3.863 1.00 0.00 C ATOM 316 C SER A 382 -4.559 12.118 -3.901 1.00 0.00 C ATOM 317 O SER A 382 -4.700 11.379 -4.876 1.00 0.00 O ATOM 318 CB SER A 382 -4.343 14.512 -4.604 1.00 0.00 C ATOM 319 OG SER A 382 -4.814 14.719 -5.926 1.00 0.00 O ATOM 0 H SER A 382 -5.023 14.830 -2.255 1.00 0.00 H new ATOM 0 HA SER A 382 -6.184 13.434 -4.358 1.00 0.00 H new ATOM 0 HB2 SER A 382 -4.341 15.458 -4.063 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.312 14.159 -4.633 1.00 0.00 H new ATOM 0 HG SER A 382 -4.242 15.373 -6.378 1.00 0.00 H new ATOM 325 N LEU A 383 -3.850 11.781 -2.829 1.00 0.00 N ATOM 326 CA LEU A 383 -3.176 10.493 -2.728 1.00 0.00 C ATOM 327 C LEU A 383 -4.191 9.378 -2.489 1.00 0.00 C ATOM 328 O LEU A 383 -4.280 8.827 -1.391 1.00 0.00 O ATOM 329 CB LEU A 383 -2.142 10.531 -1.591 1.00 0.00 C ATOM 330 CG LEU A 383 -0.674 10.350 -2.003 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.275 8.885 -1.920 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.415 10.900 -3.401 1.00 0.00 C ATOM 0 H LEU A 383 -3.727 12.384 -2.016 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.660 10.291 -3.666 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -2.237 11.485 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.395 9.752 -0.872 1.00 0.00 H new ATOM 0 HG LEU A 383 -0.059 10.919 -1.306 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.768 8.775 -2.215 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.402 8.531 -0.897 1.00 0.00 H new ATOM 0 HD13 LEU A 383 -0.905 8.298 -2.588 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.634 10.755 -3.660 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -1.043 10.375 -4.121 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.651 11.964 -3.423 1.00 0.00 H new ATOM 344 N ARG A 384 -4.956 9.052 -3.526 1.00 0.00 N ATOM 345 CA ARG A 384 -5.967 8.006 -3.431 1.00 0.00 C ATOM 346 C ARG A 384 -5.316 6.637 -3.259 1.00 0.00 C ATOM 347 O ARG A 384 -5.312 5.819 -4.179 1.00 0.00 O ATOM 348 CB ARG A 384 -6.855 8.013 -4.678 1.00 0.00 C ATOM 349 CG ARG A 384 -8.187 8.716 -4.471 1.00 0.00 C ATOM 350 CD ARG A 384 -8.628 9.456 -5.724 1.00 0.00 C ATOM 351 NE ARG A 384 -9.767 10.336 -5.468 1.00 0.00 N ATOM 352 CZ ARG A 384 -9.664 11.535 -4.900 1.00 0.00 C ATOM 353 NH1 ARG A 384 -8.478 12.000 -4.526 1.00 0.00 N ATOM 354 NH2 ARG A 384 -10.749 12.270 -4.705 1.00 0.00 N ATOM 0 H ARG A 384 -4.895 9.497 -4.442 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.584 8.206 -2.555 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.319 8.500 -5.493 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.040 6.985 -4.988 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.946 7.985 -4.193 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.103 9.419 -3.642 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -7.795 10.044 -6.110 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -8.894 8.734 -6.497 1.00 0.00 H new ATOM 0 HE ARG A 384 -10.695 10.012 -5.741 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -7.640 11.438 -4.674 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -8.405 12.920 -4.091 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -11.662 11.917 -4.990 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -10.671 13.189 -4.270 1.00 0.00 H new ATOM 366 N LEU A 385 -4.766 6.396 -2.074 1.00 0.00 N ATOM 367 CA LEU A 385 -4.112 5.127 -1.779 1.00 0.00 C ATOM 368 C LEU A 385 -5.086 3.964 -1.939 1.00 0.00 C ATOM 369 O LEU A 385 -5.860 3.660 -1.032 1.00 0.00 O ATOM 370 CB LEU A 385 -3.540 5.141 -0.360 1.00 0.00 C ATOM 371 CG LEU A 385 -2.468 4.084 -0.085 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.078 4.694 -0.190 1.00 0.00 C ATOM 373 CD2 LEU A 385 -2.674 3.457 1.286 1.00 0.00 C ATOM 0 H LEU A 385 -4.760 7.063 -1.302 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.296 4.993 -2.489 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.116 6.126 -0.165 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.358 5.000 0.347 1.00 0.00 H new ATOM 0 HG LEU A 385 -2.558 3.300 -0.837 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -0.329 3.928 0.009 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -0.931 5.094 -1.193 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -0.977 5.498 0.539 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -1.902 2.708 1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -2.613 4.230 2.052 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -3.655 2.984 1.326 1.00 0.00 H new ATOM 385 N HIS A 386 -5.039 3.318 -3.099 1.00 0.00 N ATOM 386 CA HIS A 386 -5.912 2.190 -3.383 1.00 0.00 C ATOM 387 C HIS A 386 -5.098 0.979 -3.820 1.00 0.00 C ATOM 388 O HIS A 386 -4.179 1.099 -4.631 1.00 0.00 O ATOM 389 CB HIS A 386 -6.928 2.558 -4.465 1.00 0.00 C ATOM 390 CG HIS A 386 -6.298 2.944 -5.769 1.00 0.00 C ATOM 391 ND1 HIS A 386 -6.069 4.253 -6.136 1.00 0.00 N ATOM 392 CD2 HIS A 386 -5.849 2.183 -6.795 1.00 0.00 C ATOM 393 CE1 HIS A 386 -5.508 4.281 -7.332 1.00 0.00 C ATOM 394 NE2 HIS A 386 -5.363 3.039 -7.753 1.00 0.00 N ATOM 0 H HIS A 386 -4.403 3.559 -3.859 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.450 1.937 -2.469 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.595 1.712 -4.629 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -7.543 3.384 -4.109 1.00 0.00 H new ATOM 0 HD1 HIS A 386 -6.297 5.072 -5.572 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -5.869 1.105 -6.850 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -5.218 5.169 -7.873 1.00 0.00 H new ATOM 403 N TYR A 387 -5.433 -0.184 -3.275 1.00 0.00 N ATOM 404 CA TYR A 387 -4.723 -1.411 -3.607 1.00 0.00 C ATOM 405 C TYR A 387 -5.499 -2.242 -4.619 1.00 0.00 C ATOM 406 O TYR A 387 -6.677 -2.540 -4.425 1.00 0.00 O ATOM 407 CB TYR A 387 -4.457 -2.225 -2.344 1.00 0.00 C ATOM 408 CG TYR A 387 -3.333 -1.660 -1.511 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.425 -0.386 -0.967 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.176 -2.391 -1.281 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.395 0.145 -0.216 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.142 -1.870 -0.530 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.256 -0.601 0.000 1.00 0.00 C ATOM 414 OH TYR A 387 -0.228 -0.074 0.746 1.00 0.00 O ATOM 0 H TYR A 387 -6.191 -0.302 -2.602 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.770 -1.137 -4.060 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.366 -2.262 -1.743 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.217 -3.251 -2.622 