USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=17 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 419 ASN : amide:sc= -4.98! C(o=-5.4!,f=-10!) USER MOD Set 1.2: A 421 LYS NZ :NH3+ -110:sc= -0.449 (180deg=-0.0539) USER MOD Set 2.1: A 387 TYR OH : rot 50:sc= -3.96! USER MOD Set 2.2: A 404 CYS SG : rot -99:sc= -6.77! USER MOD Single : A 369 ASN :FLIP amide:sc= -0.469 F(o=-1.6,f=-0.47) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -1.42 F(o=-3.7!,f=-1.4) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot -24:sc= 0.338 USER MOD Single : A 380 TYR OH : rot -134:sc= 1.03 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -0.0309 X(o=-0.031,f=-0.031) USER MOD Single : A 389 THR OG1 : rot 2:sc= 0.917 USER MOD Single : A 399 ASN :FLIP amide:sc= -0.179 F(o=-1,f=-0.18) USER MOD Single : A 400 SER OG : rot -170:sc= 0 USER MOD Single : A 410 THR OG1 : rot 31:sc= 0.114 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.1 USER MOD Single : A 430 ASN : amide:sc= 0 X(o=0,f=0.0016) USER MOD Single : A 435 LYS NZ :NH3+ 153:sc= -0.203 (180deg=-1.29!) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 437 MET CE :methyl 172:sc= 0 (180deg=-0.0663) USER MOD Single : A 441 TYR OH : rot 30:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.22 X(o=-0.22,f=-0.22) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.361 -2.405 9.130 1.00 0.00 N ATOM 103 CA ASN A 369 -2.308 -1.578 9.707 1.00 0.00 C ATOM 104 C ASN A 369 -1.346 -1.050 8.642 1.00 0.00 C ATOM 105 O ASN A 369 -0.701 -0.020 8.839 1.00 0.00 O ATOM 106 CB ASN A 369 -1.537 -2.368 10.768 1.00 0.00 C ATOM 107 CG ASN A 369 -0.662 -3.450 10.165 1.00 0.00 C ATOM 108 OD1 ASN A 369 0.459 -3.044 9.581 1.00 0.00 O flip ATOM 109 ND2 ASN A 369 -0.989 -4.636 10.225 1.00 0.00 N flip ATOM 0 HA ASN A 369 -2.787 -0.717 10.173 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.916 -1.684 11.346 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.243 -2.822 11.463 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -1.860 -4.902 10.684 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -0.389 -5.352 9.816 1.00 0.00 H new ATOM 116 N ALA A 370 -1.240 -1.756 7.523 1.00 0.00 N ATOM 117 CA ALA A 370 -0.343 -1.340 6.450 1.00 0.00 C ATOM 118 C ALA A 370 -0.978 -0.255 5.591 1.00 0.00 C ATOM 119 O ALA A 370 -0.294 0.656 5.122 1.00 0.00 O ATOM 120 CB ALA A 370 0.058 -2.535 5.597 1.00 0.00 C ATOM 0 H ALA A 370 -1.760 -2.613 7.335 1.00 0.00 H new ATOM 0 HA ALA A 370 0.555 -0.922 6.905 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.727 -2.206 4.802 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.568 -3.271 6.219 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.833 -2.985 5.159 1.00 0.00 H new ATOM 126 N LYS A 371 -2.288 -0.347 5.393 1.00 0.00 N ATOM 127 CA LYS A 371 -3.004 0.640 4.595 1.00 0.00 C ATOM 128 C LYS A 371 -3.242 1.906 5.407 1.00 0.00 C ATOM 129 O LYS A 371 -3.241 3.011 4.865 1.00 0.00 O ATOM 130 CB LYS A 371 -4.336 0.072 4.098 1.00 0.00 C ATOM 131 CG LYS A 371 -4.338 -0.268 2.616 1.00 0.00 C ATOM 132 CD LYS A 371 -5.754 -0.351 2.064 1.00 0.00 C ATOM 133 CE LYS A 371 -5.975 -1.642 1.291 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.422 -1.975 1.173 1.00 0.00 N ATOM 0 H LYS A 371 -2.873 -1.091 5.772 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.391 0.889 3.729 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.574 -0.826 4.668 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.127 0.795 4.297 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -3.776 0.488 2.068 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.829 -1.219 2.459 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.470 -0.289 2.884 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -5.942 0.502 1.412 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -5.541 -1.548 0.295 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -5.454 -2.459 1.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.532 -2.861 0.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -7.831 -2.089 2.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.915 -1.207 0.674 1.00 0.00 H new ATOM 148 N ARG A 372 -3.430 1.741 6.713 1.00 0.00 N ATOM 149 CA ARG A 372 -3.648 2.879 7.592 1.00 0.00 C ATOM 150 C ARG A 372 -2.349 3.652 7.769 1.00 0.00 C ATOM 151 O ARG A 372 -2.353 4.873 7.927 1.00 0.00 O ATOM 152 CB ARG A 372 -4.185 2.417 8.952 1.00 0.00 C ATOM 153 CG ARG A 372 -3.154 1.707 9.816 1.00 0.00 C ATOM 154 CD ARG A 372 -2.468 2.666 10.775 1.00 0.00 C ATOM 155 NE ARG A 372 -1.410 2.010 11.540 1.00 0.00 N ATOM 156 CZ ARG A 372 -0.424 2.660 12.155 1.00 0.00 C ATOM 157 NH1 ARG A 372 -0.360 3.984 12.104 1.00 0.00 N ATOM 158 NH2 ARG A 372 0.500 1.983 12.824 1.00 0.00 N ATOM 0 H ARG A 372 -3.435 0.835 7.181 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.391 3.534 7.138 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.564 3.283 9.495 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.030 1.748 8.789 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -3.639 0.912 10.382 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -2.407 1.235 9.178 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -2.046 3.500 10.214 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -3.206 3.083 11.460 1.00 0.00 H new ATOM 0 HE ARG A 372 -1.428 0.992 11.607 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -1.068 4.509 11.592 1.00 0.00 H new ATOM 0 HH12 ARG A 372 0.398 4.477 12.577 1.00 0.00 H new ATOM 0 HH21 ARG A 372 0.455 0.965 12.867 1.00 0.00 H new ATOM 0 HH22 ARG A 372 1.256 2.481 13.295 1.00 0.00 H new ATOM 170 N GLN A 373 -1.237 2.926 7.726 1.00 0.00 N ATOM 171 CA GLN A 373 0.076 3.533 7.867 1.00 0.00 C ATOM 172 C GLN A 373 0.346 4.485 6.708 1.00 0.00 C ATOM 173 O GLN A 373 0.706 5.643 6.913 1.00 0.00 O ATOM 174 CB GLN A 373 1.157 2.448 7.920 1.00 0.00 C ATOM 175 CG GLN A 373 1.853 2.349 9.267 1.00 0.00 C ATOM 176 CD GLN A 373 3.337 2.649 9.183 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.689 3.686 8.433 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 4.157 1.958 9.787 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.222 1.915 7.594 1.00 0.00 H new ATOM 0 HA GLN A 373 0.100 4.100 8.798 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.705 1.485 7.682 1.00 0.00 H new ATOM 0 HB3 GLN A 373 1.901 2.650 7.150 1.00 0.00 H new ATOM 0 HG2 GLN A 373 1.385 3.043 9.965 1.00 0.00 H new ATOM 0 HG3 GLN A 373 1.712 1.347 9.672 1.00 0.00 H new ATOM 0 HE21 GLN A 373 3.842 1.170 10.352 1.00 0.00 H new ATOM 0 HE22 GLN A 373 5.152 2.174 9.722 1.00 0.00 H new ATOM 187 N LEU A 374 0.164 3.986 5.489 1.00 0.00 N ATOM 188 CA LEU A 374 0.386 4.791 4.296 1.00 0.00 C ATOM 189 C LEU A 374 -0.555 5.988 4.261 1.00 0.00 C ATOM 190 O LEU A 374 -0.141 7.110 3.974 1.00 0.00 O ATOM 191 CB LEU A 374 0.197 3.938 3.040 1.00 0.00 C ATOM 192 CG LEU A 374 1.489 3.380 2.439 1.00 0.00 C ATOM 193 CD1 LEU A 374 1.221 2.060 1.733 1.00 0.00 C ATOM 194 CD2 LEU A 374 2.107 4.387 1.481 1.00 0.00 C ATOM 0 H LEU A 374 -0.136 3.029 5.303 1.00 0.00 H new ATOM 0 HA LEU A 374 1.410 5.163 4.324 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.464 3.105 3.280 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.309 4.538 2.284 1.00 0.00 H new ATOM 0 HG LEU A 374 2.197 3.197 3.247 1.00 0.00 H new ATOM 0 HD11 LEU A 374 2.151 1.678 1.312 1.00 0.00 H new ATOM 0 HD12 LEU A 374 0.823 1.339 2.448 1.00 0.00 H new ATOM 0 HD13 LEU A 374 0.497 2.216 0.933 1.00 0.00 H new ATOM 0 HD21 LEU A 374 3.025 3.975 1.062 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.405 4.601 0.675 1.00 0.00 H new ATOM 0 HD23 LEU A 374 2.335 5.308 2.018 1.00 0.00 H new ATOM 206 N TYR A 375 -1.824 5.743 4.554 1.00 0.00 N ATOM 207 CA TYR A 375 -2.822 6.804 4.551 1.00 0.00 C ATOM 208 C TYR A 375 -2.595 7.771 5.705 1.00 0.00 C ATOM 209 O TYR A 375 -2.947 8.949 5.619 1.00 0.00 O ATOM 210 CB TYR A 375 -4.229 6.210 4.632 1.00 0.00 C ATOM 211 CG TYR A 375 -5.229 6.891 3.726 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.008 6.978 2.357 1.00 0.00 C ATOM 213 CD2 TYR A 375 -6.395 7.446 4.239 1.00 0.00 C ATOM 214 CE1 TYR A 375 -5.921 7.599 1.525 1.00 0.00 C ATOM 215 CE2 TYR A 375 -7.312 8.068 3.414 1.00 0.00 C ATOM 216 CZ TYR A 375 -7.071 8.143 2.059 1.00 0.00 C ATOM 217 OH TYR A 375 -7.982 8.760 1.234 1.00 0.00 