USER MOD reduce.3.24.130724 H: found=0, std=0, add=677, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 677 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 428 THR OG1 : rot -161:sc= -0.482 USER MOD Set 1.2: A 431 GLN : amide:sc=-0.00471 X(o=-0.49,f=-0.49) USER MOD Single : A 379 SER OG : rot 180:sc= 0 USER MOD Single : A 381 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 382 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0157) USER MOD Single : A 385 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 389 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 391 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 392 TYR OH : rot 180:sc= 0 USER MOD Single : A 395 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 403 LYS NZ :NH3+ -175:sc= 1.11 (180deg=0.919) USER MOD Single : A 404 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 405 THR OG1 : rot -23:sc= 1.14 USER MOD Single : A 407 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 409 TYR OH : rot 66:sc= 0.109 USER MOD Single : A 415 MET CE :methyl 146:sc=-0.00106 (180deg=-0.429) USER MOD Single : A 417 THR OG1 : rot 90:sc= 1.27 USER MOD Single : A 418 LYS NZ :NH3+ 153:sc= 0.161 (180deg=0.0147) USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD Single : A 436 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 439 LYS NZ :NH3+ 166:sc= -0.012 (180deg=-0.17) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 444 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 446 GLN : amide:sc= -0.154 X(o=-0.15,f=-0.0013) USER MOD Single : A 451 LYS NZ :NH3+ -112:sc= 0.21 (180deg=-3.79!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 455 LYS NZ :NH3+ -162:sc= -0.509 (180deg=-1.3) USER MOD ----------------------------------------------------------------- ATOM 112 N SER A 379 4.544 23.694 -4.916 1.00 0.00 N ATOM 113 CA SER A 379 4.648 22.691 -3.860 1.00 0.00 C ATOM 114 C SER A 379 3.482 21.718 -3.900 1.00 0.00 C ATOM 115 O SER A 379 3.610 20.567 -3.483 1.00 0.00 O ATOM 116 CB SER A 379 4.739 23.357 -2.486 1.00 0.00 C ATOM 117 OG SER A 379 3.487 23.894 -2.095 1.00 0.00 O ATOM 0 HA SER A 379 5.563 22.125 -4.035 1.00 0.00 H new ATOM 0 HB2 SER A 379 5.073 22.629 -1.747 1.00 0.00 H new ATOM 0 HB3 SER A 379 5.486 24.150 -2.512 1.00 0.00 H new ATOM 0 HG SER A 379 3.572 24.313 -1.213 1.00 0.00 H new ATOM 123 N ILE A 380 2.359 22.166 -4.430 1.00 0.00 N ATOM 124 CA ILE A 380 1.194 21.314 -4.554 1.00 0.00 C ATOM 125 C ILE A 380 1.544 20.092 -5.396 1.00 0.00 C ATOM 126 O ILE A 380 0.978 19.015 -5.219 1.00 0.00 O ATOM 127 CB ILE A 380 -0.001 22.066 -5.176 1.00 0.00 C ATOM 128 CG1 ILE A 380 -0.454 23.182 -4.235 1.00 0.00 C ATOM 129 CG2 ILE A 380 -1.153 21.112 -5.462 1.00 0.00 C ATOM 130 CD1 ILE A 380 -0.970 22.676 -2.906 1.00 0.00 C ATOM 0 H ILE A 380 2.230 23.115 -4.781 1.00 0.00 H new ATOM 0 HA ILE A 380 0.896 20.999 -3.554 1.00 0.00 H new ATOM 0 HB ILE A 380 0.316 22.503 -6.123 1.00 0.00 H new ATOM 0 HG12 ILE A 380 0.382 23.859 -4.058 1.00 0.00 H new ATOM 0 HG13 ILE A 380 -1.237 23.763 -4.723 1.00 0.00 H new ATOM 0 HG21 ILE A 380 -1.984 21.665 -5.900 1.00 0.00 H new ATOM 0 HG22 ILE A 380 -0.823 20.341 -6.159 1.00 0.00 H new ATOM 0 HG23 ILE A 380 -1.478 20.645 -4.532 1.00 0.00 H new ATOM 0 HD11 ILE A 380 -1.274 23.521 -2.288 1.00 0.00 H new ATOM 0 HD12 ILE A 380 -1.826 22.022 -3.073 1.00 0.00 H new ATOM 0 HD13 ILE A 380 -0.182 22.120 -2.398 1.00 0.00 H new ATOM 142 N LYS A 381 2.489 20.277 -6.317 1.00 0.00 N ATOM 143 CA LYS A 381 2.927 19.199 -7.196 1.00 0.00 C ATOM 144 C LYS A 381 3.417 18.002 -6.385 1.00 0.00 C ATOM 145 O LYS A 381 3.257 16.854 -6.798 1.00 0.00 O ATOM 146 CB LYS A 381 4.038 19.690 -8.126 1.00 0.00 C ATOM 147 CG LYS A 381 3.580 20.758 -9.107 1.00 0.00 C ATOM 148 CD LYS A 381 4.573 20.933 -10.244 1.00 0.00 C ATOM 149 CE LYS A 381 3.879 21.356 -11.529 1.00 0.00 C ATOM 150 NZ LYS A 381 3.677 22.831 -11.591 1.00 0.00 N ATOM 0 H LYS A 381 2.965 21.166 -6.472 1.00 0.00 H new ATOM 0 HA LYS A 381 2.074 18.884 -7.797 1.00 0.00 H new ATOM 0 HB2 LYS A 381 4.856 20.087 -7.524 1.00 0.00 H new ATOM 0 HB3 LYS A 381 4.435 18.842 -8.684 1.00 0.00 H new ATOM 0 HG2 LYS A 381 2.605 20.487 -9.512 1.00 0.00 H new ATOM 0 HG3 LYS A 381 3.455 21.705 -8.583 1.00 0.00 H new ATOM 0 HD2 LYS A 381 5.316 21.681 -9.968 1.00 0.00 H new ATOM 0 HD3 LYS A 381 5.108 19.998 -10.409 1.00 0.00 H new ATOM 0 HE2 LYS A 381 4.472 21.034 -12.385 1.00 0.00 H new ATOM 0 HE3 LYS A 381 2.914 20.854 -11.603 1.00 0.00 H new ATOM 0 HZ1 LYS A 381 3.201 23.079 -12.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 381 3.090 23.135 -10.