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.317 0.200 -1.134 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.083 -3.384 -1.696 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.481 1.138 0.199 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.249 -2.452 -0.358 1.00 0.00 H new ATOM 0 HH TYR A 387 0.410 0.375 0.153 1.00 0.00 H new ATOM 424 N VAL A 388 -4.826 -2.609 -5.703 1.00 0.00 N ATOM 425 CA VAL A 388 -5.440 -3.400 -6.756 1.00 0.00 C ATOM 426 C VAL A 388 -4.679 -4.704 -6.979 1.00 0.00 C ATOM 427 O VAL A 388 -3.526 -4.695 -7.410 1.00 0.00 O ATOM 428 CB VAL A 388 -5.492 -2.611 -8.077 1.00 0.00 C ATOM 429 CG1 VAL A 388 -6.134 -3.440 -9.181 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.239 -1.300 -7.884 1.00 0.00 C ATOM 0 H VAL A 388 -3.850 -2.368 -5.874 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.456 -3.632 -6.436 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.470 -2.384 -8.379 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -6.159 -2.860 -10.104 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.553 -4.348 -9.339 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -7.151 -3.706 -8.892 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.267 -0.755 -8.827 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.257 -1.507 -7.554 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.729 -0.698 -7.132 1.00 0.00 H new ATOM 440 N THR A 389 -5.333 -5.824 -6.687 1.00 0.00 N ATOM 441 CA THR A 389 -4.716 -7.134 -6.861 1.00 0.00 C ATOM 442 C THR A 389 -4.832 -7.591 -8.312 1.00 0.00 C ATOM 443 O THR A 389 -5.935 -7.758 -8.835 1.00 0.00 O ATOM 444 CB THR A 389 -5.368 -8.161 -5.934 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.608 -8.599 -6.460 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.622 -7.631 -4.539 1.00 0.00 C ATOM 0 H THR A 389 -6.288 -5.851 -6.330 1.00 0.00 H new ATOM 0 HA THR A 389 -3.660 -7.051 -6.604 1.00 0.00 H new ATOM 0 HB THR A 389 -4.656 -8.983 -5.869 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.819 -8.088 -7.269 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.086 -8.409 -3.933 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.677 -7.333 -4.085 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.287 -6.769 -4.593 1.00 0.00 H new ATOM 594 N ASN A 399 0.852 -16.698 -6.767 1.00 0.00 N ATOM 595 CA ASN A 399 0.488 -16.092 -5.492 1.00 0.00 C ATOM 596 C ASN A 399 -0.408 -14.877 -5.704 1.00 0.00 C ATOM 597 O ASN A 399 -0.835 -14.596 -6.824 1.00 0.00 O ATOM 598 CB ASN A 399 1.744 -15.685 -4.718 1.00 0.00 C ATOM 599 CG ASN A 399 2.714 -16.836 -4.541 1.00 0.00 C ATOM 600 OD1 ASN A 399 2.839 -17.395 -3.452 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.408 -17.195 -5.615 1.00 0.00 N ATOM 0 HA ASN A 399 -0.063 -16.832 -4.912 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.243 -14.871 -5.244 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.456 -15.303 -3.739 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.077 -17.963 -5.557 1.00 0.00 H new ATOM 0 HD22 ASN A 399 3.272 -16.703 -6.498 1.00 0.00 H new ATOM 608 N SER A 400 -0.687 -14.157 -4.622 1.00 0.00 N ATOM 609 CA SER A 400 -1.527 -12.969 -4.692 1.00 0.00 C ATOM 610 C SER A 400 -0.673 -11.714 -4.812 1.00 0.00 C ATOM 611 O SER A 400 -0.126 -11.228 -3.822 1.00 0.00 O ATOM 612 CB SER A 400 -2.425 -12.875 -3.457 1.00 0.00 C ATOM 613 OG SER A 400 -3.694 -13.456 -3.702 1.00 0.00 O ATOM 0 H SER A 400 -0.343 -14.376 -3.687 1.00 0.00 H new ATOM 0 HA SER A 400 -2.156 -13.049 -5.579 1.00 0.00 H new ATOM 0 HB2 SER A 400 -1.947 -13.379 -2.617 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.549 -11.830 -3.173 1.00 0.00 H new ATOM 0 HG SER A 400 -4.372 -13.003 -3.158 1.00 0.00 H new ATOM 619 N ILE A 401 -0.557 -11.196 -6.028 1.00 0.00 N ATOM 620 CA ILE A 401 0.235 -10.000 -6.272 1.00 0.00 C ATOM 621 C ILE A 401 -0.638 -8.748 -6.237 1.00 0.00 C ATOM 622 O ILE A 401 -1.668 -8.678 -6.907 1.00 0.00 O ATOM 623 CB ILE A 401 0.985 -10.088 -7.623 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.338 -9.383 -7.522 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.158 -9.498 -8.760 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.229 -7.910 -7.185 1.00 0.00 C ATOM 0 H ILE A 401 -1.001 -11.586 -6.859 1.00 0.00 H new ATOM 0 HA ILE A 401 0.974 -9.931 -5.474 1.00 0.00 H new ATOM 0 HB ILE A 401 1.150 -11.142 -7.848 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.941 -9.878 -6.760 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.867 -9.493 -8.468 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.715 -9.576 -9.694 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.780 -10.046 -8.850 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.053 -8.449 -8.550 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.227 -7.475 -7.130 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.654 -7.401 -7.959 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.728 -7.793 -6.224 1.00 0.00 H new ATOM 638 N VAL A 402 -0.220 -7.762 -5.451 1.00 0.00 N ATOM 639 CA VAL A 402 -0.963 -6.517 -5.330 1.00 0.00 C ATOM 640 C VAL A 402 -0.080 -5.320 -5.653 1.00 0.00 C ATOM 641 O VAL A 402 1.146 -5.391 -5.551 1.00 0.00 O ATOM 642 CB VAL A 402 -1.554 -6.348 -3.918 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.434 -5.109 -3.849 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.337 -7.589 -3.516 1.00 0.00 C ATOM 0 H VAL A 402 0.630 -7.803 -4.889 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.781 -6.564 -6.049 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.732 -6.219 -3.214 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.842 -5.008 -2.843 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.840 -4.227 -4.090 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.251 -5.203 -4.564 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.747 -7.452 -2.516 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.151 -7.751 -4.223 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.675 -8.455 -3.521 1.00 0.00 H new ATOM 654 N GLU A 403 -0.712 -4.222 -6.046 1.00 0.00 N ATOM 655 CA GLU A 403 0.012 -3.006 -6.389 1.00 0.00 C ATOM 656 C GLU A 403 -0.719 -1.773 -5.868 1.00 0.00 C ATOM 657 O GLU A 403 -1.823 -1.458 -6.313 1.00 0.00 O ATOM 658 CB GLU A 403 0.192 -2.905 -7.904 1.00 0.00 C ATOM 659 CG GLU A 403 1.452 -3.584 -8.414 1.00 0.00 C ATOM 660 CD GLU A 403 1.224 -4.339 -9.710 1.00 0.00 C ATOM 661 OE1 GLU A 403 0.775 -3.712 -10.692 1.00 0.00 O ATOM 662 OE2 GLU A 403 1.494 -5.558 -9.741 1.00 0.00 O ATOM 0 H GLU A 403 -1.725 -4.149 -6.135 1.00 0.00 H new ATOM 0 HA GLU A 403 0.993 -3.051 -5.916 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.674 -3.349 -8.395 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.215 -1.853 -8.189 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.228 -2.834 -8.566 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.821 -4.275 -7.655 1.00 0.00 H new ATOM 669 N CYS A 404 -0.093 -1.079 -4.925 1.00 0.00 N ATOM 670 CA CYS A 404 -0.681 0.122 -4.343 1.00 0.00 C ATOM 671 C CYS A 404 -0.475 1.322 -5.261 1.00 0.00 C ATOM 672 O CYS A 404 0.646 1.797 -5.432 1.00 0.00 O ATOM 673 CB CYS A 404 -0.062 0.404 -2.972 1.00 0.00 C ATOM 674 SG CYS A 404 -0.666 1.916 -2.182 1.00 0.00 S ATOM 0 H CYS A 404 0.821 -1.327 -4.547 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.751 -0.046 -4.223 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.263 -0.442 -2.314 1.00 0.00 H new ATOM 0 HB3 CYS A 404 1.020 0.472 -3.082 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.369 1.607 -1.133 1.00 0.00 H new ATOM 680 N ARG A 405 -1.565 1.811 -5.843 1.00 0.00 N ATOM 681 CA ARG A 405 -1.500 2.959 -6.735 1.00 0.00 C ATOM 682 C ARG A 405 -2.106 4.188 -6.074 1.00 0.00 C ATOM 683 O ARG A 405 -3.113 4.096 -5.371 1.00 0.00 O ATOM 684 CB ARG A 405 -2.227 2.661 -8.047 1.00 0.00 C ATOM 685 CG ARG A 405 -1.447 1.752 -8.984 1.00 0.00 C ATOM 686 CD ARG A 405 -2.087 0.377 -9.092 1.00 0.00 C ATOM 687 NE ARG A 405 -3.127 0.335 -10.118 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.893 0.487 -11.419 1.00 0.00 C ATOM 689 NH1 ARG A 405 -1.657 0.693 -11.858 1.00 0.00 N ATOM 690 NH2 ARG A 405 -3.895 0.431 -12.285 1.00 0.00 N ATOM 0 H ARG A 405 -2.502 1.430 -5.712 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.451 3.160 -6.951 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.188 2.199 -7.823 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.437 3.601 -8.558 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.394 2.208 -9.973 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -0.423 1.650 -8.624 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -1.320 -0.362 -9.323 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.517 0.101 -8.129 1.00 0.00 H new ATOM 0 HE ARG A 405 -4.090 0.180 -9.819 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -0.881 0.735 -11.197 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -1.483 0.809 -12.856 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -4.847 0.271 -11.954 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -3.714 0.548 -13.282 1.00 0.00 H new ATOM 702 N VAL A 406 -1.485 5.340 -6.300 1.00 0.00 N ATOM 703 CA VAL A 406 -1.964 6.586 -5.722 1.00 0.00 C ATOM 704 C VAL A 406 -2.289 7.610 -6.803 1.00 0.00 C ATOM 705 O VAL A 406 -1.791 7.524 -7.925 1.00 0.00 O ATOM 706 CB VAL A 406 -0.933 7.192 -4.751 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.775 6.312 -3.521 1.00 0.00 C ATOM 708 CG2 VAL A 406 0.404 7.392 -5.448 1.00 0.00 C ATOM 0 H VAL A 406 -0.650 5.435 -6.879 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.873 6.344 -5.171 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.297 8.167 -4.427 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.043 6.757 -2.847 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -1.734 6.226 -3.009 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -0.435 5.321 -3.824 1.00 0.00 H new ATOM 0 HG21 VAL A 406 1.119 7.821 -4.746 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.776 6.431 -5.804 1.00 0.00 H new ATOM 0 HG23 VAL A 406 0.276 8.067 -6.294 1.00 0.00 H new ATOM 744 N THR A 410 -0.247 6.175 -9.755 1.00 0.00 N ATOM 745 CA THR A 410 1.184 6.044 -9.510 1.00 0.00 C ATOM 746 C THR A 410 1.458 5.006 -8.425 1.00 0.00 C ATOM 747 O THR A 410 1.199 5.244 -7.246 1.00 0.00 O ATOM 748 CB THR A 410 1.779 7.392 -9.102 1.00 0.00 C ATOM 749 OG1 THR A 410 1.524 8.373 -10.092 1.00 0.00 O ATOM 750 CG2 THR A 410 3.276 7.344 -8.879 1.00 0.00 C ATOM 0 HA THR A 410 1.656 5.711 -10.435 1.00 0.00 H new ATOM 0 HB THR A 410 1.296 7.647 -8.159 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.701 8.146 -10.573 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.633 8.333 -8.592 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.503 6.632 -8.086 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.771 7.032 -9.799 1.00 0.00 H new ATOM 758 N VAL A 411 1.984 3.855 -8.833 1.00 0.00 N ATOM 759 CA VAL A 411 2.293 2.784 -7.893 1.00 0.00 C ATOM 760 C VAL A 411 3.356 3.223 -6.893 1.00 0.00 C ATOM 761 O VAL A 411 4.470 3.586 -7.272 1.00 0.00 O ATOM 762 CB VAL A 411 2.773 1.515 -8.623 1.00 0.00 C ATOM 763 CG1 VAL A 411 4.057 1.790 -9.393 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.967 0.369 -7.638 1.00 0.00 C ATOM 0 H VAL A 411 2.204 3.641 -9.806 1.00 0.00 H new ATOM 0 HA VAL A 411 1.371 2.554 -7.358 1.00 0.00 H new ATOM 0 HB VAL A 411 2.005 1.221 -9.339 1.00 0.00 H new ATOM 0 HG11 VAL A 411 4.378 0.881 -9.901 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.879 2.574 -10.130 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.834 2.113 -8.701 1.00 0.00 H new ATOM 0 HG21 VAL A 411 3.306 -0.518 -8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.712 0.651 -6.894 1.00 0.00 H new ATOM 0 HG23 VAL A 411 2.022 0.153 -7.140 1.00 0.00 H new ATOM 774 N LEU A 412 3.000 3.187 -5.615 1.00 0.00 N ATOM 775 CA LEU A 412 3.916 3.579 -4.555 1.00 0.00 C ATOM 776 C LEU A 412 4.414 2.364 -3.780 1.00 0.00 C ATOM 777 O LEU A 412 5.450 2.424 -3.116 1.00 0.00 O ATOM 778 CB LEU A 412 3.229 4.556 -3.600 1.00 0.00 C ATOM 779 CG LEU A 412 4.135 5.647 -3.026 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.074 6.899 -3.886 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.744 5.965 -1.590 1.00 0.00 C ATOM 0 H LEU A 412 2.081 2.889 -5.288 1.00 0.00 H new ATOM 0 HA LEU A 412 4.775 4.067 -5.016 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.401 5.032 -4.125 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.799 3.990 -2.773 1.00 0.00 H new ATOM 0 HG LEU A 412 5.161 5.278 -3.029 1.00 0.00 H new ATOM 0 HD11 LEU A 412 4.725 7.664 -3.462 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.404 6.662 -4.898 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.050 7.270 -3.916 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.399 6.743 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.711 6.313 -1.563 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.841 5.067 -0.979 1.00 0.00 H new ATOM 793 N GLY A 413 3.672 1.262 -3.859 1.00 0.00 N ATOM 794 CA GLY