O ATOM 0 H TYR A 375 -2.187 4.821 4.796 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.724 7.357 3.617 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.182 5.151 4.376 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.582 6.274 5.661 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.108 6.554 1.936 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -6.588 7.390 5.300 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -5.735 7.658 0.463 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -8.214 8.494 3.829 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.736 9.088 1.767 1.00 0.00 H new ATOM 227 N SER A 376 -2.003 7.273 6.784 1.00 0.00 N ATOM 228 CA SER A 376 -1.730 8.101 7.950 1.00 0.00 C ATOM 229 C SER A 376 -0.349 8.748 7.859 1.00 0.00 C ATOM 230 O SER A 376 0.022 9.550 8.716 1.00 0.00 O ATOM 231 CB SER A 376 -1.828 7.264 9.228 1.00 0.00 C ATOM 232 OG SER A 376 -0.721 6.388 9.351 1.00 0.00 O ATOM 0 H SER A 376 -1.704 6.302 6.875 1.00 0.00 H new ATOM 0 HA SER A 376 -2.477 8.894 7.979 1.00 0.00 H new ATOM 0 HB2 SER A 376 -1.872 7.923 10.095 1.00 0.00 H new ATOM 0 HB3 SER A 376 -2.753 6.687 9.218 1.00 0.00 H new ATOM 0 HG SER A 376 -0.347 6.207 8.464 1.00 0.00 H new ATOM 238 N LEU A 377 0.417 8.394 6.825 1.00 0.00 N ATOM 239 CA LEU A 377 1.753 8.947 6.653 1.00 0.00 C ATOM 240 C LEU A 377 1.870 9.781 5.379 1.00 0.00 C ATOM 241 O LEU A 377 2.681 10.704 5.315 1.00 0.00 O ATOM 242 CB LEU A 377 2.798 7.829 6.638 1.00 0.00 C ATOM 243 CG LEU A 377 3.480 7.566 7.981 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.468 7.075 9.008 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.609 6.559 7.817 1.00 0.00 C ATOM 0 H LEU A 377 0.134 7.732 6.102 1.00 0.00 H new ATOM 0 HA LEU A 377 1.938 9.606 7.501 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.319 6.909 6.304 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.562 8.076 5.901 1.00 0.00 H new ATOM 0 HG LEU A 377 3.905 8.503 8.341 1.00 0.00 H new ATOM 0 HD11 LEU A 377 2.972 6.893 9.957 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.695 7.830 9.147 1.00 0.00 H new ATOM 0 HD13 LEU A 377 2.012 6.149 8.656 1.00 0.00 H new ATOM 0 HD21 LEU A 377 5.083 6.384 8.783 1.00 0.00 H new ATOM 0 HD22 LEU A 377 4.207 5.621 7.434 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.347 6.950 7.116 1.00 0.00 H new ATOM 257 N ILE A 378 1.074 9.459 4.360 1.00 0.00 N ATOM 258 CA ILE A 378 1.135 10.203 3.108 1.00 0.00 C ATOM 259 C ILE A 378 -0.256 10.529 2.565 1.00 0.00 C ATOM 260 O ILE A 378 -0.479 11.611 2.023 1.00 0.00 O ATOM 261 CB ILE A 378 1.952 9.444 2.036 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.196 8.211 1.531 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.305 9.036 2.600 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.818 7.585 0.302 1.00 0.00 C ATOM 0 H ILE A 378 0.391 8.701 4.377 1.00 0.00 H new ATOM 0 HA ILE A 378 1.640 11.142 3.334 1.00 0.00 H new ATOM 0 HB ILE A 378 2.105 10.115 1.190 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.156 7.468 2.327 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.167 8.492 1.305 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.871 8.502 1.837 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.856 9.926 2.905 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.159 8.387 3.463 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.232 6.717 -0.001 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.834 8.313 -0.509 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.837 7.273 0.529 1.00 0.00 H new ATOM 276 N GLY A 379 -1.182 9.587 2.707 1.00 0.00 N ATOM 277 CA GLY A 379 -2.531 9.795 2.217 1.00 0.00 C ATOM 278 C GLY A 379 -3.191 11.033 2.795 1.00 0.00 C ATOM 279 O GLY A 379 -3.784 10.980 3.872 1.00 0.00 O ATOM 0 H GLY A 379 -1.022 8.684 3.153 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.508 9.877 1.130 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.137 8.922 2.458 1.00 0.00 H new ATOM 283 N TYR A 380 -3.102 12.150 2.074 1.00 0.00 N ATOM 284 CA TYR A 380 -3.712 13.396 2.525 1.00 0.00 C ATOM 285 C TYR A 380 -4.892 13.770 1.634 1.00 0.00 C ATOM 286 O TYR A 380 -5.016 14.913 1.194 1.00 0.00 O ATOM 287 CB TYR A 380 -2.689 14.537 2.545 1.00 0.00 C ATOM 288 CG TYR A 380 -1.731 14.534 1.376 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.197 14.470 0.069 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.358 14.603 1.580 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.324 14.475 -1.001 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.522 14.611 0.515 1.00 0.00 C ATOM 293 CZ TYR A 380 0.035 14.546 -0.773 1.00 0.00 C ATOM 294 OH TYR A 380 0.908 14.555 -1.836 1.00 0.00 O ATOM 0 H TYR A 380 -2.616 12.216 1.180 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.072 13.239 3.542 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.222 15.487 2.560 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.115 14.479 3.470 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.260 14.415 -0.113 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.027 14.651 2.588 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.703 14.424 -2.011 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.586 14.668 0.691 1.00 0.00 H new ATOM 0 HH TYR A 380 1.642 13.929 -1.662 1.00 0.00 H new ATOM 304 N ALA A 381 -5.756 12.791 1.371 1.00 0.00 N ATOM 305 CA ALA A 381 -6.936 12.999 0.532 1.00 0.00 C ATOM 306 C ALA A 381 -6.566 12.987 -0.948 1.00 0.00 C ATOM 307 O ALA A 381 -7.069 12.165 -1.715 1.00 0.00 O ATOM 308 CB ALA A 381 -7.639 14.301 0.894 1.00 0.00 C ATOM 0 H ALA A 381 -5.660 11.841 1.729 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.624 12.174 0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -8.513 14.432 0.256 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.953 14.267 1.937 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.955 15.137 0.748 1.00 0.00 H new ATOM 314 N SER A 382 -5.684 13.899 -1.343 1.00 0.00 N ATOM 315 CA SER A 382 -5.247 13.988 -2.733 1.00 0.00 C ATOM 316 C SER A 382 -4.701 12.647 -3.222 1.00 0.00 C ATOM 317 O SER A 382 -4.695 12.370 -4.422 1.00 0.00 O ATOM 318 CB SER A 382 -4.182 15.077 -2.884 1.00 0.00 C ATOM 319 OG SER A 382 -4.598 16.074 -3.802 1.00 0.00 O ATOM 0 H SER A 382 -5.258 14.587 -0.722 1.00 0.00 H new ATOM 0 HA SER A 382 -6.111 14.248 -3.345 1.00 0.00 H new ATOM 0 HB2 SER A 382 -3.983 15.532 -1.914 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.248 14.631 -3.225 1.00 0.00 H new ATOM 0 HG SER A 382 -3.901 16.759 -3.879 1.00 0.00 H new ATOM 325 N LEU A 383 -4.243 11.819 -2.288 1.00 0.00 N ATOM 326 CA LEU A 383 -3.700 10.512 -2.622 1.00 0.00 C ATOM 327 C LEU A 383 -4.725 9.415 -2.383 1.00 0.00 C ATOM 328 O LEU A 383 -4.843 8.896 -1.273 1.00 0.00 O ATOM 329 CB LEU A 383 -2.456 10.213 -1.789 1.00 0.00 C ATOM 330 CG LEU A 383 -1.326 11.230 -1.907 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.398 11.113 -0.711 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.560 11.030 -3.206 1.00 0.00 C ATOM 0 H LEU A 383 -4.238 12.034 -1.291 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.436 10.533 -3.679 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -2.750 10.143 -0.742 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.073 9.235 -2.079 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.754 12.232 -1.920 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.407 11.842 -0.802 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.958 11.303 0.204 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.025 10.109 -0.675 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.242 11.765 -3.272 1.00 0.00 H new ATOM 0 HD22 LEU A 383 -0.135 10.026 -3.227 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -1.237 11.155 -4.051 1.00 0.00 H new ATOM 344 N ARG A 384 -5.455 9.058 -3.428 1.00 0.00 N ATOM 345 CA ARG A 384 -6.457 8.006 -3.327 1.00 0.00 C ATOM 346 C ARG A 384 -5.780 6.648 -3.153 1.00 0.00 C ATOM 347 O ARG A 384 -5.873 5.780 -4.021 1.00 0.00 O ATOM 348 CB ARG A 384 -7.347 7.997 -4.572 1.00 0.00 C ATOM 349 CG ARG A 384 -8.564 8.901 -4.454 1.00 0.00 C ATOM 350 CD ARG A 384 -9.611 8.563 -5.504 1.00 0.00 C ATOM 351 NE ARG A 384 -9.437 9.349 -6.723 1.00 0.00 N ATOM 352 CZ ARG A 384 -10.195 9.210 -7.809 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.178 