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 381 4.599 23.310 -11.546 1.00 0.00 H new ATOM 164 N LYS A 382 4.012 18.277 -5.229 1.00 0.00 N ATOM 165 CA LYS A 382 4.518 17.216 -4.366 1.00 0.00 C ATOM 166 C LYS A 382 3.376 16.391 -3.801 1.00 0.00 C ATOM 167 O LYS A 382 3.471 15.170 -3.686 1.00 0.00 O ATOM 168 CB LYS A 382 5.367 17.797 -3.233 1.00 0.00 C ATOM 169 CG LYS A 382 6.824 18.009 -3.613 1.00 0.00 C ATOM 170 CD LYS A 382 7.160 19.487 -3.752 1.00 0.00 C ATOM 171 CE LYS A 382 8.067 19.964 -2.629 1.00 0.00 C ATOM 172 NZ LYS A 382 7.651 21.295 -2.105 1.00 0.00 N ATOM 0 H LYS A 382 4.155 19.221 -4.869 1.00 0.00 H new ATOM 0 HA LYS A 382 5.149 16.563 -4.969 1.00 0.00 H new ATOM 0 HB2 LYS A 382 4.939 18.750 -2.921 1.00 0.00 H new ATOM 0 HB3 LYS A 382 5.318 17.129 -2.373 1.00 0.00 H new ATOM 0 HG2 LYS A 382 7.467 17.559 -2.856 1.00 0.00 H new ATOM 0 HG3 LYS A 382 7.033 17.498 -4.553 1.00 0.00 H new ATOM 0 HD2 LYS A 382 7.646 19.661 -4.712 1.00 0.00 H new ATOM 0 HD3 LYS A 382 6.240 20.071 -3.750 1.00 0.00 H new ATOM 0 HE2 LYS A 382 8.055 19.235 -1.819 1.00 0.00 H new ATOM 0 HE3 LYS A 382 9.093 20.021 -2.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 382 8.334 21.615 -1.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 382 7.621 21.982 -2.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 382 6.707 21.219 -1.675 1.00 0.00 H new ATOM 186 N ILE A 383 2.293 17.068 -3.475 1.00 0.00 N ATOM 187 CA ILE A 383 1.111 16.400 -2.945 1.00 0.00 C ATOM 188 C ILE A 383 0.592 15.401 -3.967 1.00 0.00 C ATOM 189 O ILE A 383 0.105 14.324 -3.621 1.00 0.00 O ATOM 190 CB ILE A 383 -0.009 17.405 -2.603 1.00 0.00 C ATOM 191 CG1 ILE A 383 0.512 18.486 -1.655 1.00 0.00 C ATOM 192 CG2 ILE A 383 -1.200 16.685 -1.988 1.00 0.00 C ATOM 193 CD1 ILE A 383 -0.433 19.656 -1.495 1.00 0.00 C ATOM 0 H ILE A 383 2.203 18.080 -3.566 1.00 0.00 H new ATOM 0 HA ILE A 383 1.400 15.889 -2.026 1.00 0.00 H new ATOM 0 HB ILE A 383 -0.335 17.885 -3.526 1.00 0.00 H new ATOM 0 HG12 ILE A 383 0.696 18.042 -0.677 1.00 0.00 H new ATOM 0 HG13 ILE A 383 1.470 18.851 -2.025 1.00 0.00 H new ATOM 0 HG21 ILE A 383 -1.981 17.408 -1.753 1.00 0.00 H new ATOM 0 HG22 ILE A 383 -1.586 15.951 -2.695 1.00 0.00 H new ATOM 0 HG23 ILE A 383 -0.887 16.179 -1.075 1.00 0.00 H new ATOM 0 HD11 ILE A 383 0.001 20.383 -0.809 1.00 0.00 H new ATOM 0 HD12 ILE A 383 -0.598 20.125 -2.465 1.00 0.00 H new ATOM 0 HD13 ILE A 383 -1.384 19.304 -1.096 1.00 0.00 H new ATOM 205 N ILE A 384 0.733 15.767 -5.235 1.00 0.00 N ATOM 206 CA ILE A 384 0.315 14.911 -6.341 1.00 0.00 C ATOM 207 C ILE A 384 1.312 13.781 -6.505 1.00 0.00 C ATOM 208 O ILE A 384 0.943 12.618 -6.673 1.00 0.00 O ATOM 209 CB ILE A 384 0.245 15.678 -7.681 1.00 0.00 C ATOM 210 CG1 ILE A 384 0.193 17.187 -7.455 1.00 0.00 C ATOM 211 CG2 ILE A 384 -0.956 15.225 -8.495 1.00 0.00 C ATOM 212 CD1 ILE A 384 -0.959 17.628 -6.577 1.00 0.00 C ATOM 0 H ILE A 384 1.137 16.658 -5.525 1.00 0.00 H new ATOM 0 HA ILE A 384 -0.680 14.538 -6.100 1.00 0.00 H new ATOM 0 HB ILE A 384 1.153 15.452 -8.240 1.00 0.00 H new ATOM 0 HG12 ILE A 384 1.130 17.511 -7.001 1.00 0.00 H new ATOM 0 HG13 ILE A 384 0.116 17.688 -8.420 1.00 0.00 H new ATOM 0 HG21 ILE A 384 -0.988 15.777 -9.435 1.00 0.00 H new ATOM 0 HG22 ILE A 384 -0.873 14.158 -8.703 1.00 0.00 H new ATOM 0 HG23 ILE A 384 -1.870 15.415 -7.932 1.00 0.00 H new ATOM 0 HD11 ILE A 384 -0.933 18.711 -6.460 1.00 0.00 H new ATOM 0 HD12 ILE A 384 -1.902 17.335 -7.039 1.00 0.00 H new ATOM 0 HD13 ILE A 384 -0.873 17.155 -5.599 1.00 0.00 H new ATOM 224 N HIS A 385 2.585 14.148 -6.448 1.00 0.00 N ATOM 225 CA HIS A 385 3.669 13.183 -6.581 1.00 0.00 C ATOM 226 C HIS A 385 3.555 12.106 -5.502 1.00 0.00 C ATOM 227 O HIS A 385 3.712 10.916 -5.778 1.00 0.00 O ATOM 228 CB HIS A 385 5.023 13.903 -6.505 1.00 0.00 C ATOM 229 CG HIS A 385 6.111 13.113 -5.843 1.00 0.00 C ATOM 230 ND1 HIS A 385 6.814 12.148 -6.522 1.00 0.00 N ATOM 231 CD2 HIS A 385 6.572 13.187 -4.573 1.00 0.00 C ATOM 232 CE1 HIS A 385 7.683 11.659 -5.656 1.00 0.00 C ATOM 233 NE2 HIS A 385 7.573 12.257 -4.459 1.00 0.00 N ATOM 0 H HIS A 385 2.894 15.110 -6.310 1.00 0.00 H new ATOM 0 HA HIS A 385 3.596 12.694 -7.552 1.00 0.00 H new ATOM 0 HB2 HIS A 385 5.341 14.159 -7.516 1.00 0.00 H new ATOM 0 HB3 HIS A 385 4.892 14.840 -5.965 1.00 0.00 H new ATOM 0 HD2 HIS A 385 6.219 13.851 -3.798 1.00 0.00 H new ATOM 0 HE1 HIS A 385 8.393 10.877 -5.882 1.00 0.00 H new ATOM 0 HE2 HIS A 385 8.127 12.058 -3.626 1.00 0.00 H new ATOM 241 N VAL A 386 3.271 12.532 -4.275 1.00 0.00 N ATOM 242 CA VAL A 386 3.126 11.603 -3.160 1.00 0.00 C ATOM 243 C VAL A 386 1.852 10.780 -3.309 1.00 0.00 C ATOM 244 O VAL A 386 1.853 9.570 -3.083 1.00 0.00 O ATOM 245 CB VAL A 386 3.098 12.340 -1.808 1.00 0.00 C ATOM 246 CG1 VAL A 386 3.052 11.347 -0.656 1.00 0.00 C ATOM 247 CG2 VAL A 386 4.300 13.262 -1.676 1.00 0.00 C ATOM 0 H VAL A 386 3.137 13.513 -4.028 1.00 0.00 H new ATOM 0 HA VAL A 386 3.993 10.942 -3.178 1.00 0.00 H new ATOM 0 HB VAL A 386 2.195 12.949 -1.769 1.00 0.00 H new ATOM 0 HG11 VAL A 386 3.033 11.888 0.290 1.00 0.00 H new ATOM 0 HG12 VAL A 386 2.156 10.732 -0.741 1.00 0.00 H new ATOM 0 HG13 VAL A 386 3.935 10.708 -0.691 1.00 0.00 H new ATOM 0 HG21 VAL A 386 4.262 13.774 -0.714 1.00 0.00 H new ATOM 0 HG22 VAL A 386 5.217 12.676 -1.739 1.00 0.00 H new ATOM 0 HG23 VAL A 386 4.284 13.998 -2.480 1.00 0.00 H new ATOM 257 N LEU A 387 0.766 11.443 -3.697 1.00 0.00 N ATOM 258 CA LEU A 387 -0.510 10.765 -3.882 1.00 0.00 C ATOM 259 C LEU A 387 -0.425 9.786 -5.043 1.00 0.00 C ATOM 260 O LEU A 387 -1.020 8.710 -5.006 1.00 0.00 O ATOM 261 CB LEU A 387 -1.628 11.781 -4.127 1.00 0.00 C ATOM 262 CG LEU A 387 -3.031 11.304 -3.739 1.00 0.00 C ATOM 263 CD1 LEU A 387 -3.511 12.017 -2.484 1.00 0.00 C ATOM 264 CD2 LEU A 387 -4.008 11.524 -4.885 1.00 0.00 C ATOM 0 H LEU A 387 0.745 12.445 -3.888 1.00 0.00 H new ATOM 0 HA LEU A 387 -0.740 10.210 -2.972 1.00 0.00 H new ATOM 0 HB2 LEU A 387 -1.402 12.689 -3.569 1.00 0.00 H new ATOM 0 HB3 LEU A 387 -1.631 12.048 -5.184 1.00 0.00 H new ATOM 0 HG LEU A 387 -2.983 10.235 -3.530 1.00 0.00 H new ATOM 0 HD11 LEU A 387 -4.509 11.665 -2.225 1.00 0.00 H new ATOM 0 HD12 LEU A 387 -2.827 11.807 -1.662 1.00 0.00 H new ATOM 0 HD13 LEU A 387 -3.541 13.091 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A 387 -4.999 11.179 -4.590 1.00 0.00 H new ATOM 0 HD22 LEU A 387 -4.051 12.586 -5.128 1.00 0.00 H new ATOM 0 HD23 LEU A 387 -3.675 10.965 -5.760 1.00 0.00 H new ATOM 276 N GLU A 388 0.337 10.151 -6.064 1.00 0.00 N ATOM 277 CA GLU A 388 0.517 9.286 -7.218 1.00 0.00 C ATOM 278 C GLU A 388 1.201 7.997 -6.781 1.00 0.00 C ATOM 279 O GLU A 388 0.918 6.915 -7.299 1.00 0.00 O ATOM 280 CB GLU A 388 1.352 9.988 -8.291 1.00 0.00 C ATOM 281 CG GLU A 388 1.113 9.456 -9.695 1.00 0.00 C ATOM 282 CD GLU A 388 1.926 10.192 -10.742 1.00 0.00 C ATOM 283 OE1 GLU A 388 1.734 11.417 -10.891 1.00 0.00 O ATOM 284 OE2 GLU A 388 2.754 9.542 -11.415 1.00 0.00 O ATOM 0 H GLU A 388 0.839 11.038 -6.116 1.00 0.00 H new ATOM 0 HA GLU A 388 -0.459 9.053 -7.644 1.00 0.00 H new ATOM 0 HB2 GLU A 388 1.128 11.055 -8.273 1.00 0.00 H new ATOM 0 HB3 GLU A 388 2.408 9.880 -8.046 1.00 0.00 H new ATOM 0 HG2 GLU A 388 1.363 8.395 -9.725 1.00 0.00 H new ATOM 0 HG3 GLU A 388 0.054 9.541 -9.937 1.00 0.00 H new ATOM 291 N LYS A 389 2.099 8.129 -5.807 1.00 0.00 N ATOM 292 CA LYS A 389 2.828 6.989 -5.273 1.00 0.00 C ATOM 293 C LYS A 389 1.882 6.046 -4.536 1.00 0.00 C ATOM 294 O LYS A 389 1.990 4.826 -4.653 1.00 0.00 O ATOM 295 CB LYS A 389 3.935 7.465 -4.330 1.00 0.00 C ATOM 296 CG LYS A 389 5.238 6.695 -4.481 1.00 0.00 C ATOM 297 CD LYS A 389 6.447 7.616 -4.392 1.00 0.00 C ATOM 298 CE LYS A 389 7.343 7.252 -3.219 1.00 0.00 C ATOM 299 NZ LYS A 389 6.869 7.863 -1.947 1.00 0.00 N ATOM 0 H LYS A 389 2.337 9.020 -5.372 1.00 0.00 H new ATOM 0 HA LYS A 389 3.280 6.448 -6.104 1.00 0.00 H new ATOM 0 HB2 LYS A 389 4.125 8.523 -4.511 1.00 0.00 H new ATOM 0 HB3 LYS A 389 3.587 7.375 -3.301 1.00 0.00 H new ATOM 0 HG2 LYS A 389 5.303 5.933 -3.705 1.00 0.00 H new ATOM 0 HG3 LYS A 389 5.245 6.176 -5.439 1.00 0.00 H new ATOM 0 HD2 LYS A 389 7.018 7.558 -5.319 1.00 0.00 H new ATOM 0 HD3 LYS A 389 6.112 8.648 -4.288 1.00 0.00 H new ATOM 0 HE2 LYS A 389 7.376 6.168 -3.111 1.00 0.00 H new ATOM 0 HE3 LYS A 389 8.361 7.583 -3.423 1.00 0.00 H new ATOM 0 HZ1 LYS A 389 7.507 7.591 -1.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 389 6.861 8.899 -2.041 1.00 0.00 H new ATOM 0 HZ3 LYS A 389 5.907 7.527 -1.738 1.00 0.00 H new ATOM 313 N VAL A 390 0.951 6.622 -3.779 1.00 0.00 N ATOM 314 CA VAL A 390 -0.014 5.831 -3.030 1.00 0.00 C ATOM 315 C VAL A 390 -0.906 5.030 -3.977 1.00 0.00 C ATOM 316 O VAL A 390 -1.291 3.899 -3.677 1.00 0.00 O ATOM 317 CB VAL A 390 -0.874 6.708 -2.080 1.00 0.00 C ATOM 318 CG1 VAL A 390 -1.973 7.464 -2.822 1.00 0.00 C ATOM 319 CG2 VAL A 390 -1.464 5.855 -0.967 1.00 0.00 C ATOM 0 H VAL A 390 0.847 7.631 -3.670 1.00 0.00 H new ATOM 0 HA VAL A 390 0.551 5.136 -2.408 1.00 0.00 H new ATOM 0 HB VAL A 390 -0.214 7.458 -1.644 1.00 0.00 H new ATOM 0 HG11 VAL A 390 -2.546 8.062 -2.113 1.00 0.00 H new ATOM 0 HG12 VAL A 390 -1.524 8.118 -3.569 1.00 0.00 H new ATOM 0 HG13 VAL A 390 -2.636 6.752 -3.314 1.00 0.00 H new ATOM 0 HG21 VAL A 390 -2.065 6.482 -0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 390 -2.092 5.076 -1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 390 -0.658 5.395 -0.395 1.00 0.00 H new ATOM 329 N GLN A 391 -1.223 5.624 -5.124 1.00 0.00 N ATOM 330 CA GLN A 391 -2.060 4.970 -6.120 1.00 0.00 C ATOM 331 C GLN A 391 -1.386 3.704 -6.636 1.00 0.00 C ATOM 332 O GLN A 391 -2.035 2.674 -6.824 1.00 0.00 O ATOM 333 CB GLN A 391 -2.340 5.926 -7.280 1.00 0.00 C ATOM 334 CG GLN A 391 -3.815 6.230 -7.480 1.00 0.00 C ATOM 335 CD GLN A 391 -4.050 7.291 -8.531 1.00 0.00 C ATOM 336 OE1 GLN A 391 -4.141 6.996 -9.723 1.00 0.00 O ATOM 337 NE2 GLN A 391 -4.148 8.537 -8.090 1.00 0.00 N ATOM 0 H GLN A 391 -0.911 6.559 -5.385 1.00 