A 413 4.066 0.058 -3.148 1.00 0.00 C ATOM 795 C GLY A 413 3.515 -1.211 -3.773 1.00 0.00 C ATOM 796 O GLY A 413 2.300 -1.388 -3.869 1.00 0.00 O ATOM 0 H GLY A 413 2.810 1.181 -4.399 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.154 -0.001 -3.121 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.724 0.125 -2.115 1.00 0.00 H new ATOM 800 N THR A 414 4.413 -2.097 -4.192 1.00 0.00 N ATOM 801 CA THR A 414 4.025 -3.358 -4.804 1.00 0.00 C ATOM 802 C THR A 414 4.640 -4.532 -4.045 1.00 0.00 C ATOM 803 O THR A 414 5.717 -4.408 -3.462 1.00 0.00 O ATOM 804 CB THR A 414 4.472 -3.381 -6.266 1.00 0.00 C ATOM 805 OG1 THR A 414 3.760 -2.419 -7.023 1.00 0.00 O ATOM 806 CG2 THR A 414 4.284 -4.724 -6.939 1.00 0.00 C ATOM 0 H THR A 414 5.421 -1.961 -4.117 1.00 0.00 H new ATOM 0 HA THR A 414 2.940 -3.452 -4.761 1.00 0.00 H new ATOM 0 HB THR A 414 5.538 -3.157 -6.239 1.00 0.00 H new ATOM 0 HG1 THR A 414 2.936 -2.176 -6.551 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.623 -4.663 -7.973 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.865 -5.480 -6.411 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.229 -4.997 -6.918 1.00 0.00 H new ATOM 814 N GLY A 415 3.954 -5.672 -4.054 1.00 0.00 N ATOM 815 CA GLY A 415 4.461 -6.842 -3.359 1.00 0.00 C ATOM 816 C GLY A 415 3.549 -8.049 -3.491 1.00 0.00 C ATOM 817 O GLY A 415 2.341 -7.907 -3.673 1.00 0.00 O ATOM 0 H GLY A 415 3.061 -5.806 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.446 -7.093 -3.752 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.590 -6.604 -2.303 1.00 0.00 H new ATOM 821 N VAL A 416 4.135 -9.240 -3.395 1.00 0.00 N ATOM 822 CA VAL A 416 3.383 -10.480 -3.501 1.00 0.00 C ATOM 823 C VAL A 416 2.987 -10.997 -2.120 1.00 0.00 C ATOM 824 O VAL A 416 3.551 -10.583 -1.108 1.00 0.00 O ATOM 825 CB VAL A 416 4.209 -11.560 -4.220 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.387 -12.821 -4.438 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.749 -11.032 -5.541 1.00 0.00 C ATOM 0 H VAL A 416 5.135 -9.369 -3.243 1.00 0.00 H new ATOM 0 HA VAL A 416 2.483 -10.267 -4.078 1.00 0.00 H new ATOM 0 HB VAL A 416 5.055 -11.818 -3.583 1.00 0.00 H new ATOM 0 HG11 VAL A 416 3.995 -13.568 -4.948 1.00 0.00 H new ATOM 0 HG12 VAL A 416 3.062 -13.214 -3.475 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.514 -12.586 -5.047 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.330 -11.811 -6.034 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.918 -10.739 -6.183 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.386 -10.167 -5.354 1.00 0.00 H new ATOM 837 N GLY A 417 2.018 -11.904 -2.087 1.00 0.00 N ATOM 838 CA GLY A 417 1.568 -12.461 -0.825 1.00 0.00 C ATOM 839 C GLY A 417 0.661 -13.661 -1.014 1.00 0.00 C ATOM 840 O GLY A 417 0.155 -13.899 -2.110 1.00 0.00 O ATOM 0 H GLY A 417 1.536 -12.264 -2.911 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.434 -12.753 -0.231 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.038 -11.694 -0.261 1.00 0.00 H new ATOM 844 N ARG A 418 0.454 -14.420 0.059 1.00 0.00 N ATOM 845 CA ARG A 418 -0.399 -15.600 0.005 1.00 0.00 C ATOM 846 C ARG A 418 -1.837 -15.213 -0.321 1.00 0.00 C ATOM 847 O ARG A 418 -2.562 -15.965 -0.971 1.00 0.00 O ATOM 848 CB ARG A 418 -0.349 -16.354 1.336 1.00 0.00 C ATOM 849 CG ARG A 418 0.933 -17.144 1.538 1.00 0.00 C ATOM 850 CD ARG A 418 0.805 -18.126 2.691 1.00 0.00 C ATOM 851 NE ARG A 418 0.377 -19.448 2.241 1.00 0.00 N ATOM 852 CZ ARG A 418 0.513 -20.558 2.964 1.00 0.00 C ATOM 853 NH1 ARG A 418 1.063 -20.506 4.171 1.00 0.00 N ATOM 854 NH2 ARG A 418 0.099 -21.720 2.480 1.00 0.00 N ATOM 0 H ARG A 418 0.865 -14.238 0.974 1.00 0.00 H new ATOM 0 HA ARG A 418 -0.028 -16.252 -0.786 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.459 -15.641 2.153 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -1.198 -17.035 1.391 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.177 -17.685 0.623 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.758 -16.458 1.732 1.00 0.00 H new ATOM 0 HD2 ARG A 418 1.764 -18.210 3.203 1.00 0.00 H new ATOM 0 HD3 ARG A 418 0.089 -17.741 3.417 1.00 0.00 H new ATOM 0 HE ARG A 418 -0.051 -19.526 1.319 1.00 0.00 H new ATOM 0 HH11 ARG A 418 1.383 -19.614 4.548 1.00 0.00 H new ATOM 0 HH12 ARG A 418 1.165 -21.358 4.722 1.00 0.00 H new ATOM 0 HH21 ARG A 418 -0.324 -21.765 1.553 1.00 0.00 H new ATOM 0 HH22 ARG A 418 0.204 -22.570 3.034 1.00 0.00 H new ATOM 866 N ASN A 419 -2.240 -14.032 0.135 1.00 0.00 N ATOM 867 CA ASN A 419 -3.590 -13.539 -0.109 1.00 0.00 C ATOM 868 C ASN A 419 -3.619 -12.015 -0.100 1.00 0.00 C ATOM 869 O ASN A 419 -2.578 -11.365 0.009 1.00 0.00 O ATOM 870 CB ASN A 419 -4.557 -14.090 0.941 1.00 0.00 C ATOM 871 CG ASN A 419 -4.182 -13.673 2.350 1.00 0.00 C ATOM 872 OD1 ASN A 419 -3.560 -12.633 2.558 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.562 -14.488 3.328 1.00 0.00 N ATOM 0 H ASN A 419 -1.651 -13.399 0.676 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.905 -13.884 -1.094 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.566 -13.743 0.719 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.574 -15.178 0.880 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -4.339 -14.261 4.297 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -5.077 -15.341 3.110 1.00 0.00 H new ATOM 880 N ILE A 420 -4.815 -11.448 -0.217 1.00 0.00 N ATOM 881 CA ILE A 420 -4.977 -10.000 -0.222 1.00 0.00 C ATOM 882 C ILE A 420 -4.460 -9.381 1.072 1.00 0.00 C ATOM 883 O ILE A 420 -3.992 -8.243 1.083 1.00 0.00 O ATOM 884 CB ILE A 420 -6.450 -9.604 -0.421 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.041 -10.372 -1.610 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.565 -8.097 -0.619 1.00 0.00 C ATOM 887 CD1 ILE A 420 -8.140 -9.633 -2.343 1.00 0.00 C ATOM 0 H ILE A 420 -5.686 -11.970 -0.310 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.390 -9.618 -1.058 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.020 -9.869 0.469 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -6.241 -10.601 -2.314 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -7.434 -11.324 -1.254 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -7.612 -7.827 -0.759 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.172 -7.584 0.259 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -5.993 -7.801 -1.499 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.502 -10.246 -3.169 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -8.961 -9.427 -1.656 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -7.749 -8.693 -2.733 1.00 0.00 H new ATOM 899 N LYS A 421 -4.549 -10.137 2.161 1.00 0.00 N ATOM 900 CA LYS A 421 -4.090 -9.661 3.462 1.00 0.00 C ATOM 901 C LYS A 421 -2.570 -9.575 3.505 1.00 0.00 C ATOM 902 O LYS A 421 -2.003 -8.528 3.820 1.00 0.00 O ATOM 903 CB LYS A 421 -4.593 -10.583 4.574 1.00 0.00 C ATOM 904 CG LYS A 421 -4.225 -10.107 5.971 1.00 0.00 C ATOM 905 CD LYS A 421 -3.315 -11.097 6.680 1.00 0.00 C ATOM 906 CE LYS A 421 -2.867 -10.572 8.034 1.00 0.00 C ATOM 907 NZ LYS A 421 -1.794 -11.418 8.629 1.00 0.00 N ATOM 0 H LYS A 421 -4.934 -11.081 2.169 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.496 -8.662 3.618 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.677 -10.668 4.502 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.184 -11.582 4.420 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -3.729 -9.138 5.907 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.133 -9.962 6.557 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -3.838 -12.044 6.811 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -2.442 -11.298 6.060 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -2.505 -9.549 7.926 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -3.720 -10.538 8.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -1.515 -11.027 9.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -2.147 -12.388 8.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -0.970 -11.430 7.995 1.00 0.00 H new ATOM 921 N ILE A 422 -1.916 -10.684 3.187 1.00 0.00 N ATOM 922 CA ILE A 422 -0.459 -10.741 3.187 1.00 0.00 C ATOM 923 C ILE A 422 0.119 -9.866 2.083 1.00 0.00 C ATOM 924 O ILE A 422 0.937 -8.981 2.338 1.00 0.00 O ATOM 925 CB ILE A 422 0.048 -12.191 3.015 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.243 -13.007 4.276 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.540 -12.213 2.701 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.680 -13.467 4.381 1.00 0.00 C ATOM 0 H ILE A 422 -2.372 -11.558 2.925 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.122 -10.366 4.153 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.482 -12.640 2.175 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.411 -13.879 4.294 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.003 -12.407 5.152 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.872 -13.245 2.585 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.725 -11.666 1.777 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.090 -11.744 3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.813 -14.039 5.299 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.340 -12.599 4.396 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.925 -14.094 3.524 1.00 0.00 H new ATOM 940 N ALA A 423 -0.310 -10.123 0.856 1.00 0.00 N ATOM 941 CA ALA A 423 0.162 -9.366 -0.297 1.00 0.00 C ATOM 942 C ALA A 423 0.003 -7.867 -0.073 1.00 0.00 C ATOM 943 O ALA A 423 0.856 -7.074 -0.472 1.00 0.00 O ATOM 944 CB ALA A 423 -0.580 -9.795 -1.552 1.00 0.00 C ATOM 0 H ALA A 423 -0.987 -10.853 0.632 1.00 0.00 H new ATOM 0 HA ALA A 423 1.223 -9.577 -0.427 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.216 -9.221 -2.404 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.409 -10.857 -1.731 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.647 -9.616 -1.423 1.00 0.00 H new ATOM 950 N GLY A 424 -1.093 -7.486 0.570 1.00 0.00 N ATOM 951 CA GLY A 424 -1.344 -6.085 0.841 1.00 0.00 C ATOM 952 C GLY A 424 -0.344 -5.502 1.818 1.00 0.00 C ATOM 953 O GLY A 424 0.165 -4.400 1.615 1.00 0.00 O ATOM 0 H GLY A 424 -1.813 -8.124 0.909 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.306 -5.524 -0.093 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.351 -5.969 1.242 1.00 0.00 H new ATOM 957 N ILE A 425 -0.058 -6.247 2.881 1.00 0.00 N ATOM 958 CA ILE A 425 0.892 -5.804 3.890 1.00 0.00 C ATOM 959 C ILE A 425 2.299 -5.727 3.307 1.00 0.00 C ATOM 960 O ILE A 425 3.094 -4.867 3.686 1.00 0.00 O ATOM 961 CB ILE A 425 0.895 -6.748 5.110 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.499 -6.806 5.736 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.923 -6.297 6.137 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.751 -8.065 6.538 1.00 0.00 C ATOM 0 H ILE A 425 -0.472 -7.161 3.064 1.00 0.00 H new ATOM 0 HA ILE A 425 0.581 -4.812 4.216 1.00 0.00 H new ATOM 0 HB ILE A 425 1.168 -7.748 4.773 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.634 -5.940 6.384 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.246 -6.733 4.946 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.908 -6.977 6.989 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.915 -6.303 5.685 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.683 -5.288 6.473 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.759 -8.037 6.952 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.649 -8.936 5.890 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.027 -8.130 7.350 1.00 0.00 H new ATOM 976 N ARG A 426 2.596 -6.630 2.378 1.00 0.00 N ATOM 977 CA ARG A 426 3.905 -6.661 1.738 1.00 0.00 C ATOM 978 C ARG A 426 4.067 -5.475 0.795 1.00 0.00 C ATOM 979 O ARG A 426 5.069 -4.762 0.843 1.00 0.00 O ATOM 980 CB ARG A 426 4.095 -7.971 0.971 1.00 0.00 C ATOM 981 CG ARG A 426 5.548 -8.285 0.654 1.00 0.00 C ATOM 982 CD ARG A 426 5.729 -8.690 -0.800 1.00 0.00 C ATOM 983 NE ARG A 426 6.950 -8.132 -1.375 1.00 0.00 N ATOM 984 CZ ARG A 426 8.164 -8.638 -1.172 1.00 0.00 C ATOM 985 NH1 ARG A 426 8.325 -9.712 -0.410 1.00 0.00 N ATOM 986 NH2 ARG A 426 9.222 -8.067 -1.734 1.00 0.00 N ATOM 0 H ARG A 426 1.949 -7.348 2.053 1.00 0.00 H new ATOM 0 HA ARG A 426 4.667 -6.596 2.515 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.674 -8.789 1.556 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.531 -7.922 0.040 1.00 0.00 H new ATOM 0 HG2 ARG A 426 6.165 -7.412 0.869 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.897 -9.089 1.302 1.00 0.00 H new ATOM 0 HD2 ARG A 426 5.758 -9.777 -0.873 1.00 0.00 H new ATOM 0 HD3 ARG A 426 4.869 -8.355 -1.380 1.00 0.00 H new ATOM 0 HE ARG A 426 6.867 -7.306 -1.967 1.00 0.00 H new ATOM 0 HH11 ARG A 426 7.515 -10.155 0.024 1.00 0.00 H new ATOM 0 HH12 ARG A 426 9.258 -10.095 -0.259 1.00 0.00 H new ATOM 0 HH21 ARG A 426 9.104 -7.241 -2.321 1.00 0.00 H new ATOM 0 HH22 ARG A 426 10.153 -8.454 -1.579 1.00 0.00 H new ATOM 998 N ALA A 427 3.069 -5.268 -0.053 1.00 0.00 N ATOM 999 CA ALA A 427 3.093 -4.161 -1.001 1.00 0.00 C ATOM 1000 C ALA A 427 3.081 -2.831 -0.263 1.00 0.00 C ATOM 1001 O ALA