8.319 -7.831 1.00 0.00 N ATOM 354 NH2 ARG A 384 -9.970 9.966 -8.875 1.00 0.00 N ATOM 0 H ARG A 384 -5.374 9.479 -4.353 1.00 0.00 H new ATOM 0 HA ARG A 384 -7.081 8.202 -2.455 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -6.756 8.307 -5.434 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -7.679 6.977 -4.764 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.999 8.801 -3.459 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.258 9.941 -4.565 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -9.553 7.502 -5.746 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -10.605 8.743 -5.095 1.00 0.00 H new ATOM 0 HE ARG A 384 -8.691 10.045 -6.743 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -11.356 7.736 -7.013 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -11.755 8.217 -8.666 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -9.217 10.654 -8.863 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -10.550 9.860 -9.707 1.00 0.00 H new ATOM 366 N LEU A 385 -5.090 6.476 -2.027 1.00 0.00 N ATOM 367 CA LEU A 385 -4.384 5.232 -1.736 1.00 0.00 C ATOM 368 C LEU A 385 -5.293 4.023 -1.943 1.00 0.00 C ATOM 369 O LEU A 385 -6.073 3.661 -1.062 1.00 0.00 O ATOM 370 CB LEU A 385 -3.846 5.247 -0.301 1.00 0.00 C ATOM 371 CG LEU A 385 -3.184 3.944 0.156 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.676 4.117 0.258 1.00 0.00 C ATOM 373 CD2 LEU A 385 -3.762 3.491 1.489 1.00 0.00 C ATOM 0 H LEU A 385 -5.005 7.186 -1.300 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.546 5.151 -2.428 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.122 6.056 -0.209 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.668 5.476 0.377 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.391 3.174 -0.588 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.224 3.180 0.584 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.275 4.394 -0.717 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.448 4.901 0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.280 2.564 1.798 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -3.587 4.260 2.242 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.834 3.325 1.383 1.00 0.00 H new ATOM 385 N HIS A 386 -5.182 3.403 -3.114 1.00 0.00 N ATOM 386 CA HIS A 386 -5.987 2.236 -3.443 1.00 0.00 C ATOM 387 C HIS A 386 -5.101 1.073 -3.870 1.00 0.00 C ATOM 388 O HIS A 386 -4.040 1.272 -4.461 1.00 0.00 O ATOM 389 CB HIS A 386 -6.983 2.572 -4.554 1.00 0.00 C ATOM 390 CG HIS A 386 -7.959 1.472 -4.835 1.00 0.00 C ATOM 391 ND1 HIS A 386 -9.131 1.307 -4.126 1.00 0.00 N ATOM 392 CD2 HIS A 386 -7.934 0.477 -5.753 1.00 0.00 C ATOM 393 CE1 HIS A 386 -9.783 0.258 -4.596 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.078 -0.262 -5.583 1.00 0.00 N ATOM 0 H HIS A 386 -4.540 3.692 -3.852 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.540 1.941 -2.551 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.532 3.472 -4.278 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.433 2.801 -5.467 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.158 0.298 -6.483 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -10.731 -0.111 -4.234 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -9.341 -1.081 -6.131 1.00 0.00 H new ATOM 403 N TYR A 387 -5.540 -0.144 -3.562 1.00 0.00 N ATOM 404 CA TYR A 387 -4.783 -1.337 -3.911 1.00 0.00 C ATOM 405 C TYR A 387 -5.453 -2.107 -5.039 1.00 0.00 C ATOM 406 O TYR A 387 -6.657 -2.359 -5.008 1.00 0.00 O ATOM 407 CB TYR A 387 -4.616 -2.232 -2.685 1.00 0.00 C ATOM 408 CG TYR A 387 -3.621 -1.686 -1.692 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.810 -0.439 -1.111 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.486 -2.407 -1.345 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.899 0.073 -0.210 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.570 -1.901 -0.445 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.781 -0.660 0.120 1.00 0.00 C ATOM 414 OH TYR A 387 -0.870 -0.150 1.015 1.00 0.00 O ATOM 0 H TYR A 387 -6.415 -0.328 -3.072 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.799 -1.022 -4.259 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.582 -2.353 -2.195 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.295 -3.223 -3.006 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.685 0.140 -1.369 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.317 -3.378 -1.786 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -3.062 1.044 0.234 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.692 -2.474 -0.184 1.00 0.00 H new ATOM 0 HH TYR A 387 -1.339 0.161 1.818 1.00 0.00 H new ATOM 424 N VAL A 388 -4.661 -2.473 -6.039 1.00 0.00 N ATOM 425 CA VAL A 388 -5.164 -3.210 -7.186 1.00 0.00 C ATOM 426 C VAL A 388 -4.472 -4.562 -7.317 1.00 0.00 C ATOM 427 O VAL A 388 -3.273 -4.634 -7.582 1.00 0.00 O ATOM 428 CB VAL A 388 -4.964 -2.409 -8.485 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.518 -3.170 -9.681 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.611 -1.037 -8.372 1.00 0.00 C ATOM 0 H VAL A 388 -3.662 -2.269 -6.076 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.230 -3.371 -7.025 1.00 0.00 H new ATOM 0 HB VAL A 388 -3.894 -2.271 -8.639 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.365 -2.584 -10.587 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.002 -4.125 -9.775 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.584 -3.346 -9.538 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -5.459 -0.486 -9.300 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.679 -1.152 -8.189 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.159 -0.488 -7.546 1.00 0.00 H new ATOM 440 N THR A 389 -5.237 -5.633 -7.133 1.00 0.00 N ATOM 441 CA THR A 389 -4.697 -6.983 -7.235 1.00 0.00 C ATOM 442 C THR A 389 -4.619 -7.422 -8.693 1.00 0.00 C ATOM 443 O THR A 389 -5.642 -7.655 -9.337 1.00 0.00 O ATOM 444 CB THR A 389 -5.562 -7.963 -6.440 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.769 -8.240 -7.128 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.926 -7.457 -5.060 1.00 0.00 C ATOM 0 H THR A 389 -6.232 -5.592 -6.913 1.00 0.00 H new ATOM 0 HA THR A 389 -3.690 -6.980 -6.818 1.00 0.00 H new ATOM 0 HB THR A 389 -4.954 -8.861 -6.332 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.774 -7.763 -7.984 1.00 0.00 H new ATOM 0 HG21 THR A 389 -6.540 -8.200 -4.550 1.00 0.00 H new ATOM 0 HG22 THR A 389 -5.017 -7.281 -4.485 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.484 -6.525 -5.150 1.00 0.00 H new ATOM 594 N ASN A 399 0.948 -16.548 -7.106 1.00 0.00 N ATOM 595 CA ASN A 399 0.465 -16.070 -5.815 1.00 0.00 C ATOM 596 C ASN A 399 -0.459 -14.867 -5.991 1.00 0.00 C ATOM 597 O ASN A 399 -0.942 -14.602 -7.092 1.00 0.00 O ATOM 598 CB ASN A 399 1.640 -15.697 -4.905 1.00 0.00 C ATOM 599 CG ASN A 399 2.858 -16.570 -5.134 1.00 0.00 C ATOM 600 OD1 ASN A 399 3.542 -16.345 -6.249 1.00 0.00 O flip ATOM 601 ND2 ASN A 399 3.180 -17.436 -4.320 1.00 0.00 N flip ATOM 0 HA ASN A 399 -0.100 -16.877 -5.349 1.00 0.00 H new ATOM 0 HB2 ASN A 399 1.909 -14.654 -5.074 1.00 0.00 H new ATOM 0 HB3 ASN A 399 1.329 -15.781 -3.864 1.00 0.00 H new ATOM 0 HD21 ASN A 399 2.624 -17.574 -3.476 1.00 0.00 H new ATOM 0 HD22 ASN A 399 4.002 -18.015 -4.490 1.00 0.00 H new ATOM 608 N SER A 400 -0.700 -14.143 -4.903 1.00 0.00 N ATOM 609 CA SER A 400 -1.564 -12.971 -4.943 1.00 0.00 C ATOM 610 C SER A 400 -0.735 -11.695 -5.040 1.00 0.00 C ATOM 611 O SER A 400 -0.300 -11.148 -4.029 1.00 0.00 O ATOM 612 CB SER A 400 -2.459 -12.924 -3.700 1.00 0.00 C ATOM 613 OG SER A 400 -3.825 -13.062 -4.051 1.00 0.00 O ATOM 0 H SER A 400 -0.309 -14.348 -3.984 1.00 0.00 H new ATOM 0 HA SER A 400 -2.196 -13.043 -5.828 1.00 0.00 H new ATOM 0 HB2 SER A 400 -2.174 -13.721 -3.013 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.308 -11.981 -3.175 1.00 0.00 H new ATOM 0 HG SER A 400 -4.384 -12.872 -3.269 1.00 0.00 H new ATOM 619 N ILE A 401 -0.522 -11.226 -6.264 1.00 0.00 N ATOM 620 CA ILE A 401 0.254 -10.015 -6.490 1.00 0.00 C ATOM 621 C ILE A 401 -0.636 -8.777 -6.398 1.00 0.00 C ATOM 622 O ILE A 401 -1.674 -8.698 -7.056 1.00 0.00 O ATOM 623 CB ILE A 401 0.964 -10.053 -7.864 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.227 -9.191 -7.834 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.031 -9.598 -8.979 1.00 0.00 C ATOM 626 CD1 ILE A 401 1.964 -7.746 -7.472 1.00 0.00 C ATOM 0 H ILE A 401 -0.876 -11.666 -7.113 1.00 0.00 H new ATOM 0 HA ILE A 401 1.015 -9.962 -5.711 1.00 0.00 H new ATOM 0 HB ILE A 401 1.250 -11.085 -8.069 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.929 -9.615 -7.116 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.707 -9.231 -8.812 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.558 -9.635 -9.932 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.837 -10.256 -9.018 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.296 -8.577 -8.785 1.00 0.00 H new ATOM 0 HD11 ILE A 401 2.904 -7.194 -7.470 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.286 -7.305 -8.203 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.512 -7.696 -6.482 1.00 0.00 H new ATOM 638 N VAL A 402 -0.230 -7.814 -5.577 1.00 0.00 N ATOM 639 CA VAL A 402 -1.001 -6.592 -5.408 1.00 0.00 C ATOM 640 C VAL A 402 -0.106 -5.362 -5.451 1.00 0.00 C ATOM 641 O VAL A 402 1.089 -5.436 -5.165 1.00 0.00 O ATOM 642 CB VAL A 402 -1.783 -6.597 -4.081 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.734 -5.411 -4.018 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.539 -7.905 -3.911 1.00 0.00 C ATOM 0 H VAL A 402 0.624 -7.857 -5.022 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.707 -6.552 -6.237 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.071 -6.507 -3.261 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -3.278 -5.431 -3.074 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -2.165 -4.484 -4.090 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.441 -5.467 -4.845 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.085 -7.890 -2.968 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.241 -8.029 -4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.833 -8.736 -3.908 1.00 0.00 H new ATOM 654 N GLU A 403 -0.699 -4.231 -5.807 1.00 0.00 N ATOM 655 CA GLU A 403 0.033 -2.976 -5.888 1.00 0.00 C ATOM 656 C GLU A 403 -0.805 -1.830 -5.337 1.00 0.00 C ATOM 657 O GLU A 403 -2.018 -1.784 -5.536 1.00 0.00 O ATOM 658 CB GLU A 403 0.431 -2.683 -7.335 1.00 0.00 C ATOM 659 CG GLU A 403 1.334 -3.743 -7.944 1.00 0.00 C ATOM 660 CD GLU A 403 1.407 -3.648 -9.456 1.00 0.00 C ATOM 661 OE1 GLU A 403 1.945 -2.641 -9.962 1.00 0.00 O ATOM 662 OE2 GLU A 403 0.926 -4.581 -10.133 1.00 0.00 O ATOM 0 H GLU A 403 -1.688 -4.157 -6.045 1.00 0.00 H new ATOM 0 HA GLU A 403 0.937 -3.069 -5.285 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.471 -2.595 -7.940 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.938 -1.719 -7.376 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.337 -3.643 -7.529 1.00 0.00 H new ATOM 0 HG3 GLU A 403 0.969 -4.731 -7.663 1.00 0.00 H new ATOM 669 N CYS A 404 -0.150 -0.904 -4.646 1.00 0.00 N ATOM 670 CA CYS A 404 -0.835 0.242 -4.072 1.00 0.00 C ATOM 671 C CYS A 404 -0.655 1.463 -4.968 1.00 0.00 C ATOM 672 O CYS A 404 0.441 2.011 -5.070 1.00 0.00 O ATOM 673 CB CYS A 404 -0.318 0.546 -2.657 1.00 0.00 C ATOM 674 SG CYS A 404 0.890 -0.627 -1.997 1.00 0.00 S ATOM 0 H CYS A 404 0.855 -0.927 -4.471 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.896 0.002 -4.001 1.00 0.00 H new ATOM 0 HB2 CYS A 404 0.131 1.539 -2.659 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -1.170 0.583 -1.978 1.00 0.00 H new ATOM 0 HG CYS A 404 0.293 -1.464 -1.202 1.00 0.00 H new ATOM 680 N ARG A 405 -1.735 1.880 -5.620 1.00 0.00 N ATOM 681 CA ARG A 405 -1.688 3.029 -6.510 1.00 0.00 C ATOM 682 C ARG A 405 -2.427 4.216 -5.911 1.00 0.00 C ATOM 683 O ARG A 405 -3.483 4.059 -5.297 1.00 0.00 O ATOM 684 CB ARG A 405 -2.285 2.676 -7.872 1.00 0.00 C ATOM 685 CG ARG A 405 -1.422 1.727 -8.686 1.00 0.00 C ATOM 686 CD ARG A 405 -2.267 0.786 -9.530 1.00 0.00 C ATOM 687 NE ARG A 405 -1.447 -0.068 -10.385 1.00 0.00 N ATOM 688 CZ ARG A 405 -1.933 -0.814 -11.375 1.00 0.00 C ATOM 689 NH1 ARG A 405 -3.234 -0.813 -11.638 1.00 0.00 N ATOM 690 NH2 ARG A 405 -1.115 -1.561 -12.104 1.00 0.00 N ATOM 0 H ARG A 405 -2.652 1.438 -5.547 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.642 3.306 -6.642 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.266 2.225 -7.724 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.438 3.593 -8.441 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -0.760 2.302 -9.333 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -0.788 1.146 -8.016 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -2.879 0.164 -8.877 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.950 1.368 -10.148 1.00 0.00 H new ATOM 0 HE ARG A 405 -0.442 -0.095 -10.214 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -3.867 -0.239 -11.081 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -3.601 -1.386 -12.398 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -0.114 -1.564 -11.906 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -1.486 -2.133 -12.863 1.00 0.00 H new ATOM 702 N VAL A 406 -1.865 5.404 -6.095 1.00 0.00 N ATOM 703 CA VAL A 406 -2.469 6.619 -5.575 1.00 0.00 C ATOM 704 C VAL A 406 -2.775 7.606 -6.697 1.00 0.00 C ATOM 705 O VAL A 406 -2.185 7.537 -7.776 1.00 0.00 O ATOM 706 CB VAL A 406 -1.560 7.303 -4.538 1.00 0.00 C ATOM 707 CG1 VAL A 406 -1.465 6.464 -3.274 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.178 7.558 -5.124 1.00 0.00 C ATOM 0 H VAL A 406 -0.991 5.550 -6.601 1.00 0.00 H new ATOM 0 HA VAL A 406 -3.400 6.324 -5.090 1.00 0.00 H new ATOM 0 HB VAL A 406 -2.000 8.265 -4.275 1.00 0.00 H new ATOM 0 HG11 VAL A 406 -0.818 6.964 -2.553 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -2.459 6.339 -2.844 1.00 0.00 H new ATOM 0 HG13 VAL A 406 -1.050 5.486 -3.517 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.451 8.042 -4.376 1.00 0.00 H new ATOM 0 HG22 VAL A 406 0.273 6.610 -5.419 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -0.267 8.204 -5.997 1.00 0.00 H new ATOM 744 N THR A 410 -0.280 6.091 -9.936 1.00 0.00 N ATOM 745 CA THR A 410 1.095 6.019 -9.454 1.00 0.00 C ATOM 746 C THR A 410 1.224 4.991 -8.333 1.00 0.00 C ATOM 747 O THR A 410 0.763 5.218 -7.214 1.00 0.00 O ATOM 748 CB THR A 410 1.558 7.390 -8.960 1.00 0.00 C ATOM 749 OG1 THR A 410 1.425 8.362 -9.983 1.00 0.00 O ATOM 750 CG2 THR A 410 2.999 7.405 -8.498 1.00 0.00 C ATOM 0 HA THR A 410 1.729 5.708 -10.284 1.00 0.00 H new ATOM 0 HB THR A 410 0.918 7.621 -8.108 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.672 8.125 -10.564 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.263 8.407 -8.161 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.125 6.701 -7.676 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.649 7.118 -9.324 1.00 0.00 H new ATOM 758 N VAL A 411 1.854 3.863 -8.642 1.00 0.00 N ATOM 759 CA VAL A 411 2.045 2.801 -7.661 1.00 0.00 C ATOM 760 C VAL A 411 3.201 3.121 -6.722 1.00 0.00 C ATOM 761 O VAL A 411 4.342 3.277 -7.155 1.00 0.00 O ATOM 762 CB VAL A 411 2.305 1.442 -8.343 1.00 0.00 C ATOM 763 CG1 VAL A 411 3.591 1.484 -9.155 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.354 0.326 -7.310 1.00 0.00 C ATOM 0 H VAL A 411 2.241 3.660 -9.564 1.00 0.00 H new ATOM 0 HA VAL A 411 1.123 2.735 -7.084 1.00 0.00 H new ATOM 0 HB VAL A 411 1.480 1.238 -9.026 1.00 0.00 H new ATOM 0 HG11 VAL A 411 3.755 0.515 -9.627 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.511 2.253 -9.923 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.429 1.713 -8.497 1.00 0.00 H new ATOM 0 HG21 VAL A 411 2.538 -0.625 -7.810 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.156 0.523 -6.599 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.403 0.279 -6.780 1.00 0.00 H new ATOM 774 N LEU A 412 2.895 3.217 -5.434 1.00 0.00 N ATOM 775 CA LEU A 412 3.902 3.517 -4.428 1.00 0.00 C ATOM 776 C LEU A 412 4.390 2.245 -3.740 1.00 0.00 C ATOM 777 O LEU A 412 5.474 2.223 -3.158 1.00 0.00 O ATOM 778 CB LEU A 412 3.337 4.486 -3.388 1.00 0.00 C ATOM 779 CG LEU A 412 4.336 5.509 -2.843 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.477 6.681 -3.801 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.902 5.993 -1.467 1.00 0.00 C ATOM 0 H LEU A 412 1.954 3.091 -5.062 1.00 0.00 H new ATOM 0 HA LEU A 412 4.751 3.982 -4.930 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.498 5.022 -3.832 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.941 