0.00 H new ATOM 0 HA GLN A 391 -3.005 4.694 -5.652 1.00 0.00 H new ATOM 0 HB2 GLN A 391 -1.806 6.860 -7.106 1.00 0.00 H new ATOM 0 HB3 GLN A 391 -1.939 5.496 -8.198 1.00 0.00 H new ATOM 0 HG2 GLN A 391 -4.335 5.316 -7.768 1.00 0.00 H new ATOM 0 HG3 GLN A 391 -4.247 6.558 -6.534 1.00 0.00 H new ATOM 0 HE21 GLN A 391 -4.066 8.733 -7.092 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -4.306 9.300 -8.748 1.00 0.00 H new ATOM 346 N TYR A 392 -0.078 3.788 -6.854 1.00 0.00 N ATOM 347 CA TYR A 392 0.689 2.648 -7.341 1.00 0.00 C ATOM 348 C TYR A 392 0.808 1.583 -6.258 1.00 0.00 C ATOM 349 O TYR A 392 0.793 0.386 -6.544 1.00 0.00 O ATOM 350 CB TYR A 392 2.082 3.094 -7.792 1.00 0.00 C ATOM 351 CG TYR A 392 2.841 2.032 -8.556 1.00 0.00 C ATOM 352 CD1 TYR A 392 3.288 0.878 -7.922 1.00 0.00 C ATOM 353 CD2 TYR A 392 3.112 2.184 -9.910 1.00 0.00 C ATOM 354 CE1 TYR A 392 3.983 -0.093 -8.617 1.00 0.00 C ATOM 355 CE2 TYR A 392 3.806 1.216 -10.611 1.00 0.00 C ATOM 356 CZ TYR A 392 4.240 0.080 -9.961 1.00 0.00 C ATOM 357 OH TYR A 392 4.932 -0.884 -10.655 1.00 0.00 O ATOM 0 H TYR A 392 0.472 4.633 -6.701 1.00 0.00 H new ATOM 0 HA TYR A 392 0.163 2.222 -8.195 1.00 0.00 H new ATOM 0 HB2 TYR A 392 1.985 3.981 -8.418 1.00 0.00 H new ATOM 0 HB3 TYR A 392 2.662 3.384 -6.916 1.00 0.00 H new ATOM 0 HD1 TYR A 392 3.089 0.739 -6.870 1.00 0.00 H new ATOM 0 HD2 TYR A 392 2.775 3.073 -10.423 1.00 0.00 H new ATOM 0 HE1 TYR A 392 4.324 -0.984 -8.110 1.00 0.00 H new ATOM 0 HE2 TYR A 392 4.008 1.349 -11.664 1.00 0.00 H new ATOM 0 HH TYR A 392 5.027 -0.608 -11.591 1.00 0.00 H new ATOM 367 N LEU A 393 0.921 2.029 -5.010 1.00 0.00 N ATOM 368 CA LEU A 393 1.037 1.116 -3.881 1.00 0.00 C ATOM 369 C LEU A 393 -0.242 0.301 -3.719 1.00 0.00 C ATOM 370 O LEU A 393 -0.197 -0.889 -3.405 1.00 0.00 O ATOM 371 CB LEU A 393 1.333 1.895 -2.595 1.00 0.00 C ATOM 372 CG LEU A 393 2.665 1.554 -1.926 1.00 0.00 C ATOM 373 CD1 LEU A 393 2.946 2.513 -0.779 1.00 0.00 C ATOM 374 CD2 LEU A 393 2.659 0.116 -1.433 1.00 0.00 C ATOM 0 H LEU A 393 0.935 3.017 -4.757 1.00 0.00 H new ATOM 0 HA LEU A 393 1.863 0.432 -4.075 1.00 0.00 H new ATOM 0 HB2 LEU A 393 1.320 2.961 -2.822 1.00 0.00 H new ATOM 0 HB3 LEU A 393 0.528 1.711 -1.883 1.00 0.00 H new ATOM 0 HG LEU A 393 3.460 1.661 -2.664 1.00 0.00 H new ATOM 0 HD11 LEU A 393 3.898 2.256 -0.314 1.00 0.00 H new ATOM 0 HD12 LEU A 393 2.993 3.533 -1.161 1.00 0.00 H new ATOM 0 HD13 LEU A 393 2.149 2.439 -0.039 1.00 0.00 H new ATOM 0 HD21 LEU A 393 3.614 -0.110 -0.960 1.00 0.00 H new ATOM 0 HD22 LEU A 393 1.855 -0.017 -0.709 1.00 0.00 H new ATOM 0 HD23 LEU A 393 2.504 -0.557 -2.276 1.00 0.00 H new ATOM 386 N GLU A 394 -1.380 0.950 -3.941 1.00 0.00 N ATOM 387 CA GLU A 394 -2.673 0.288 -3.825 1.00 0.00 C ATOM 388 C GLU A 394 -2.782 -0.854 -4.831 1.00 0.00 C ATOM 389 O GLU A 394 -3.191 -1.962 -4.485 1.00 0.00 O ATOM 390 CB GLU A 394 -3.807 1.291 -4.048 1.00 0.00 C ATOM 391 CG GLU A 394 -5.176 0.755 -3.662 1.00 0.00 C ATOM 392 CD GLU A 394 -6.180 0.844 -4.796 1.00 0.00 C ATOM 393 OE1 GLU A 394 -5.778 0.645 -5.961 1.00 0.00 O ATOM 394 OE2 GLU A 394 -7.367 1.113 -4.518 1.00 0.00 O ATOM 0 H GLU A 394 -1.433 1.935 -4.202 1.00 0.00 H new ATOM 0 HA GLU A 394 -2.758 -0.123 -2.819 1.00 0.00 H new ATOM 0 HB2 GLU A 394 -3.603 2.193 -3.470 1.00 0.00 H new ATOM 0 HB3 GLU A 394 -3.823 1.582 -5.098 1.00 0.00 H new ATOM 0 HG2 GLU A 394 -5.080 -0.284 -3.348 1.00 0.00 H new ATOM 0 HG3 GLU A 394 -5.552 1.313 -2.805 1.00 0.00 H new ATOM 401 N GLN A 395 -2.407 -0.575 -6.074 1.00 0.00 N ATOM 402 CA GLN A 395 -2.458 -1.580 -7.128 1.00 0.00 C ATOM 403 C GLN A 395 -1.517 -2.737 -6.812 1.00 0.00 C ATOM 404 O GLN A 395 -1.789 -3.886 -7.163 1.00 0.00 O ATOM 405 CB GLN A 395 -2.086 -0.956 -8.475 1.00 0.00 C ATOM 406 CG GLN A 395 -2.309 -1.885 -9.656 1.00 0.00 C ATOM 407 CD GLN A 395 -1.882 -1.265 -10.972 1.00 0.00 C ATOM 408 OE1 GLN A 395 -2.718 -0.885 -11.794 1.00 0.00 O ATOM 409 NE2 GLN A 395 -0.575 -1.159 -11.180 1.00 0.00 N ATOM 0 H GLN A 395 -2.065 0.337 -6.376 1.00 0.00 H new ATOM 0 HA GLN A 395 -3.476 -1.965 -7.185 1.00 0.00 H new ATOM 0 HB2 GLN A 395 -2.673 -0.049 -8.621 1.00 0.00 H new ATOM 0 HB3 GLN A 395 -1.038 -0.657 -8.451 1.00 0.00 H new ATOM 0 HG2 GLN A 395 -1.754 -2.809 -9.497 1.00 0.00 H new ATOM 0 HG3 GLN A 395 -3.364 -2.152 -9.710 1.00 0.00 H new ATOM 0 HE21 GLN A 395 0.082 -1.487 -10.472 1.00 0.00 H new ATOM 0 HE22 GLN A 395 -0.228 -0.750 -12.048 1.00 0.00 H new ATOM 418 N GLU A 396 -0.411 -2.426 -6.145 1.00 0.00 N ATOM 419 CA GLU A 396 0.571 -3.438 -5.774 1.00 0.00 C ATOM 420 C GLU A 396 0.012 -4.371 -4.705 1.00 0.00 C ATOM 421 O GLU A 396 0.261 -5.576 -4.724 1.00 0.00 O ATOM 422 CB GLU A 396 1.856 -2.772 -5.274 1.00 0.00 C ATOM 423 CG GLU A 396 3.056 -3.009 -6.178 1.00 0.00 C ATOM 424 CD GLU A 396 4.129 -3.852 -5.517 1.00 0.00 C ATOM 425 OE1 GLU A 396 3.872 -5.047 -5.262 1.00 0.00 O ATOM 426 OE2 GLU A 396 5.226 -3.316 -5.252 1.00 0.00 O ATOM 0 H GLU A 396 -0.172 -1.479 -5.850 1.00 0.00 H new ATOM 0 HA GLU A 396 0.801 -4.030 -6.660 1.00 0.00 H new ATOM 0 HB2 GLU A 396 1.687 -1.699 -5.182 1.00 0.00 H new ATOM 0 HB3 GLU A 396 2.084 -3.145 -4.276 1.00 0.00 H new ATOM 0 HG2 GLU A 396 2.725 -3.501 -7.093 1.00 0.00 H new ATOM 0 HG3 GLU A 396 3.482 -2.049 -6.469 1.00 0.00 H new ATOM 433 N VAL A 397 -0.748 -3.803 -3.772 1.00 0.00 N ATOM 434 CA VAL A 397 -1.345 -4.583 -2.694 1.00 0.00 C ATOM 435 C VAL A 397 -2.282 -5.649 -3.250 1.00 0.00 C ATOM 436 O VAL A 397 -2.286 -6.788 -2.784 1.00 0.00 O ATOM 437 CB VAL A 397 -2.128 -3.684 -1.718 1.00 0.00 C ATOM 438 CG1 VAL A 397 -2.576 -4.480 -0.502 1.00 0.00 C ATOM 439 CG2 VAL A 397 -1.287 -2.485 -1.301 1.00 0.00 C ATOM 0 H VAL A 397 -0.964 -2.807 -3.742 1.00 0.00 H new ATOM 0 HA VAL A 397 -0.528 -5.063 -2.155 1.00 0.00 H new ATOM 0 HB VAL A 397 -3.017 -3.313 -2.229 1.00 0.00 H new ATOM 0 HG11 VAL A 397 -3.127 -3.829 0.176 1.00 0.00 H new ATOM 0 HG12 VAL A 397 -3.219 -5.300 -0.821 1.00 0.00 H new ATOM 0 HG13 VAL A 397 -1.703 -4.882 0.011 1.00 0.00 H new ATOM 0 HG21 VAL A 397 -1.858 -1.862 -0.612 1.00 0.00 H new ATOM 0 HG22 VAL A 397 -0.378 -2.832 -0.809 1.00 0.00 H new ATOM 0 HG23 VAL A 397 -1.023 -1.902 -2.183 1.00 0.00 H new ATOM 449 N GLU A 398 -3.073 -5.277 -4.254 1.00 0.00 N ATOM 450 CA GLU A 398 -4.010 -6.209 -4.873 1.00 0.00 C ATOM 451 C GLU A 398 -3.277 -7.452 -5.369 1.00 0.00 C ATOM 452 O GLU A 398 -3.806 -8.562 -5.320 1.00 0.00 O ATOM 453 CB GLU A 398 -4.744 -5.534 -6.035 1.00 0.00 C ATOM 454 CG GLU A 398 -6.230 -5.853 -6.084 1.00 0.00 C ATOM 455 CD GLU A 398 -6.956 -5.076 -7.166 1.00 0.00 C ATOM 456 OE1 GLU A 398 -6.806 -3.837 -7.209 1.00 0.00 O ATOM 457 OE2 GLU A 398 -7.674 -5.707 -7.969 1.00 0.00 O ATOM 0 H GLU A 398 -3.083 -4.339 -4.655 1.00 0.00 H new ATOM 0 HA GLU A 398 -4.741 -6.510 -4.123 1.00 0.00 H new ATOM 0 HB2 GLU A 398 -4.615 -4.454 -5.957 1.00 0.00 H new ATOM 0 HB3 GLU A 398 -4.283 -5.843 -6.973 1.00 0.00 H new ATOM 0 HG2 GLU A 398 -6.363 -6.921 -6.257 1.00 0.00 H new ATOM 0 HG3 GLU A 398 -6.679 -5.628 -5.116 1.00 0.00 H new ATOM 464 N GLU A 399 -2.048 -7.252 -5.831 1.00 0.00 N ATOM 465 CA GLU A 399 -1.222 -8.348 -6.321 1.00 0.00 C ATOM 466 C GLU A 399 -0.503 -9.023 -5.160 1.00 0.00 C ATOM 467 O GLU A 399 -0.596 -10.236 -4.976 1.00 0.00 O ATOM 468 CB GLU A 399 -0.197 -7.824 -7.326 1.00 0.00 C ATOM 469 CG GLU A 399 0.339 -8.894 -8.262 1.00 0.00 C ATOM 470 CD GLU A 399 1.172 -8.316 -9.389 1.00 0.00 C ATOM 471 OE1 GLU A 399 1.814 -7.265 -9.175 1.00 0.00 O ATOM 472 OE2 GLU A 399 1.183 -8.913 -10.486 1.00 0.00 O ATOM 0 H GLU A 399 -1.600 -6.337 -5.876 1.00 0.00 H new ATOM 0 HA GLU A 399 -1.866 -9.077 -6.814 1.00 0.00 H new ATOM 0 HB2 GLU A 399 -0.654 -7.031 -7.918 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.636 -7.377 -6.783 1.00 0.00 H new ATOM 0 HG2 GLU A 399 0.944 -9.600 -7.693 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.495 -9.455 -8.682 1.00 0.00 H new ATOM 479 N PHE A 400 0.215 -8.208 -4.389 1.00 0.00 N ATOM 480 CA PHE A 400 0.974 -8.663 -3.229 1.00 0.00 C ATOM 481 C PHE A 400 0.392 -9.915 -2.592 1.00 0.00 C ATOM 482 O PHE A 400 -0.686 -9.885 -1.997 1.00 0.00 O ATOM 483 CB PHE A 400 1.025 -7.553 -2.187 1.00 0.00 C ATOM 484 CG PHE A 400 1.936 -7.843 -1.041 1.00 0.00 C ATOM 485 CD1 PHE A 400 3.282 -8.049 -1.262 1.00 0.00 C ATOM 486 CD2 PHE A 400 1.450 -7.900 0.250 1.00 0.00 C ATOM 487 CE1 PHE A 400 4.138 -8.311 -0.208 1.00 0.00 C ATOM 488 CE2 PHE A 400 2.294 -8.160 1.310 1.00 0.00 C ATOM 489 CZ PHE A 400 3.642 -8.366 1.082 1.00 0.00 C ATOM 0 H PHE A 400 0.286 -7.204 -4.555 1.00 0.00 H new ATOM 0 HA PHE A 400 1.974 -8.913 -3.583 1.00 0.00 H new ATOM 0 HB2 PHE A 400 1.346 -6.630 -2.669 1.00 0.00 H new ATOM 0 HB3 PHE A 400 0.019 -7.380 -1.804 1.00 0.00 H new ATOM 0 HD1 PHE A 400 3.671 -8.005 -2.268 1.00 0.00 H new ATOM 0 HD2 PHE A 400 0.398 -7.739 0.432 1.00 0.00 H new ATOM 0 HE1 PHE A 400 5.190 -8.472 -0.391 1.00 0.00 H new ATOM 0 HE2 PHE A 400 1.903 -8.203 2.316 1.00 0.00 H new ATOM 0 HZ PHE A 400 4.306 -8.569 1.909 1.00 0.00 H new ATOM 499 N VAL A 401 1.133 -11.006 -2.694 1.00 0.00 N ATOM 500 CA VAL A 401 0.719 -12.264 -2.103 1.00 0.00 C ATOM 501 C VAL A 401 1.542 -12.533 -0.849 1.00 0.00 C ATOM 502 O VAL A 401 1.751 -13.683 -0.464 1.00 0.00 O ATOM 503 CB VAL A 401 0.881 -13.436 -3.092 1.00 0.00 C ATOM 504 CG1 VAL A 401 2.344 -13.631 -3.466 1.00 0.00 C ATOM 505 CG2 VAL A 401 0.295 -14.713 -2.511 1.00 0.00 C ATOM 0 H VAL A 401 2.027 -11.044 -3.183 1.00 0.00 H new ATOM 0 HA VAL A 401 -0.337 -12.186 -1.846 1.00 0.00 H new ATOM 0 HB VAL A 401 0.331 -13.193 -4.001 1.00 0.00 H new ATOM 0 HG11 VAL A 401 2.433 -14.463 -4.164 1.00 0.00 H new ATOM 0 HG12 VAL A 401 2.724 -12.723 -3.933 1.00 0.00 H new ATOM 0 HG13 VAL A 401 2.923 -13.847 -2.568 1.00 0.00 H new ATOM 0 HG21 VAL A 401 0.419 -15.528 -3.224 1.00 0.00 H new ATOM 0 HG22 VAL A 401 0.811 -14.961 -1.583 1.00 0.00 H new ATOM 0 HG23 VAL A 401 -0.766 -14.567 -2.308 1.00 0.00 H new ATOM 515 N GLY A 402 2.019 -11.455 -0.220 1.00 0.00 N ATOM 516 CA GLY A 402 2.823 -11.594 0.970 1.00 0.00 C ATOM 517 C GLY A 402 2.123 -12.346 2.075 1.00 0.00 C ATOM 518 O GLY A 402 1.057 -12.929 1.875 1.00 0.00 O ATOM 0 H GLY A 402 1.858 -10.493 -0.520 1.00 0.00 H new ATOM 0 HA2 GLY A 402 3.749 -12.111 0.717 1.00 0.00 H new ATOM 0 HA3 GLY A 402 3.100 -10.604 1.332 1.00 0.00 H new ATOM 522 N LYS A 403 2.734 -12.324 3.245 1.00 0.00 N ATOM 523 CA LYS A 403 2.182 -13.004 4.419 1.00 0.00 C ATOM 524 C LYS A 403 2.228 -12.111 5.655 1.00 0.00 C ATOM 525 O LYS A 403 3.167 -11.345 5.845 1.00 0.00 O ATOM 526 CB LYS A 403 2.925 -14.315 4.687 1.00 0.00 C ATOM 527 CG LYS A 403 2.649 -15.390 3.648 1.00 0.00 C ATOM 528 CD LYS A 403 3.605 -15.284 2.470 1.00 0.00 C ATOM 529 CE LYS A 403 4.687 -16.351 2.531 1.00 0.00 C ATOM 530 NZ LYS A 403 5.686 -16.189 1.440 1.00 0.00 N ATOM 0 H LYS A 403 3.617 -11.842 3.415 1.00 0.00 H new ATOM 0 HA LYS A 403 1.138 -13.230 4.204 1.00 0.00 H new ATOM 0 HB2 LYS A 403 3.996 -14.117 4.718 1.00 0.00 H new ATOM 0 HB3 LYS A 403 2.642 -14.690 5.671 1.00 0.00 H new ATOM 0 HG2 LYS A 403 2.743 -16.374 4.107 1.00 0.00 H new ATOM 0 HG3 LYS A 403 1.622 -15.300 3.294 1.00 0.00 H new ATOM 0 HD2 LYS A 403 3.048 -15.382 1.538 1.00 0.00 H new ATOM 0 HD3 LYS A 403 4.067 -14.297 2.463 1.00 0.00 H new ATOM 0 HE2 LYS A 403 5.192 -16.302 3.496 1.00 0.00 H new ATOM 0 HE3 LYS A 403 4.229 -17.338 2.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 6.358 -16.982 1.464 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 5.198 -16.176 0.522 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 6.201 -15.295 1.571 1.00 0.00 H new ATOM 544 N LYS A 404 1.205 -12.222 6.496 1.00 0.00 N ATOM 545 CA LYS A 404 1.114 -11.429 7.720 1.00 0.00 C ATOM 546 C LYS A 404 2.423 -11.442 8.512 1.00 0.00 C ATOM 547 O LYS A 404 2.742 -10.478 9.208 1.00 0.00 O ATOM 548 CB LYS A 404 -0.029 -11.948 8.598 1.00 0.00 C ATOM 549 CG LYS A 404 -1.069 -10.891 8.934 1.00 0.00 C ATOM 550 CD LYS A 404 -1.067 -10.556 10.417 1.00 0.00 C ATOM 551 CE LYS A 404 -1.827 -9.270 10.700 1.00 0.00 C ATOM 552 NZ LYS A 404 -1.853 -8.949 12.154 1.00 0.00 N ATOM 0 H LYS A 404 0.421 -12.858 6.352 1.00 0.00 H new ATOM 0 HA LYS A 404 0.915 -10.398 7.427 1.00 0.00 H new ATOM 0 HB2 LYS A 404 -0.519 -12.778 8.089 1.00 0.00 H new ATOM 0 HB3 LYS A 404 0.387 -12.343 9.525 1.00 0.00 H new ATOM 0 HG2 LYS A 404 -0.871 -9.988 8.356 1.00 0.00 H new ATOM 0 HG3 LYS A 404 -2.057 -11.246 8.642 1.00 0.00 H new ATOM 0 HD2 LYS A 404 -1.517 -11.376 10.977 1.00 0.00 H new ATOM 0 HD3 LYS A 404 -0.040 -10.457 10.767 1.00 0.00 H new ATOM 0 HE2 LYS A 404 -1.364 -8.447 10.155 1.00 0.00 H new ATOM 0 HE3 LYS A 404 -2.848 -9.363 10.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 404 -2.380 -8.065 12.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 404 -2.317 -9.722 12.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 404 -0.880 -8.835 12.502 1.00 0.00 H new ATOM 566 N THR A 405 3.170 -12.537 8.414 1.00 0.00 N ATOM 567 CA THR A 405 4.433 -12.659 9.138 1.00 0.00 C ATOM 568 C THR A 405 5.626 -12.751 8.188 1.00 0.00 C ATOM 569 O THR A 405 6.720 -13.142 8.596 1.00 0.00 O ATOM 570 CB THR A 405 4.402 -13.883 10.053 1.00 0.00 C ATOM 571 OG1 THR A 405 5.658 -14.071 10.681 1.00 0.00 O ATOM 572 CG2 THR A 405 4.055 -15.165 9.328 1.00 0.00 C ATOM 0 H THR A 405 2.926 -13.348 7.845 1.00 0.00 H new ATOM 0 HA THR A 405 4.553 -11.758 9.739 1.00 0.00 H new ATOM 0 HB THR A 405 3.621 -13.676 10.785 1.00 0.00 H new ATOM 0 HG1 THR A 405 6.358 -13.637 10.150 1.00 0.00 H new ATOM 0 HG21 THR A 405 4.051 -15.994 10.036 1.00 0.00 H new ATOM 0 HG22 THR A 405 3.069 -15.071 8.874 1.00 0.00 H new ATOM 0 HG23 THR A 405 4.795 -15.356 8.551 1.00 0.00 H new ATOM 580 N ASP A 406 5.419 -12.391 6.924 1.00 0.00 N ATOM 581 CA ASP A 406 6.494 -12.440 5.938 1.00 0.00 C ATOM 582 C ASP A 406 7.356 -11.185 6.012 1.00 0.00 C ATOM 583 O ASP A 406 6.875 -10.108 6.366 1.00 0.00 O ATOM 584 CB ASP A 406 5.924 -12.589 4.526 1.00 0.00 C ATOM 585 CG ASP A 406 6.289 -13.918 3.892 1.00 0.00 C ATOM 586 OD1 ASP A 406 6.524 -14.888 4.642 1.00 0.00 O ATOM 587 OD2 ASP A 406 6.339 -13.987 2.646 1.00 0.00 O ATOM 0 H ASP A 406 4.524 -12.065 6.561 1.00 0.00 H new ATOM 0 HA ASP A 406 7.114 -13.307 6.165 1.00 0.00 H new ATOM 0 HB2 ASP A 406 4.839 -12.493 4.563 1.00 0.00 H new ATOM 0 HB3 ASP A 406 6.294 -11.777 3.900 1.00 0.00 H new ATOM 592 N LYS A 407 8.631 -11.328 5.664 1.00 0.00 N ATOM 593 CA LYS A 407 9.552 -10.201 5.679 1.00 0.00 C ATOM 594 C LYS A 407 9.111 -9.147 4.670 1.00 0.00 C ATOM 595 O LYS A 407 9.334 -7.952 4.864 1.00 0.00 O ATOM 596 CB LYS A 407 10.974 -10.669 