A 427 3.825 -1.909 -0.600 1.00 0.00 O ATOM 1002 CB ALA A 427 1.911 -4.253 -1.955 1.00 0.00 C ATOM 0 H ALA A 427 2.233 -5.851 -0.105 1.00 0.00 H new ATOM 0 HA ALA A 427 4.012 -4.223 -1.584 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.944 -3.419 -2.656 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.960 -5.192 -2.506 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.981 -4.213 -1.387 1.00 0.00 H new ATOM 1008 N ALA A 428 2.237 -2.746 0.759 1.00 0.00 N ATOM 1009 CA ALA A 428 2.130 -1.537 1.564 1.00 0.00 C ATOM 1010 C ALA A 428 3.443 -1.256 2.279 1.00 0.00 C ATOM 1011 O ALA A 428 3.864 -0.106 2.404 1.00 0.00 O ATOM 1012 CB ALA A 428 0.996 -1.669 2.569 1.00 0.00 C ATOM 0 H ALA A 428 1.616 -3.502 1.049 1.00 0.00 H new ATOM 0 HA ALA A 428 1.911 -0.699 0.902 1.00 0.00 H new ATOM 0 HB1 ALA A 428 0.929 -0.758 3.163 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.057 -1.827 2.039 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.189 -2.517 3.226 1.00 0.00 H new ATOM 1018 N GLU A 429 4.091 -2.321 2.739 1.00 0.00 N ATOM 1019 CA GLU A 429 5.365 -2.193 3.433 1.00 0.00 C ATOM 1020 C GLU A 429 6.431 -1.678 2.479 1.00 0.00 C ATOM 1021 O GLU A 429 7.284 -0.874 2.857 1.00 0.00 O ATOM 1022 CB GLU A 429 5.788 -3.538 4.025 1.00 0.00 C ATOM 1023 CG GLU A 429 5.325 -3.736 5.458 1.00 0.00 C ATOM 1024 CD GLU A 429 5.794 -5.052 6.046 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.135 -6.084 5.793 1.00 0.00 O ATOM 1026 OE2 GLU A 429 6.819 -5.053 6.758 1.00 0.00 O ATOM 0 H GLU A 429 3.755 -3.279 2.644 1.00 0.00 H new ATOM 0 HA GLU A 429 5.248 -1.478 4.248 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.387 -4.341 3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.874 -3.618 3.987 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.696 -2.915 6.072 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.236 -3.694 5.493 1.00 0.00 H new ATOM 1033 N ASN A 430 6.364 -2.132 1.233 1.00 0.00 N ATOM 1034 CA ASN A 430 7.312 -1.704 0.214 1.00 0.00 C ATOM 1035 C ASN A 430 7.164 -0.207 -0.033 1.00 0.00 C ATOM 1036 O ASN A 430 8.136 0.486 -0.333 1.00 0.00 O ATOM 1037 CB ASN A 430 7.085 -2.480 -1.086 1.00 0.00 C ATOM 1038 CG ASN A 430 8.251 -3.389 -1.426 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.538 -4.346 -0.707 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.931 -3.093 -2.528 1.00 0.00 N ATOM 0 H ASN A 430 5.663 -2.796 0.905 1.00 0.00 H new ATOM 0 HA ASN A 430 8.323 -1.908 0.565 1.00 0.00 H new ATOM 0 HB2 ASN A 430 6.177 -3.076 -0.997 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.926 -1.777 -1.903 1.00 0.00 H new ATOM 0 HD21 ASN A 430 9.725 -3.669 -2.807 1.00 0.00 H new ATOM 0 HD22 ASN A 430 8.659 -2.290 -3.095 1.00 0.00 H new ATOM 1047 N ALA A 431 5.935 0.283 0.106 1.00 0.00 N ATOM 1048 CA ALA A 431 5.648 1.697 -0.089 1.00 0.00 C ATOM 1049 C ALA A 431 6.201 2.524 1.066 1.00 0.00 C ATOM 1050 O ALA A 431 6.637 3.660 0.878 1.00 0.00 O ATOM 1051 CB ALA A 431 4.147 1.914 -0.230 1.00 0.00 C ATOM 0 H ALA A 431 5.122 -0.281 0.353 1.00 0.00 H new ATOM 0 HA ALA A 431 6.137 2.026 -1.006 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.945 2.975 -0.375 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.777 1.353 -1.089 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.643 1.569 0.673 1.00 0.00 H new ATOM 1057 N LEU A 432 6.185 1.941 2.262 1.00 0.00 N ATOM 1058 CA LEU A 432 6.690 2.620 3.451 1.00 0.00 C ATOM 1059 C LEU A 432 8.209 2.499 3.549 1.00 0.00 C ATOM 1060 O LEU A 432 8.855 3.254 4.277 1.00 0.00 O ATOM 1061 CB LEU A 432 6.041 2.037 4.708 1.00 0.00 C ATOM 1062 CG LEU A 432 4.520 2.189 4.782 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.892 0.967 5.432 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.150 3.452 5.544 1.00 0.00 C ATOM 0 H LEU A 432 5.828 1.001 2.433 1.00 0.00 H new ATOM 0 HA LEU A 432 6.434 3.676 3.370 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.288 0.977 4.768 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.482 2.517 5.582 1.00 0.00 H new ATOM 0 HG LEU A 432 4.131 2.273 3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.810 1.094 5.476 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.130 0.080 4.845 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.285 0.850 6.442 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.065 3.546 5.588 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.551 3.397 6.556 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.569 4.320 5.035 1.00 0.00 H new ATOM 1076 N ARG A 433 8.778 1.544 2.815 1.00 0.00 N ATOM 1077 CA ARG A 433 10.220 1.324 2.825 1.00 0.00 C ATOM 1078 C ARG A 433 10.976 2.601 2.474 1.00 0.00 C ATOM 1079 O ARG A 433 11.885 3.015 3.195 1.00 0.00 O ATOM 1080 CB ARG A 433 10.594 0.213 1.843 1.00 0.00 C ATOM 1081 CG ARG A 433 10.497 -1.184 2.437 1.00 0.00 C ATOM 1082 CD ARG A 433 11.000 -2.238 1.465 1.00 0.00 C ATOM 1083 NE ARG A 433 11.414 -3.461 2.150 1.00 0.00 N ATOM 1084 CZ ARG A 433 10.565 -4.387 2.589 1.00 0.00 C ATOM 1085 NH1 ARG A 433 9.259 -4.236 2.418 1.00 0.00 N ATOM 1086 NH2 ARG A 433 11.026 -5.470 3.202 1.00 0.00 N ATOM 0 H ARG A 433 8.260 0.911 2.206 1.00 0.00 H new ATOM 0 HA ARG A 433 10.505 1.024 3.833 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.941 0.274 0.972 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.612 0.379 1.491 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.078 -1.230 3.358 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.461 -1.397 2.702 1.00 0.00 H new ATOM 0 HD2 ARG A 433 10.215 -2.473 0.747 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.841 -1.837 0.899 1.00 0.00 H new ATOM 0 HE ARG A 433 12.411 -3.614 2.300 1.00 0.00 H new ATOM 0 HH11 ARG A 433 8.899 -3.406 1.947 1.00 0.00 H new ATOM 0 HH12 ARG A 433 8.614 -4.950 2.757 1.00 0.00 H new ATOM 0 HH21 ARG A 433 12.030 -5.592 3.336 1.00 0.00 H new ATOM 0 HH22 ARG A 433 10.377 -6.181 3.539 1.00 0.00 H new ATOM 1098 N ASP A 434 10.595 3.217 1.364 1.00 0.00 N ATOM 1099 CA ASP A 434 11.236 4.447 0.913 1.00 0.00 C ATOM 1100 C ASP A 434 11.094 5.550 1.957 1.00 0.00 C ATOM 1101 O ASP A 434 10.162 6.352 1.907 1.00 0.00 O ATOM 1102 CB ASP A 434 10.636 4.904 -0.417 1.00 0.00 C ATOM 1103 CG ASP A 434 11.390 4.353 -1.611 1.00 0.00 C ATOM 1104 OD1 ASP A 434 11.215 3.158 -1.924 1.00 0.00 O ATOM 1105 OD2 ASP A 434 12.158 5.119 -2.233 1.00 0.00 O ATOM 0 H ASP A 434 9.845 2.886 0.758 1.00 0.00 H new ATOM 0 HA ASP A 434 12.297 4.242 0.771 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.595 4.587 -0.471 