3.908 -2.553 1.00 0.00 H new ATOM 0 HG LEU A 412 5.308 5.025 -2.749 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.191 7.398 -3.396 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.832 6.321 -4.767 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.509 7.166 -3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.623 6.720 -1.093 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.920 6.460 -1.539 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.852 5.146 -0.782 1.00 0.00 H new ATOM 793 N GLY A 413 3.582 1.191 -3.803 1.00 0.00 N ATOM 794 CA GLY A 413 3.958 -0.064 -3.172 1.00 0.00 C ATOM 795 C GLY A 413 3.533 -1.282 -3.971 1.00 0.00 C ATOM 796 O GLY A 413 2.370 -1.411 -4.350 1.00 0.00 O ATOM 0 H GLY A 413 2.679 1.182 -4.276 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.039 -0.086 -3.035 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.510 -0.113 -2.179 1.00 0.00 H new ATOM 800 N THR A 414 4.480 -2.178 -4.227 1.00 0.00 N ATOM 801 CA THR A 414 4.209 -3.393 -4.979 1.00 0.00 C ATOM 802 C THR A 414 4.766 -4.610 -4.243 1.00 0.00 C ATOM 803 O THR A 414 5.964 -4.678 -3.966 1.00 0.00 O ATOM 804 CB THR A 414 4.833 -3.281 -6.369 1.00 0.00 C ATOM 805 OG1 THR A 414 4.128 -2.338 -7.158 1.00 0.00 O ATOM 806 CG2 THR A 414 4.862 -4.588 -7.134 1.00 0.00 C ATOM 0 H THR A 414 5.448 -2.082 -3.921 1.00 0.00 H new ATOM 0 HA THR A 414 3.131 -3.519 -5.079 1.00 0.00 H new ATOM 0 HB THR A 414 5.862 -2.967 -6.193 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.542 -2.278 -8.044 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.319 -4.428 -8.111 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.444 -5.323 -6.577 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.844 -4.955 -7.266 1.00 0.00 H new ATOM 814 N GLY A 415 3.898 -5.567 -3.923 1.00 0.00 N ATOM 815 CA GLY A 415 4.346 -6.753 -3.218 1.00 0.00 C ATOM 816 C GLY A 415 3.432 -7.948 -3.419 1.00 0.00 C ATOM 817 O GLY A 415 2.217 -7.797 -3.538 1.00 0.00 O ATOM 0 H GLY A 415 2.901 -5.542 -4.138 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.350 -7.011 -3.555 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.414 -6.531 -2.153 1.00 0.00 H new ATOM 821 N VAL A 416 4.026 -9.137 -3.450 1.00 0.00 N ATOM 822 CA VAL A 416 3.275 -10.370 -3.629 1.00 0.00 C ATOM 823 C VAL A 416 2.911 -10.979 -2.280 1.00 0.00 C ATOM 824 O VAL A 416 3.492 -10.626 -1.254 1.00 0.00 O ATOM 825 CB VAL A 416 4.092 -11.392 -4.438 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.266 -12.633 -4.737 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.613 -10.765 -5.724 1.00 0.00 C ATOM 0 H VAL A 416 5.033 -9.270 -3.353 1.00 0.00 H new ATOM 0 HA VAL A 416 2.363 -10.126 -4.173 1.00 0.00 H new ATOM 0 HB VAL A 416 4.948 -11.696 -3.835 1.00 0.00 H new ATOM 0 HG11 VAL A 416 3.866 -13.340 -5.310 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.954 -13.097 -3.801 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.385 -12.353 -5.315 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.188 -11.504 -6.282 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.773 -10.426 -6.330 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.252 -9.915 -5.482 1.00 0.00 H new ATOM 837 N GLY A 417 1.947 -11.891 -2.284 1.00 0.00 N ATOM 838 CA GLY A 417 1.528 -12.527 -1.051 1.00 0.00 C ATOM 839 C GLY A 417 0.623 -13.719 -1.286 1.00 0.00 C ATOM 840 O GLY A 417 -0.028 -13.817 -2.326 1.00 0.00 O ATOM 0 H GLY A 417 1.449 -12.201 -3.118 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.409 -12.849 -0.495 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.008 -11.798 -0.430 1.00 0.00 H new ATOM 844 N ARG A 418 0.579 -14.627 -0.315 1.00 0.00 N ATOM 845 CA ARG A 418 -0.257 -15.818 -0.419 1.00 0.00 C ATOM 846 C ARG A 418 -1.709 -15.435 -0.695 1.00 0.00 C ATOM 847 O ARG A 418 -2.463 -16.208 -1.287 1.00 0.00 O ATOM 848 CB ARG A 418 -0.170 -16.642 0.866 1.00 0.00 C ATOM 849 CG ARG A 418 1.251 -17.016 1.254 1.00 0.00 C ATOM 850 CD ARG A 418 1.278 -18.231 2.166 1.00 0.00 C ATOM 851 NE ARG A 418 2.561 -18.929 2.109 1.00 0.00 N ATOM 852 CZ ARG A 418 2.751 -20.170 2.552 1.00 0.00 C ATOM 853 NH1 ARG A 418 1.745 -20.854 3.083 1.00 0.00 N ATOM 854 NH2 ARG A 418 3.950 -20.729 2.462 1.00 0.00 N ATOM 0 H ARG A 418 1.112 -14.560 0.552 1.00 0.00 H new ATOM 0 HA ARG A 418 0.109 -16.420 -1.251 1.00 0.00 H new ATOM 0 HB2 ARG A 418 -0.624 -16.078 1.681 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -0.756 -17.553 0.744 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.833 -17.221 0.355 1.00 0.00 H new ATOM 0 HG3 ARG A 418 1.726 -16.173 1.755 1.00 0.00 H new ATOM 0 HD2 ARG A 418 1.080 -17.919 3.192 1.00 0.00 H new ATOM 0 HD3 ARG A 418 0.479 -18.916 1.881 1.00 0.00 H new ATOM 0 HE ARG A 418 3.358 -18.436 1.706 1.00 0.00 H new ATOM 0 HH11 ARG A 418 0.820 -20.429 3.153 1.00 0.00 H new ATOM 0 HH12 ARG A 418 1.897 -21.804 3.421 1.00 0.00 H new ATOM 0 HH21 ARG A 418 4.726 -20.208 2.054 1.00 0.00 H new ATOM 0 HH22 ARG A 418 4.096 -21.680 2.801 1.00 0.00 H new ATOM 866 N ASN A 419 -2.090 -14.236 -0.266 1.00 0.00 N ATOM 867 CA ASN A 419 -3.449 -13.747 -0.469 1.00 0.00 C ATOM 868 C ASN A 419 -3.501 -12.227 -0.354 1.00 0.00 C ATOM 869 O ASN A 419 -2.479 -11.574 -0.151 1.00 0.00 O ATOM 870 CB ASN A 419 -4.408 -14.384 0.541 1.00 0.00 C ATOM 871 CG ASN A 419 -3.801 -14.510 1.925 1.00 0.00 C ATOM 872 OD1 ASN A 419 -2.839 -15.252 2.128 1.00 0.00 O ATOM 873 ND2 ASN A 419 -4.361 -13.785 2.886 1.00 0.00 N ATOM 0 H ASN A 419 -1.477 -13.585 0.224 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.761 -14.029 -1.474 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -5.317 -13.785 0.600 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -4.700 -15.372 0.185 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -3.995 -13.830 3.837 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -5.157 -13.183 2.673 1.00 0.00 H new ATOM 880 N ILE A 420 -4.701 -11.670 -0.488 1.00 0.00 N ATOM 881 CA ILE A 420 -4.892 -10.226 -0.404 1.00 0.00 C ATOM 882 C ILE A 420 -4.348 -9.669 0.909 1.00 0.00 C ATOM 883 O ILE A 420 -3.772 -8.581 0.942 1.00 0.00 O ATOM 884 CB ILE A 420 -6.382 -9.853 -0.537 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.561 -8.332 -0.546 1.00 0.00 C ATOM 886 CG2 ILE A 420 -7.187 -10.483 0.587 1.00 0.00 C ATOM 887 CD1 ILE A 420 -6.431 -7.716 -1.921 1.00 0.00 C ATOM 0 H ILE A 420 -5.557 -12.198 -0.656 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.338 -9.783 -1.232 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.752 -10.242 -1.486 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.542 -8.087 -0.139 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.820 -7.883 0.116 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.237 -10.211 0.480 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -7.087 -11.567 0.542 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.815 -10.124 1.547 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -6.569 -6.637 -1.851 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -5.441 -7.930 -2.323 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -7.189 -8.137 -2.581 1.00 0.00 H new ATOM 899 N LYS A 421 -4.535 -10.420 1.988 1.00 0.00 N ATOM 900 CA LYS A 421 -4.064 -9.997 3.302 1.00 0.00 C ATOM 901 C LYS A 421 -2.554 -9.801 3.303 1.00 0.00 C ATOM 902 O LYS A 421 -2.053 -8.740 3.676 1.00 0.00 O ATOM 903 CB LYS A 421 -4.457 -11.025 4.366 1.00 0.00 C ATOM 904 CG LYS A 421 -4.265 -10.530 5.789 1.00 0.00 C ATOM 905 CD LYS A 421 -4.826 -11.514 6.803 1.00 0.00 C ATOM 906 CE LYS A 421 -3.802 -12.574 7.176 1.00 0.00 C ATOM 907 NZ LYS A 421 -4.007 -13.840 6.417 1.00 0.00 N ATOM 0 H LYS A 421 -5.009 -11.323 1.979 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.536 -9.043 3.537 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.502 -11.301 4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -3.866 -11.929 4.222 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -3.203 -10.374 5.981 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -4.756 -9.564 5.908 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -5.138 -10.977 7.699 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -5.715 -11.994 6.393 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -2.799 -12.193 6.982 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -3.864 -12.778 8.