5.364 1.00 0.00 C ATOM 597 CG LYS A 407 11.718 -11.209 6.575 1.00 0.00 C ATOM 598 CD LYS A 407 12.629 -10.158 7.185 1.00 0.00 C ATOM 599 CE LYS A 407 13.686 -10.786 8.079 1.00 0.00 C ATOM 600 NZ LYS A 407 13.159 -11.079 9.441 1.00 0.00 N ATOM 0 H LYS A 407 9.047 -12.211 5.369 1.00 0.00 H new ATOM 0 HA LYS A 407 9.544 -9.760 6.676 1.00 0.00 H new ATOM 0 HB2 LYS A 407 10.932 -11.444 4.599 1.00 0.00 H new ATOM 0 HB3 LYS A 407 11.537 -9.836 4.943 1.00 0.00 H new ATOM 0 HG2 LYS A 407 11.001 -11.548 7.322 1.00 0.00 H new ATOM 0 HG3 LYS A 407 12.308 -12.078 6.283 1.00 0.00 H new ATOM 0 HD2 LYS A 407 13.114 -9.590 6.391 1.00 0.00 H new ATOM 0 HD3 LYS A 407 12.034 -9.452 7.764 1.00 0.00 H new ATOM 0 HE2 LYS A 407 14.046 -11.708 7.623 1.00 0.00 H new ATOM 0 HE3 LYS A 407 14.541 -10.114 8.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 407 13.910 -11.506 10.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 407 12.839 -10.196 9.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 407 12.359 -11.740 9.369 1.00 0.00 H new ATOM 614 N ALA A 408 8.477 -9.603 3.593 1.00 0.00 N ATOM 615 CA ALA A 408 7.993 -8.707 2.553 1.00 0.00 C ATOM 616 C ALA A 408 6.767 -7.934 3.026 1.00 0.00 C ATOM 617 O ALA A 408 6.617 -6.751 2.729 1.00 0.00 O ATOM 618 CB ALA A 408 7.671 -9.488 1.289 1.00 0.00 C ATOM 0 H ALA A 408 8.287 -10.590 3.420 1.00 0.00 H new ATOM 0 HA ALA A 408 8.782 -7.989 2.330 1.00 0.00 H new ATOM 0 HB1 ALA A 408 7.310 -8.804 0.521 1.00 0.00 H new ATOM 0 HB2 ALA A 408 8.570 -9.992 0.934 1.00 0.00 H new ATOM 0 HB3 ALA A 408 6.902 -10.229 1.505 1.00 0.00 H new ATOM 624 N TYR A 409 5.896 -8.612 3.768 1.00 0.00 N ATOM 625 CA TYR A 409 4.684 -7.987 4.289 1.00 0.00 C ATOM 626 C TYR A 409 5.033 -6.815 5.190 1.00 0.00 C ATOM 627 O TYR A 409 4.431 -5.746 5.097 1.00 0.00 O ATOM 628 CB TYR A 409 3.855 -9.013 5.062 1.00 0.00 C ATOM 629 CG TYR A 409 2.762 -8.410 5.919 1.00 0.00 C ATOM 630 CD1 TYR A 409 3.028 -7.961 7.210 1.00 0.00 C ATOM 631 CD2 TYR A 409 1.465 -8.294 5.438 1.00 0.00 C ATOM 632 CE1 TYR A 409 2.028 -7.414 7.993 1.00 0.00 C ATOM 633 CE2 TYR A 409 0.461 -7.747 6.216 1.00 0.00 C ATOM 634 CZ TYR A 409 0.748 -7.309 7.492 1.00 0.00 C ATOM 635 OH TYR A 409 -0.248 -6.764 8.268 1.00 0.00 O ATOM 0 H TYR A 409 6.007 -9.594 4.022 1.00 0.00 H new ATOM 0 HA TYR A 409 4.097 -7.616 3.449 1.00 0.00 H new ATOM 0 HB2 TYR A 409 3.404 -9.707 4.353 1.00 0.00 H new ATOM 0 HB3 TYR A 409 4.521 -9.596 5.699 1.00 0.00 H new ATOM 0 HD1 TYR A 409 4.030 -8.041 7.605 1.00 0.00 H new ATOM 0 HD2 TYR A 409 1.236 -8.637 4.440 1.00 0.00 H new ATOM 0 HE1 TYR A 409 2.249 -7.071 8.993 1.00 0.00 H new ATOM 0 HE2 TYR A 409 -0.543 -7.663 5.826 1.00 0.00 H new ATOM 0 HH TYR A 409 -0.053 -5.818 8.433 1.00 0.00 H new ATOM 645 N TRP A 410 6.015 -7.018 6.059 1.00 0.00 N ATOM 646 CA TRP A 410 6.442 -5.969 6.967 1.00 0.00 C ATOM 647 C TRP A 410 6.899 -4.759 6.166 1.00 0.00 C ATOM 648 O TRP A 410 6.464 -3.635 6.408 1.00 0.00 O ATOM 649 CB TRP A 410 7.568 -6.483 7.857 1.00 0.00 C ATOM 650 CG TRP A 410 7.277 -6.302 9.306 1.00 0.00 C ATOM 651 CD1 TRP A 410 6.718 -7.209 10.155 1.00 0.00 C ATOM 652 CD2 TRP A 410 7.518 -5.125 10.070 1.00 0.00 C ATOM 653 NE1 TRP A 410 6.596 -6.665 11.409 1.00 0.00 N ATOM 654 CE2 TRP A 410 7.085 -5.381 11.382 1.00 0.00 C ATOM 655 CE3 TRP A 410 8.062 -3.879 9.764 1.00 0.00 C ATOM 656 CZ2 TRP A 410 7.181 -4.430 12.394 1.00 0.00 C ATOM 657 CZ3 TRP A 410 8.159 -2.933 10.766 1.00 0.00 C ATOM 658 CH2 TRP A 410 7.720 -3.213 12.069 1.00 0.00 C ATOM 0 H TRP A 410 6.527 -7.896 6.152 1.00 0.00 H new ATOM 0 HA TRP A 410 5.608 -5.673 7.603 1.00 0.00 H new ATOM 0 HB2 TRP A 410 7.734 -7.541 7.652 1.00 0.00 H new ATOM 0 HB3 TRP A 410 8.492 -5.961 7.607 1.00 0.00 H new ATOM 0 HD1 TRP A 410 6.415 -8.209 9.881 1.00 0.00 H new ATOM 0 HE1 TRP A 410 6.207 -7.136 12.226 1.00 0.00 H new ATOM 0 HE3 TRP A 410 8.401 -3.657 8.763 1.00 0.00 H new ATOM 0 HZ2 TRP A 410 6.843 -4.643 13.397 1.00 0.00 H new ATOM 0 HZ3 TRP A 410 8.579 -1.963 10.543 1.00 0.00 H new ATOM 0 HH2 TRP A 410 7.809 -2.453 12.832 1.00 0.00 H new ATOM 669 N LEU A 411 7.746 -5.024 5.183 1.00 0.00 N ATOM 670 CA LEU A 411 8.249 -3.999 4.289 1.00 0.00 C ATOM 671 C LEU A 411 7.098 -3.419 3.478 1.00 0.00 C ATOM 672 O LEU A 411 7.049 -2.217 3.224 1.00 0.00 O ATOM 673 CB LEU A 411 9.309 -4.584 3.352 1.00 0.00 C ATOM 674 CG LEU A 411 10.745 -4.521 3.878 1.00 0.00 C ATOM 675 CD1 LEU A 411 11.147 -3.083 4.171 1.00 0.00 C ATOM 676 CD2 LEU A 411 10.892 -5.383 5.124 1.00 0.00 C ATOM 0 H LEU A 411 8.103 -5.959 4.985 1.00 0.00 H new ATOM 0 HA LEU A 411 8.708 -3.207 4.880 1.00 0.00 H new ATOM 0 HB2 LEU A 411 9.058 -5.625 3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 411 9.263 -4.054 2.401 1.00 0.00 H new ATOM 0 HG LEU A 411 11.411 -4.910 3.108 1.00 0.00 H new ATOM 0 HD11 LEU A 411 12.171 -3.060 4.544 1.00 0.00 H new ATOM 0 HD12 LEU