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.640 5.993 -0.459 1.00 0.00 H new ATOM 1110 N LYS A 435 12.027 5.581 2.902 1.00 0.00 N ATOM 1111 CA LYS A 435 12.016 6.582 3.964 1.00 0.00 C ATOM 1112 C LYS A 435 12.135 7.993 3.394 1.00 0.00 C ATOM 1113 O LYS A 435 11.779 8.970 4.053 1.00 0.00 O ATOM 1114 CB LYS A 435 13.156 6.323 4.951 1.00 0.00 C ATOM 1115 CG LYS A 435 12.978 7.031 6.283 1.00 0.00 C ATOM 1116 CD LYS A 435 14.314 7.280 6.965 1.00 0.00 C ATOM 1117 CE LYS A 435 14.147 7.477 8.463 1.00 0.00 C ATOM 1118 NZ LYS A 435 15.120 6.661 9.242 1.00 0.00 N ATOM 0 H LYS A 435 12.804 4.922 2.955 1.00 0.00 H new ATOM 0 HA LYS A 435 11.063 6.503 4.487 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.237 5.250 5.127 1.00 0.00 H new ATOM 0 HB3 LYS A 435 14.095 6.644 4.501 1.00 0.00 H new ATOM 0 HG2 LYS A 435 12.466 7.980 6.126 1.00 0.00 H new ATOM 0 HG3 LYS A 435 12.343 6.430 6.934 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.981 6.438 6.780 1.00 0.00 H new ATOM 0 HD3 LYS A 435 14.786 8.162 6.531 1.00 0.00 H new ATOM 0 HE2 LYS A 435 14.279 8.531 8.708 1.00 0.00 H new ATOM 0 HE3 LYS A 435 13.132 7.207 8.754 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 14.974 6.823 10.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 14.978 5.653 9.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 16.089 6.936 8.984 1.00 0.00 H new ATOM 1132 N LYS A 436 12.629 8.094 2.164 1.00 0.00 N ATOM 1133 CA LYS A 436 12.780 9.386 1.508 1.00 0.00 C ATOM 1134 C LYS A 436 11.450 9.829 0.927 1.00 0.00 C ATOM 1135 O LYS A 436 10.995 10.950 1.158 1.00 0.00 O ATOM 1136 CB LYS A 436 13.835 9.309 0.403 1.00 0.00 C ATOM 1137 CG LYS A 436 15.227 8.973 0.912 1.00 0.00 C ATOM 1138 CD LYS A 436 15.442 7.471 1.001 1.00 0.00 C ATOM 1139 CE LYS A 436 15.643 6.853 -0.373 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.069 6.502 -0.621 1.00 0.00 N ATOM 0 H LYS A 436 12.931 7.297 1.603 1.00 0.00 H new ATOM 0 HA LYS A 436 13.108 10.115 2.248 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.532 8.556 -0.325 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.870 10.264 -0.121 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.973 9.409 0.248 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.374 9.421 1.895 1.00 0.00 H new ATOM 0 HD2 LYS A 436 16.311 7.264 1.625 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.583 7.008 1.487 1.00 0.00 H new ATOM 0 HE2 LYS A 436 15.028 5.957 -0.462 1.00 0.00 H new ATOM 0 HE3 LYS A 436 15.302 7.551 -1.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 17.164 6.083 -1.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.653 7.360 -0.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 17.387 5.817 0.094 1.00 0.00 H new ATOM 1154 N MET A 437 10.824 8.927 0.187 1.00 0.00 N ATOM 1155 CA MET A 437 9.531 9.200 -0.416 1.00 0.00 C ATOM 1156 C MET A 437 8.475 9.366 0.669 1.00 0.00 C ATOM 1157 O MET A 437 7.478 10.063 0.480 1.00 0.00 O ATOM 1158 CB MET A 437 9.139 8.065 -1.365 1.00 0.00 C ATOM 1159 CG MET A 437 7.784 8.259 -2.023 1.00 0.00 C ATOM 1160 SD MET A 437 7.907 9.009 -3.658 1.00 0.00 S ATOM 1161 CE MET A 437 7.428 7.633 -4.700 1.00 0.00 C ATOM 0 H MET A 437 11.193 7.997 -0.010 1.00 0.00 H new ATOM 0 HA MET A 437 9.598 10.125 -0.988 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.900 7.973 -2.140 1.00 0.00 H new ATOM 0 HB3 MET A 437 9.133 7.126 -0.811 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.284 7.294 -2.107 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.161 8.887 -1.385 1.00 0.00 H new ATOM 0 HE1 MET A 437 8.172 7.494 -5.484 1.00 0.00 H new ATOM 0 HE2 MET A 437 7.361 6.727 -4.098 1.00 0.00 H new ATOM 0 HE3 MET A 437 6.458 7.840 -5.153 1.00 0.00 H new ATOM 1171 N LEU A 438 8.708 8.729 1.815 1.00 0.00 N ATOM 1172 CA LEU A 438 7.778 8.816 2.935 1.00 0.00 C ATOM 1173 C LEU A 438 7.951 10.139 3.669 1.00 0.00 C ATOM 1174 O LEU A 438 6.984 10.722 4.157 1.00 0.00 O ATOM 1175 CB LEU A 438 7.989 7.646 3.900 1.00 0.00 C ATOM 1176 CG LEU A 438 6.716 6.892 4.287 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.742 7.820 4.997 1.00 0.00 C ATOM 1178 CD2 LEU A 438 6.067 6.278 3.055 1.00 0.00 C ATOM 0 H LEU A 438 9.529 8.150 1.990 1.00 0.00 H new ATOM 0 HA LEU A 438 6.763 8.765 2.542 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.687 6.942 3.447 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.460 8.023 4.808 1.00 0.00 H new ATOM 0 HG LEU A 438 6.985 6.088 4.972 1.00 0.00 H new ATOM 0 HD11 LEU A 438 4.842 7.267 5.265 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.208 8.214 5.900 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.477 8.645 4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 438 5.162 5.745 3.348 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.811 7.067 2.348 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.763 5.582 2.586 1.00 0.00 H new ATOM 1190 N ASP A 439 9.190 10.614 3.734 1.00 0.00 N ATOM 1191 CA ASP A 439 9.490 11.875 4.400 1.00 0.00 C ATOM 1192 C ASP A 439 8.896 13.042 3.619 1.00 0.00 C ATOM 1193 O ASP A 439 8.461 14.036 4.200 1.00 0.00 O ATOM 1194 CB ASP A 439 11.002 12.056 4.546 1.00 0.00 C ATOM 1195 CG ASP A 439 11.361 13.271 5.379 1.00 0.00 C ATOM 1196 OD1 ASP A 439 11.385 14.388 4.821 1.00 0.00 O ATOM 1197 OD2 ASP A 439 11.617 13.105 6.591 1.00 0.00 O ATOM 0 H ASP A 439 10.002 10.145 3.334 1.00 0.00 H new ATOM 0 HA ASP A 439 9.043 11.854 5.394 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.429 11.165 5.006 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.451 12.151 3.557 1.00 0.00 H new ATOM 1202 N PHE A 440 8.876 12.908 2.298 1.00 0.00 N ATOM 1203 CA PHE A 440 8.331 13.945 1.431 1.00 0.00 C ATOM 1204 C PHE A 440 6.824 14.073 1.626 1.00 0.00 C ATOM 1205 O PHE A 440 6.283 15.178 1.657 1.00 0.00 O ATOM 1206 CB PHE A 440 8.639 13.628 -0.031 1.00 0.00 C ATOM 1207 CG PHE A 440 8.537 14.820 -0.939 1.00 0.00 C ATOM 1208 CD1 PHE A 440 9.229 15.985 -0.654 1.00 0.00 C ATOM 1209 CD2 PHE A 440 7.748 14.774 -2.078 1.00 0.00 C ATOM 1210 CE1 PHE A 440 9.137 17.084 -1.488 1.00 0.00 C ATOM 1211 CE2 PHE A 440 7.652 15.869 -2.915 1.00 0.00 C ATOM 1212 CZ PHE A 440 8.347 17.025 -2.620 1.00 0.00 C ATOM 0 H PHE A 440 9.232 12.090 1.804 1.00 0.00 H new ATOM 0 HA PHE A 440 8.799 14.893 1.697 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.645 13.214 -0.100 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.952 12.857 -0.379 1.00 0.00 H new ATOM 0 HD1 PHE A 440 9.848 16.036 0.230 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.202 13.872 -2.314 1.00 