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -4.353 -14.579 7.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -4.706 -13.684 5.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -3.105 -14.142 5.996 1.00 0.00 H new ATOM 921 N ILE A 422 -1.837 -10.831 2.878 1.00 0.00 N ATOM 922 CA ILE A 422 -0.382 -10.779 2.823 1.00 0.00 C ATOM 923 C ILE A 422 0.086 -9.827 1.729 1.00 0.00 C ATOM 924 O ILE A 422 0.878 -8.918 1.979 1.00 0.00 O ATOM 925 CB ILE A 422 0.220 -12.182 2.579 1.00 0.00 C ATOM 926 CG1 ILE A 422 0.044 -13.056 3.823 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.692 -12.086 2.202 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.398 -13.394 4.126 1.00 0.00 C ATOM 0 H ILE A 422 -2.239 -11.715 2.566 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.034 -10.412 3.789 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.312 -12.642 1.747 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.605 -13.981 3.689 1.00 0.00 H new ATOM 0 HG13 ILE A 422 0.476 -12.542 4.682 1.00 0.00 H new ATOM 0 HG21 ILE A 422 2.091 -13.087 2.036 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.796 -11.498 1.290 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.244 -11.605 3.010 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -1.446 -14.015 5.020 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -1.960 -12.475 4.292 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -1.829 -13.936 3.284 1.00 0.00 H new ATOM 940 N ALA A 423 -0.407 -10.045 0.519 1.00 0.00 N ATOM 941 CA ALA A 423 -0.040 -9.211 -0.618 1.00 0.00 C ATOM 942 C ALA A 423 -0.268 -7.738 -0.311 1.00 0.00 C ATOM 943 O ALA A 423 0.572 -6.890 -0.611 1.00 0.00 O ATOM 944 CB ALA A 423 -0.824 -9.624 -1.853 1.00 0.00 C ATOM 0 H ALA A 423 -1.064 -10.794 0.298 1.00 0.00 H new ATOM 0 HA ALA A 423 1.023 -9.354 -0.814 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.538 -8.992 -2.694 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.606 -10.665 -2.091 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.891 -9.512 -1.661 1.00 0.00 H new ATOM 950 N GLY A 424 -1.412 -7.443 0.294 1.00 0.00 N ATOM 951 CA GLY A 424 -1.732 -6.073 0.642 1.00 0.00 C ATOM 952 C GLY A 424 -0.730 -5.486 1.613 1.00 0.00 C ATOM 953 O GLY A 424 -0.270 -4.358 1.436 1.00 0.00 O ATOM 0 H GLY A 424 -2.123 -8.128 0.550 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.759 -5.466 -0.263 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.729 -6.034 1.082 1.00 0.00 H new ATOM 957 N ILE A 425 -0.382 -6.259 2.637 1.00 0.00 N ATOM 958 CA ILE A 425 0.581 -5.814 3.634 1.00 0.00 C ATOM 959 C ILE A 425 1.967 -5.682 3.013 1.00 0.00 C ATOM 960 O ILE A 425 2.762 -4.835 3.420 1.00 0.00 O ATOM 961 CB ILE A 425 0.646 -6.789 4.828 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.720 -6.892 5.504 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.704 -6.344 5.829 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.926 -8.188 6.257 1.00 0.00 C ATOM 0 H ILE A 425 -0.753 -7.196 2.797 1.00 0.00 H new ATOM 0 HA ILE A 425 0.250 -4.841 3.998 1.00 0.00 H new ATOM 0 HB ILE A 425 0.924 -7.774 4.453 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.838 -6.057 6.195 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.499 -6.793 4.748 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.733 -7.045 6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.679 -6.319 5.341 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.458 -5.349 6.200 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.917 -8.191 6.711 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.840 -9.027 5.567 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.169 -8.280 7.036 1.00 0.00 H new ATOM 976 N ARG A 426 2.247 -6.524 2.023 1.00 0.00 N ATOM 977 CA ARG A 426 3.535 -6.500 1.343 1.00 0.00 C ATOM 978 C ARG A 426 3.669 -5.247 0.491 1.00 0.00 C ATOM 979 O ARG A 426 4.678 -4.544 0.556 1.00 0.00 O ATOM 980 CB ARG A 426 3.704 -7.748 0.474 1.00 0.00 C ATOM 981 CG ARG A 426 5.154 -8.089 0.173 1.00 0.00 C ATOM 982 CD ARG A 426 5.901 -8.508 1.429 1.00 0.00 C ATOM 983 NE ARG A 426 5.300 -9.682 2.058 1.00 0.00 N ATOM 984 CZ ARG A 426 5.826 -10.315 3.104 1.00 0.00 C ATOM 985 NH1 ARG A 426 6.963 -9.889 3.643 1.00 0.00 N ATOM 986 NH2 ARG A 426 5.215 -11.375 3.615 1.00 0.00 N ATOM 0 H ARG A 426 1.599 -7.231 1.675 1.00 0.00 H new ATOM 0 HA ARG A 426 4.320 -6.490 2.100 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.237 -8.596 0.976 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.172 -7.601 -0.466 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.195 -8.894 -0.561 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.647 -7.225 -0.273 1.00 0.00 H new ATOM 0 HD2 ARG A 426 6.940 -8.723 1.178 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.909 -7.681 2.139 1.00 0.00 H new ATOM 0 HE ARG A 426 4.425 -10.038 1.672 1.00 0.00 H new ATOM 0 HH11 ARG A 426 7.437 -9.073 3.255 1.00 0.00 H new ATOM 0 HH12 ARG A 426 7.362 -10.378 4.445 1.00 0.00 H new ATOM 0 HH21 ARG A 426 4.341 -11.706 3.206 1.00 0.00 H new ATOM 0 HH22 ARG A 426 5.619 -11.859 4.417 1.00 0.00 H new ATOM 998 N ALA A 427 2.641 -4.965 -0.301 1.00 0.00 N ATOM 999 CA ALA A 427 2.645 -3.785 -1.157 1.00 0.00 C ATOM 1000 C ALA A 427 2.769 -2.524 -0.316 1.00 0.00 C ATOM 1001 O ALA A 427 3.591 -1.651 -0.598 1.00 0.00 O ATOM 1002 CB ALA A 427 1.386 -3.734 -2.011 1.00 0.00 C ATOM 0 H ALA A 427 1.798 -5.535 -0.368 1.00 0.00 H new ATOM 0 HA ALA A 427 3.506 -3.846 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.410 -2.845 -2.642 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.336 -4.624 -2.639 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.509 -3.696 -1.365 1.00 0.00 H new ATOM 1008 N ALA A 428 1.954 -2.444 0.726 1.00 0.00 N ATOM 1009 CA ALA A 428 1.972 -1.299 1.623 1.00 0.00 C ATOM 1010 C ALA A 428 3.325 -1.180 2.306 1.00 0.00 C ATOM 1011 O ALA A 428 3.889 -0.092 2.406 1.00 0.00 O ATOM 1012 CB ALA A 428 0.866 -1.419 2.658 1.00 0.00 C ATOM 0 H ALA A 428 1.271 -3.161 0.971 1.00 0.00 H new ATOM 0 HA ALA A 428 1.801 -0.397 1.035 1.00 0.00 H new ATOM 0 HB1 ALA A 428 0.893 -0.555 3.321 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -0.100 -1.460 2.155 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.011 -2.328 3.241 1.00 0.00 H new ATOM 1018 N GLU A 429 3.845 -2.311 2.766 1.00 0.00 N ATOM 1019 CA GLU A 429 5.139 -2.335 3.432 1.00 0.00 C ATOM 1020 C GLU A 429 6.227 -1.845 2.486 1.00 0.00 C ATOM 1021 O GLU A 429 7.141 -1.127 2.891 1.00 0.00 O ATOM 1022 CB GLU A 429 5.463 -3.746 3.924 1.00 0.00 C ATOM 1023 CG GLU A 429 5.051 -3.990 5.365 1.00 0.00 C ATOM 1024 CD GLU A 429 5.599 -5.292 5.917 1.00 0.00 C ATOM 1025 OE1 GLU A 429 6.837 -5.454 5.936 1.00 0.00 O ATOM 1026 OE2 GLU A 429 4.789 -6.150 6.327 1.00 0.00 O ATOM 0 H GLU A 429 3.391 -3.221 2.690 1.00 0.00 H new ATOM 0 HA GLU A 429 5.096 -1.669 4.294 1.00 0.00 H new ATOM 0 HB2 GLU A 429 4.962 -4.471 3.283 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.534 -3.920 3.825 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.399 -3.163 5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 429 3.963 -4.001 5.431 1.00 0.00 H new ATOM 1033 N ASN A 430 6.109 -2.227 1.220 1.00 0.00 N ATOM 1034 CA ASN A 430 7.069 -1.816 0.206 1.00 0.00 C ATOM 1035 C ASN A 430 7.055 -0.300 0.059 1.00 0.00 C ATOM 1036 O ASN A 430 8.083 0.322 -0.209 1.00 0.00 O ATOM 1037 CB ASN A 430 6.744 -2.481 -1.135 1.00 0.00 C ATOM 1038 CG ASN A 430 7.695 -3.615 -1.463 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.637 -4.685 -0.857 1.00 0.00 O ATOM 1040 ND2 ASN A 430 8.578 -3.387 -2.429 1.00 0.00 N ATOM 0 H ASN A 430 5.357 -2.821 0.872 1.00 0.00 H new ATOM 0 HA ASN A 430 8.065 -2.131 0.517 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.723 -2.862 -1.110 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.786 -1.734 -1.928 1.00 0.00 H new ATOM 0 HD21 ASN A 430 9.243 -4.114 -2.694 1.00 0.00 H new ATOM 0 HD22 ASN A 430 8.591 -2.485 -2.905 1.00 0.00 H new ATOM 1047 N ALA A 431 5.876 0.288 0.242 1.00 0.00 N ATOM 1048 CA ALA A 431 5.713 1.731 0.140 1.00 0.00 C ATOM 1049 C ALA A 431 6.335 2.437 1.339 1.00 0.00 C ATOM 1050 O ALA A 431 6.926 3.509 1.205 1.00 0.00 O ATOM 1051 CB ALA A 431 4.237 2.085 0.020 1.00 0.00 C ATOM 0 H ALA A 431 5.018 -0.217 0.462 1.00 0.00 H new ATOM 0 HA ALA A 431 6.231 2.072 -0.757 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.127 3.167 -0.056 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.821 1.615 -0.871 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.704 1.727 0.901 1.00 0.00 H new ATOM 1057 N LEU A 432 6.198 1.829 2.514 1.00 0.00 N ATOM 1058 CA LEU A 432 6.747 2.399 3.739 1.00 0.00 C ATOM 1059 C LEU A 432 8.270 2.285 3.765 1.00 0.00 C ATOM 1060 O LEU A 432 8.946 3.050 4.452 1.00 0.00 O ATOM 1061 CB LEU A 432 6.152 1.699 4.962 1.00 0.00 C ATOM 1062 CG LEU A 432 4.623 1.662 5.006 1.00 0.00 C ATOM 1063 CD1 LEU A 432 4.142 0.689 6.069 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.066 3.054 5.261 1.00 0.00 C ATOM 0 H LEU A 432 5.711 0.942 2.643 1.00 0.00 H new ATOM 0 HA LEU A 432 6.482 3.456 3.766 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.526 0.676 4.994 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.514 2.199 5.860 1.00 0.00 H new ATOM 0 HG LEU A 432 4.258 1.317 4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 432 3.052 0.677 6.085 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.513 -0.311 5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.516 1.002 7.044 1.00 0.00 H new ATOM 0 HD21 LEU A 432 2.977 3.011 5.289 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.439 3.426 6.215 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.382 3.724 4.462 1.00 0.00 H new ATOM 1076 N ARG A 433 8.804 1.325 3.015 1.00 0.00 N ATOM 1077 CA ARG A 433 10.247 1.113 2.957 1.00 0.00 C ATOM 1078 C ARG A 433 10.967 2.372 2.487 1.00 0.00 C ATOM 1079 O ARG A 433 11.952 2.798 3.089 1.00 0.00 O ATOM 1080 CB ARG A 433 10.576 -0.054 2.024 1.00 0.00 C ATOM 1081 CG ARG A 433 10.255 -1.416 2.617 1.00 0.00 C ATOM 1082 CD ARG A 433 11.379 -1.912 3.513 1.00 0.00 C ATOM 1083 NE ARG A 433 11.061 -3.198 4.129 1.00 0.00 N ATOM 1084 CZ ARG A 433 11.685 -3.682 5.201 1.00 0.00 C ATOM 1085 NH1 ARG A 433 12.661 -2.990 5.778 1.00 0.00 N ATOM 1086 NH2 ARG A 433 11.333 -4.860 5.698 1.00 0.00 N ATOM 0 H ARG A 433 8.260 0.682 2.440 1.00 0.00 H new ATOM 0 HA ARG A 433 10.592 0.874 3.963 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.021 0.068 1.094 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.635 -0.018 1.770 1.00 0.00 H new ATOM 0 HG2 ARG A 433 9.330 -1.355 3.191 1.00 0.00 H new ATOM 0 HG3 ARG A 433 10.085 -2.133 1.814 1.00 0.00 H new ATOM 0 HD2 ARG A 433 12.294 -2.007 2.928 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.574 -1.175 4.292 1.00 0.00 H new ATOM 0 HE ARG A 433 10.317 -3.758 3.713 1.00 0.00 H new ATOM 0 HH11 ARG A 433 12.936 -2.083 5.400 1.00 0.00 H new ATOM 0 HH12 ARG A 433 13.136 -3.365 6.599 1.00 0.00 H new ATOM 0 HH21 ARG A 433 10.584 -5.396 5.259 1.00 0.00 H new ATOM 0 HH22 ARG A 433 11.811 -5.231 6.519 1.00 0.00 H new ATOM 1098 N ASP A 434 10.468 2.962 1.409 1.00 0.00 N ATOM 1099 CA ASP A 434 11.060 4.173 0.854 1.00 0.00 C ATOM 1100 C ASP A 434 10.919 5.340 1.826 1.00 0.00 C ATOM 1101 O ASP A 434 10.035 6.183 1.674 1.00 0.00 O ATOM 1102 CB ASP A 434 10.403 4.522 -0.482 1.00 0.00 C ATOM 1103 CG ASP A 434 11.125 3.900 -1.661 1.00 0.00 C ATOM 1104 OD1 ASP A 434 12.370 3.992 -1.711 1.00 0.00 O ATOM 1105 OD2 ASP A 434 10.445 3.322 -2.536 1.00 0.00 O ATOM 0 H ASP A 434 9.653 2.621 0.900 1.00 0.00 H new ATOM 0 HA ASP A 434 12.121 3.987 0.689 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.367 4.183 -0.474 1.00 0.00 H new ATOM 0 HB3 ASP A 434 10.383 5.605 -0.602 1.00 0.00 H new ATOM 1110 N LYS A 435 11.794 5.381 2.825 1.00 0.00 N ATOM 1111 CA LYS A 435 11.768 6.442 3.827 1.00 0.00 C ATOM 1112 C LYS A 435 11.846 7.818 3.174 1.00 0.00 C ATOM 1113 O LYS A 435 11.202 8.765 3.623 1.00 0.00 O ATOM 1114 CB LYS A 435 12.923 6.269 4.815 1.00 0.00 C ATOM 1115 CG LYS A 435 12.726 7.024 6.120 1.00 0.00 C ATOM 1116 CD LYS A 435 13.140 6.187 7.322 1.00 0.00 C ATOM 1117 CE LYS A 435 14.169 6.910 8.177 1.00 0.00 C ATOM 1118 NZ LYS A 435 13.796 8.332 8.412 1.00 0.00 N ATOM 0 H LYS A 435 12.532 4.690 2.963 1.00 0.00 H new ATOM 0 HA LYS A 435 10.823 6.371 4.365 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.047 5.208 5.034 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.846 6.608 4.345 1.00 0.00 H new ATOM 0 HG2 LYS A 435 13.309 7.945 6.099 1.00 0.00 H new ATOM 0 HG3 LYS A 435 11.679 7.312 6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 435 12.262 5.956 7.925 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.552 5.237 6.981 1.00 0.00 H new ATOM 0 HE2 LYS A 435 14.270 6.398 9.134 1.00 0.00 H new ATOM 0 HE3 LYS A 435 15.142 6.866 7.688 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 14.213 8.657 9.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 14.154 8.918 7.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 12.761 8.416 8.461 1.00 0.00 H new ATOM 1132 N LYS A 436 12.634 7.919 2.111 1.00 0.00 N ATOM 1133 CA LYS A 436 12.791 9.177 1.394 1.00 0.00 C ATOM 1134 C LYS A 436 11.453 9.651 0.847 1.00 0.00 C ATOM 1135 O LYS A 436 10.944 10.702 1.235 1.00 0.00 O ATOM 1136 CB LYS A 436 13.790 9.012 0.251 1.00 0.00 C ATOM 1137 CG LYS A 436 15.138 8.468 0.694 1.00 0.00 C ATOM 1138 CD LYS A 436 15.257 6.980 0.405 1.00 0.00 C ATOM 1139 CE LYS A 436 16.000 6.254 1.514 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.424 6.005 1.160 1.00 0.00 N ATOM 0 H LYS A 436 13.174 7.144 1.727 1.00 0.00 H new ATOM 0 HA LYS A 436 13.168 9.925 2.092 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.366 8.343 -0.497 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.939 9.977 -0.233 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.935 9.005 0.180 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.271 8.645 1.761 1.00 0.00 H new ATOM 0 HD2 LYS A 436 14.262 6.550 0.290 1.00 0.00 H new ATOM 0 HD3 LYS A 436 15.779 6.833 -0.541 1.00 0.00 H new ATOM 0 HE2 LYS A 436 15.952 6.844 2.429 1.00 0.00 H new ATOM 0 HE3 LYS A 436 15.506 5.304 1.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 17.895 5.508 1.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.471 5.421 0.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 17.903 6.912 0.988 1.00 0.00 H new ATOM 1154 N MET A 437 10.886 8.858 -0.053 1.00 0.00 N ATOM 1155 CA MET A 437 9.600 9.179 -0.656 1.00 0.00 C ATOM 1156 C MET A 437 8.533 9.348 0.422 1.00 0.00 C ATOM 1157 O MET A 437 7.587 10.118 0.259 1.00 0.00 O ATOM 1158 CB MET A 437 9.188 8.081 -1.641 1.00 0.00 C ATOM 1159 CG MET A 437 7.771 8.232 -2.173 1.00 0.00 C ATOM 1160 SD MET A 437 7.704 8.317 -3.973 1.00 0.00 S ATOM 1161 CE MET A 437 7.964 6.598 -4.403 1.00 0.00 C ATOM 0 H MET A 437 11.299 7.985 -0.382 1.00 0.00 H new ATOM 0 HA MET A 437 9.697 10.119 -1.199 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.883 8.080 -2.481 1.00 0.00 H new ATOM 0 HB3 MET A 437 9.280 7.112 -1.150 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.168 7.391 -1.831 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.325 9.134 -1.755 1.00 0.00 H new ATOM 0 HE1 MET A 437 7.809 6.463 -5.473 1.00 0.00 H new ATOM 0 HE2 MET A 437 8.983 6.308 -4.145 1.00 0.00 H new ATOM 0 HE3 MET A 437 7.259 5.975 -3.853 1.00 0.00 H new ATOM 1171 N LEU A 438 8.699 8.627 1.526 1.00 0.00 N ATOM 1172 CA LEU A 438 7.755 8.703 2.633 1.00 0.00 C ATOM 1173 C LEU A 438 7.924 10.016 3.387 1.00 0.00 C ATOM 1174 O LEU A 438 6.948 10.624 3.827 1.00 0.00 O ATOM 1175 CB LEU A 438 7.951 7.522 3.587 1.00 0.00 C ATOM 1176 CG LEU A 438 6.680 7.035 4.281 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.994 8.185 5.003 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.736 6.395 3.274 1.00 0.00 C ATOM 0 H LEU A 438 9.477 7.985 1.677 1.00 0.00 H new ATOM 0 HA LEU A 438 6.745 8.660 2.225 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.383 6.691 3.029 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.677 7.806 4.349 1.00 0.00 H new ATOM 0 HG LEU A 438 6.956 6.282 5.019 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.091 7.820 5.492 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.669 8.599 5.751 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.730 8.960 4.284 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.836 6.054 3.785 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.466 7.127 2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.229 5.545 2.802 1.00 0.00 