0.00 H new ATOM 0 HE1 PHE A 440 9.682 17.987 -1.255 1.00 0.00 H new ATOM 0 HE2 PHE A 440 7.034 15.821 -3.799 1.00 0.00 H new ATOM 0 HZ PHE A 440 8.273 17.882 -3.273 1.00 0.00 H new ATOM 1222 N TYR A 441 6.153 12.933 1.765 1.00 0.00 N ATOM 1223 CA TYR A 441 4.713 12.916 1.967 1.00 0.00 C ATOM 1224 C TYR A 441 4.387 13.170 3.426 1.00 0.00 C ATOM 1225 O TYR A 441 3.499 13.955 3.747 1.00 0.00 O ATOM 1226 CB TYR A 441 4.126 11.578 1.525 1.00 0.00 C ATOM 1227 CG TYR A 441 3.770 11.523 0.058 1.00 0.00 C ATOM 1228 CD1 TYR A 441 2.527 11.951 -0.390 1.00 0.00 C ATOM 1229 CD2 TYR A 441 4.676 11.042 -0.878 1.00 0.00 C ATOM 1230 CE1 TYR A 441 2.197 11.902 -1.732 1.00 0.00 C ATOM 1231 CE2 TYR A 441 4.356 10.989 -2.220 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.115 11.420 -2.642 1.00 0.00 C ATOM 1233 OH TYR A 441 2.792 11.370 -3.979 1.00 0.00 O ATOM 0 H TYR A 441 6.586 12.010 1.741 1.00 0.00 H new ATOM 0 HA TYR A 441 4.270 13.707 1.362 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.843 10.787 1.745 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.232 11.372 2.114 1.00 0.00 H new ATOM 0 HD1 TYR A 441 1.807 12.328 0.321 1.00 0.00 H new ATOM 0 HD2 TYR A 441 5.648 10.703 -0.550 1.00 0.00 H new ATOM 0 HE1 TYR A 441 1.227 12.239 -2.066 1.00 0.00 H new ATOM 0 HE2 TYR A 441 5.073 10.613 -2.935 1.00 0.00 H new ATOM 0 HH TYR A 441 3.548 11.006 -4.485 1.00 0.00 H new ATOM 1243 N ALA A 442 5.121 12.509 4.309 1.00 0.00 N ATOM 1244 CA ALA A 442 4.913 12.678 5.737 1.00 0.00 C ATOM 1245 C ALA A 442 5.067 14.143 6.128 1.00 0.00 C ATOM 1246 O ALA A 442 4.447 14.611 7.083 1.00 0.00 O ATOM 1247 CB ALA A 442 5.880 11.806 6.525 1.00 0.00 C ATOM 0 H ALA A 442 5.863 11.854 4.062 1.00 0.00 H new ATOM 0 HA ALA A 442 3.897 12.364 5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.709 11.946 7.592 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.720 10.759 6.266 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.905 12.087 6.282 1.00 0.00 H new ATOM 1253 N LYS A 443 5.886 14.868 5.370 1.00 0.00 N ATOM 1254 CA LYS A 443 6.104 16.287 5.625 1.00 0.00 C ATOM 1255 C LYS A 443 5.010 17.126 4.966 1.00 0.00 C ATOM 1256 O LYS A 443 4.968 18.345 5.126 1.00 0.00 O ATOM 1257 CB LYS A 443 7.478 16.717 5.109 1.00 0.00 C ATOM 1258 CG LYS A 443 8.603 16.477 6.103 1.00 0.00 C ATOM 1259 CD LYS A 443 8.746 17.637 7.076 1.00 0.00 C ATOM 1260 CE LYS A 443 8.911 17.149 8.506 1.00 0.00 C ATOM 1261 NZ LYS A 443 10.342 16.912 8.850 1.00 0.00 N ATOM 0 H LYS A 443 6.408 14.496 4.576 1.00 0.00 H new ATOM 0 HA LYS A 443 6.066 16.450 6.702 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.697 16.177 4.188 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.447 17.777 4.857 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.410 15.558 6.657 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.540 16.334 5.565 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.607 18.244 6.796 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.868 18.280 7.009 1.00 0.00 H new ATOM 0 HE2 LYS A 443 8.490 17.884 9.192 1.00 0.00 H new ATOM 0 HE3 LYS A 443 8.347 16.226 8.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 10.412 16.580 9.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 10.738 16.192 8.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 10.876 17.798 8.745 1.00 0.00 H new ATOM 1275 N GLN A 444 4.123 16.460 4.228 1.00 0.00 N ATOM 1276 CA GLN A 444 3.025 17.132 3.552 1.00 0.00 C ATOM 1277 C GLN A 444 1.696 16.718 4.166 1.00 0.00 C ATOM 1278 O GLN A 444 0.867 17.561 4.506 1.00 0.00 O ATOM 1279 CB GLN A 444 3.037 16.808 2.057 1.00 0.00 C ATOM 1280 CG GLN A 444 4.303 17.258 1.344 1.00 0.00 C ATOM 1281 CD GLN A 444 4.124 18.575 0.616 1.00 0.00 C ATOM 1282 OE1 GLN A 444 4.156 18.627 -0.613 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.934 19.650 1.373 1.00 0.00 N ATOM 0 H GLN A 444 4.148 15.450 4.085 1.00 0.00 H new ATOM 0 HA GLN A 444 3.151 18.208 3.676 1.00 0.00 H new ATOM 0 HB2 GLN A 444 2.920 15.732 1.926 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.177 17.282 1.585 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.110 17.355 2.070 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.606 16.491 0.631 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.915 19.561 2.389 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.808 20.564 0.938 1.00 0.00 H new ATOM 1292 N ARG A 445 1.505 15.413 4.316 1.00 0.00 N ATOM 1293 CA ARG A 445 0.279 14.885 4.902 1.00 0.00 C ATOM 1294 C ARG A 445 0.177 15.276 6.370 1.00 0.00 C ATOM 1295 O ARG A 445 -0.873 15.719 6.836 1.00 0.00 O ATOM 1296 CB ARG A 445 0.232 13.362 4.762 1.00 0.00 C ATOM 1297 CG ARG A 445 -1.178 12.795 4.768 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.240 11.456 5.486 1.00 0.00 C ATOM 1299 NE ARG A 445 -2.317 11.413 6.472 1.00 0.00 N ATOM 1300 CZ ARG A 445 -2.327 12.132 7.592 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -1.321 12.951 7.872 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -3.346 12.034 8.434 1.00 0.00 N ATOM 0 H ARG A 445 2.182 14.702 4.040 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.568 15.314 4.366 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.726 13.075 3.834 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.799 12.913 5.577 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.852 13.500 5.254 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -1.527 12.675 3.742 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.385 10.660 4.756 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -0.288 11.266 5.981 1.00 0.00 H new ATOM 0 HE ARG A 445 -3.108 10.795 6.291 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -0.535 13.032 7.227 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -1.334 13.500 8.732 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -4.123 11.407 8.224 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -3.353 12.585 9.292 1.00 0.00 H new ATOM 1314 N ALA A 446 1.277 15.112 7.090 1.00 0.00 N ATOM 1315 CA ALA A 446 1.325 15.452 8.507 1.00 0.00 C ATOM 1316 C ALA A 446 1.412 16.962 8.699 1.00 0.00 C ATOM 1317 O ALA A 446 0.986 17.493 9.724 1.00 0.00 O ATOM 1318 CB ALA A 446 2.506 14.764 9.174 1.00 0.00 C ATOM 0 H ALA A 446 2.152 14.744 6.716 1.00 0.00 H new ATOM 0 HA ALA A 446 0.405 15.102 8.975 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.530 15.026 10.232 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.404 13.684 9.070 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.432 15.088 8.699 1.00 0.00 H new