H new ATOM 1190 N ASP A 439 9.172 10.449 3.528 1.00 0.00 N ATOM 1191 CA ASP A 439 9.474 11.694 4.222 1.00 0.00 C ATOM 1192 C ASP A 439 8.878 12.881 3.475 1.00 0.00 C ATOM 1193 O ASP A 439 8.390 13.832 4.085 1.00 0.00 O ATOM 1194 CB ASP A 439 10.988 11.870 4.364 1.00 0.00 C ATOM 1195 CG ASP A 439 11.384 12.387 5.733 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.924 13.486 6.108 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.154 11.693 6.429 1.00 0.00 O ATOM 0 H ASP A 439 9.990 9.956 3.171 1.00 0.00 H new ATOM 0 HA ASP A 439 9.029 11.649 5.216 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.481 10.915 4.183 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.344 12.562 3.601 1.00 0.00 H new ATOM 1202 N PHE A 440 8.918 12.814 2.149 1.00 0.00 N ATOM 1203 CA PHE A 440 8.379 13.878 1.311 1.00 0.00 C ATOM 1204 C PHE A 440 6.890 14.069 1.574 1.00 0.00 C ATOM 1205 O PHE A 440 6.408 15.196 1.686 1.00 0.00 O ATOM 1206 CB PHE A 440 8.607 13.558 -0.163 1.00 0.00 C ATOM 1207 CG PHE A 440 8.485 14.755 -1.064 1.00 0.00 C ATOM 1208 CD1 PHE A 440 9.237 15.894 -0.828 1.00 0.00 C ATOM 1209 CD2 PHE A 440 7.617 14.740 -2.144 1.00 0.00 C ATOM 1210 CE1 PHE A 440 9.126 16.997 -1.653 1.00 0.00 C ATOM 1211 CE2 PHE A 440 7.503 15.839 -2.973 1.00 0.00 C ATOM 1212 CZ PHE A 440 8.258 16.969 -2.727 1.00 0.00 C ATOM 0 H PHE A 440 9.319 12.032 1.631 1.00 0.00 H new ATOM 0 HA PHE A 440 8.899 14.803 1.560 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.599 13.123 -0.283 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.888 12.802 -0.478 1.00 0.00 H new ATOM 0 HD1 PHE A 440 9.918 15.920 0.010 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.023 13.859 -2.340 1.00 0.00 H new ATOM 0 HE1 PHE A 440 9.717 17.880 -1.458 1.00 0.00 H new ATOM 0 HE2 PHE A 440 6.824 15.815 -3.813 1.00 0.00 H new ATOM 0 HZ PHE A 440 8.170 17.830 -3.374 1.00 0.00 H new ATOM 1222 N TYR A 441 6.167 12.959 1.677 1.00 0.00 N ATOM 1223 CA TYR A 441 4.736 13.003 1.934 1.00 0.00 C ATOM 1224 C TYR A 441 4.478 13.243 3.408 1.00 0.00 C ATOM 1225 O TYR A 441 3.603 14.022 3.776 1.00 0.00 O ATOM 1226 CB TYR A 441 4.073 11.701 1.492 1.00 0.00 C ATOM 1227 CG TYR A 441 3.731 11.666 0.020 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.649 11.205 -0.916 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.491 12.093 -0.432 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.338 11.173 -2.262 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.171 12.064 -1.774 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.098 11.603 -2.686 1.00 0.00 C ATOM 1233 OH TYR A 441 2.785 11.573 -4.025 1.00 0.00 O ATOM 0 H TYR A 441 6.551 12.018 1.586 1.00 0.00 H new ATOM 0 HA TYR A 441 4.306 13.824 1.360 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.738 10.868 1.722 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.162 11.552 2.072 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.620 10.867 -0.586 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.763 12.455 0.279 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.062 10.813 -2.978 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.201 12.400 -2.108 1.00 0.00 H new ATOM 0 HH TYR A 441 3.271 10.840 -4.458 1.00 0.00 H new ATOM 1243 N ALA A 442 5.256 12.580 4.251 1.00 0.00 N ATOM 1244 CA ALA A 442 5.115 12.738 5.689 1.00 0.00 C ATOM 1245 C ALA A 442 5.238 14.208 6.082 1.00 0.00 C ATOM 1246 O ALA A 442 4.676 14.641 7.088 1.00 0.00 O ATOM 1247 CB ALA A 442 6.148 11.898 6.423 1.00 0.00 C ATOM 0 H ALA A 442 5.988 11.930 3.965 1.00 0.00 H new ATOM 0 HA ALA A 442 4.123 12.389 5.977 1.00 0.00 H new ATOM 0 HB1 ALA A 442 6.027 12.030 7.498 1.00 0.00 H new ATOM 0 HB2 ALA A 442 6.010 10.847 6.168 1.00 0.00 H new ATOM 0 HB3 ALA A 442 7.149 12.214 6.130 1.00 0.00 H new ATOM 1253 N LYS A 443 5.964 14.974 5.270 1.00 0.00 N ATOM 1254 CA LYS A 443 6.144 16.399 5.525 1.00 0.00 C ATOM 1255 C LYS A 443 5.026 17.213 4.872 1.00 0.00 C ATOM 1256 O LYS A 443 4.975 18.434 5.006 1.00 0.00 O ATOM 1257 CB LYS A 443 7.506 16.867 5.008 1.00 0.00 C ATOM 1258 CG LYS A 443 8.197 17.862 5.926 1.00 0.00 C ATOM 1259 CD LYS A 443 8.824 17.170 7.125 1.00 0.00 C ATOM 1260 CE LYS A 443 7.854 17.087 8.292 1.00 0.00 C ATOM 1261 NZ LYS A 443 8.530 17.333 9.595 1.00 0.00 N ATOM 0 H LYS A 443 6.435 14.632 4.433 1.00 0.00 H new ATOM 0 HA LYS A 443 6.103 16.558 6.603 1.00 0.00 H new ATOM 0 HB2 LYS A 443 8.152 15.999 4.875 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.376 17.321 4.026 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.966 18.398 5.370 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.476 18.604 6.269 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.141 16.166 6.842 1.00 0.00 H new ATOM 0 HD3 LYS A 443 9.718 17.712 7.432 1.00 0.00 H new ATOM 0 HE2 LYS A 443 7.056 17.817 8.154 1.00 0.00 H new ATOM 0 HE3 LYS A 443 7.386 16.103 8.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 7.834 17.267 10.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 9.274 16.621 9.740 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 8.955 18.282 9.592 1.00 0.00 H new ATOM 1275 N GLN A 444 4.128 16.521 4.176 1.00 0.00 N ATOM 1276 CA GLN A 444 3.004 17.165 3.516 1.00 0.00 C ATOM 1277 C GLN A 444 1.700 16.712 4.158 1.00 0.00 C ATOM 1278 O GLN A 444 0.824 17.522 4.451 1.00 0.00 O ATOM 1279 CB GLN A 444 3.000 16.840 2.021 1.00 0.00 C ATOM 1280 CG GLN A 444 4.178 17.434 1.267 1.00 0.00 C ATOM 1281 CD GLN A 444 4.259 18.942 1.407 1.00 0.00 C ATOM 1282 OE1 GLN A 444 5.250 19.479 1.903 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.212 19.634 0.971 1.00 0.00 N ATOM 0 H GLN A 444 4.161 15.509 4.056 1.00 0.00 H new ATOM 0 HA GLN A 444 3.101 18.245 3.631 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.006 15.758 1.893 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.074 17.208 1.580 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.102 16.988 1.635 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.097 17.175 0.211 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.412 19.148 0.567 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.208 20.652 1.040 1.00 0.00 H new ATOM 1292 N ARG A 445 1.592 15.409 4.387 1.00 0.00 N ATOM 1293 CA ARG A 445 0.408 14.836 5.015 1.00 0.00 C ATOM 1294 C ARG A 445 0.291 15.313 6.456 1.00 0.00 C ATOM 1295 O ARG A 445 -0.746 15.827 6.873 1.00 0.00 O ATOM 1296 CB ARG A 445 0.475 13.305 4.975 1.00 0.00 C ATOM 1297 CG ARG A 445 -0.865 12.633 4.721 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.928 13.105 5.701 1.00 0.00 C ATOM 1299 NE ARG A 445 -1.793 12.463 7.006 1.00 0.00 N ATOM 1300 CZ ARG A 445 -2.781 12.369 7.893 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -3.978 12.876 7.623 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -2.572 11.765 9.055 1.00 0.00 N ATOM 0 H ARG A 445 2.312 14.728 4.146 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.472 15.166 4.462 1.00 0.00 H new ATOM 0 HB2 ARG A 445 1.175 13.003 4.196 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.877 12.944 5.922 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.190 12.844 3.702 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -0.751 11.552 4.801 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.857 14.186 5.820 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -2.916 12.893 5.293 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.888 12.063 7.252 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -4.145 13.341 6.731 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -4.730 12.800 8.308 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -1.655 11.373 9.268 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -3.328 11.692 9.735 1.00 0.00 H new ATOM 1314 N ALA A 446 1.372 15.141 7.204 1.00 0.00 N ATOM 1315 CA ALA A 446 1.414 15.555 8.601 1.00 0.00 C ATOM 1316 C ALA A 446 1.464 17.074 8.717 1.00 0.00 C ATOM 1317 O ALA A 446 1.043 17.645 9.723 1.00 0.00 O ATOM 1318 CB ALA A 446 2.617 14.935 9.295 1.00 0.00 C ATOM 0 H ALA A 446 2.235 14.716 6.866 1.00 0.00 H new ATOM 0 HA ALA A 446 0.504 15.206 9.089 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.638 15.251 10.338 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.545 13.848 9.247 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.531 15.260 8.799 1.00 0.00 H new