A 411 11.080 -2.493 3.257 1.00 0.00 H new ATOM 0 HD13 LEU A 411 10.478 -2.664 4.923 1.00 0.00 H new ATOM 0 HD21 LEU A 411 11.919 -5.328 5.486 1.00 0.00 H new ATOM 0 HD22 LEU A 411 10.215 -5.022 5.898 1.00 0.00 H new ATOM 0 HD23 LEU A 411 10.648 -6.417 4.882 1.00 0.00 H new ATOM 688 N LEU A 412 6.161 -4.287 3.080 1.00 0.00 N ATOM 689 CA LEU A 412 5.005 -3.851 2.305 1.00 0.00 C ATOM 690 C LEU A 412 4.222 -2.818 3.104 1.00 0.00 C ATOM 691 O LEU A 412 3.891 -1.743 2.605 1.00 0.00 O ATOM 692 CB LEU A 412 4.104 -5.043 1.970 1.00 0.00 C ATOM 693 CG LEU A 412 3.329 -4.922 0.656 1.00 0.00 C ATOM 694 CD1 LEU A 412 2.587 -3.597 0.590 1.00 0.00 C ATOM 695 CD2 LEU A 412 4.269 -5.069 -0.533 1.00 0.00 C ATOM 0 H LEU A 412 6.184 -5.287 3.282 1.00 0.00 H new ATOM 0 HA LEU A 412 5.350 -3.406 1.372 1.00 0.00 H new ATOM 0 HB2 LEU A 412 4.718 -5.943 1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.391 -5.179 2.783 1.00 0.00 H new ATOM 0 HG LEU A 412 2.595 -5.726 0.616 1.00 0.00 H new ATOM 0 HD11 LEU A 412 2.043 -3.531 -0.352 1.00 0.00 H new ATOM 0 HD12 LEU A 412 1.884 -3.532 1.421 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.301 -2.776 0.654 1.00 0.00 H new ATOM 0 HD21 LEU A 412 3.701 -4.980 -1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 412 5.027 -4.287 -0.496 1.00 0.00 H new ATOM 0 HD23 LEU A 412 4.753 -6.045 -0.496 1.00 0.00 H new ATOM 707 N GLU A 413 3.975 -3.138 4.370 1.00 0.00 N ATOM 708 CA GLU A 413 3.285 -2.226 5.270 1.00 0.00 C ATOM 709 C GLU A 413 4.204 -1.057 5.601 1.00 0.00 C ATOM 710 O GLU A 413 3.758 0.070 5.813 1.00 0.00 O ATOM 711 CB GLU A 413 2.864 -2.952 6.551 1.00 0.00 C ATOM 712 CG GLU A 413 1.362 -2.953 6.784 1.00 0.00 C ATOM 713 CD GLU A 413 0.999 -2.763 8.243 1.00 0.00 C ATOM 714 OE1 GLU A 413 1.352 -1.708 8.810 1.00 0.00 O ATOM 715 OE2 GLU A 413 0.362 -3.670 8.820 1.00 0.00 O ATOM 0 H GLU A 413 4.244 -4.025 4.795 1.00 0.00 H new ATOM 0 HA GLU A 413 2.385 -1.852 4.782 1.00 0.00 H new ATOM 0 HB2 GLU A 413 3.217 -3.982 6.508 1.00 0.00 H new ATOM 0 HB3 GLU A 413 3.355 -2.482 7.403 1.00 0.00 H new ATOM 0 HG2 GLU A 413 0.906 -2.159 6.193 1.00 0.00 H new ATOM 0 HG3 GLU A 413 0.943 -3.895 6.429 1.00 0.00 H new ATOM 722 N GLU A 414 5.501 -1.356 5.646 1.00 0.00 N ATOM 723 CA GLU A 414 6.523 -0.366 5.954 1.00 0.00 C ATOM 724 C GLU A 414 6.580 0.722 4.883 1.00 0.00 C ATOM 725 O GLU A 414 6.627 1.911 5.197 1.00 0.00 O ATOM 726 CB GLU A 414 7.887 -1.054 6.083 1.00 0.00 C ATOM 727 CG GLU A 414 8.499 -0.935 7.470 1.00 0.00 C ATOM 728 CD GLU A 414 9.590 0.115 7.539 1.00 0.00 C ATOM 729 OE1 GLU A 414 10.532 0.046 6.723 1.00 0.00 O ATOM 730 OE2 GLU A 414 9.500 1.007 8.409 1.00 0.00 O ATOM 0 H GLU A 414 5.869 -2.291 5.470 1.00 0.00 H new ATOM 0 HA GLU A 414 6.266 0.110 6.900 1.00 0.00 H new ATOM 0 HB2 GLU A 414 7.778 -2.109 5.832 1.00 0.00 H new ATOM 0 HB3 GLU A 414 8.573 -0.623 5.354 1.00 0.00 H new ATOM 0 HG2 GLU A 414 7.717 -0.688 8.188 1.00 0.00 H new ATOM 0 HG3 GLU A 414 8.910 -1.900 7.766 1.00 0.00 H new ATOM 737 N MET A 415 6.576 0.310 3.618 1.00 0.00 N ATOM 738 CA MET A 415 6.628 1.259 2.511 1.00 0.00 C ATOM 739 C MET A 415 5.397 2.159 2.509 1.00 0.00 C ATOM 740 O MET A 415 5.495 3.361 2.262 1.00 0.00 O ATOM 741 CB MET A 415 6.746 0.523 1.173 1.00 0.00 C ATOM 742 CG MET A 415 5.653 -0.507 0.941 1.00 0.00 C ATOM 743 SD MET A 415 5.614 -1.104 -0.760 1.00 0.00 S ATOM 744 CE MET A 415 7.029 -2.203 -0.765 1.00 0.00 C ATOM 0 H MET A 415 6.538 -0.669 3.335 1.00 0.00 H new ATOM 0 HA MET A 415 7.512 1.883 2.645 1.00 0.00 H new ATOM 0 HB2 MET A 415 6.722 1.253 0.364 1.00 0.00 H new ATOM 0 HB3 MET A 415 7.716 0.027 1.126 1.00 0.00 H new ATOM 0 HG2 MET A 415 5.804 -1.350 1.615 1.00 0.00 H new ATOM 0 HG3 MET A 415 4.687 -0.069 1.191 1.00 0.00 H new ATOM 0 HE1 MET A 415 6.830 -3.049 -1.423 1.00 0.00 H new ATOM 0 HE2 MET A 415 7.907 -1.664 -1.122 1.00 0.00 H new ATOM 0 HE3 MET A 415 7.212 -2.565 0.247 1.00 0.00 H new ATOM 754 N LEU A 416 4.239 1.572 2.794 1.00 0.00 N ATOM 755 CA LEU A 416 2.991 2.327 2.833 1.00 0.00 C ATOM 756 C LEU A 416 3.036 3.378 3.936 1.00 0.00 C ATOM 757 O LEU A 416 2.704 4.542 3.717 1.00 0.00 O ATOM 758 CB LEU A 416 1.809 1.385 3.061 1.00 0.00 C ATOM 759 CG LEU A 416 1.380 0.577 1.834 1.00 0.00 C ATOM 760 CD1 LEU A 416 1.189 -0.885 2.203 1.00 0.00 C ATOM 761 CD2 LEU A 416 0.103 1.149 1.237 1.00 0.00 C ATOM 0 H LEU A 416 4.139 0.578 3.001 1.00 0.00 H new ATOM 0 HA LEU A 416 2.865 2.830 1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 416 2.065 0.692 3.862 1.00 0.00 H new ATOM 0 HB3 LEU A 416 0.958 1.971 3.407 1.00 0.00 H new ATOM 0 HG LEU A 416 2.168 0.644 1.084 1.00 0.00 H new ATOM 0 HD11 LEU A 416 0.884 -1.446 1.320 1.00 0.00 H new ATOM 0 HD12 LEU A 416 2.127 -1.290 2.584 1.00 0.00 H new ATOM 0 HD13 LEU A 416 0.419 -0.969 2.970 1.00 0.00 H new ATOM 0 HD21 LEU A 416 -0.186 0.561 0.366 1.00 0.00 H new ATOM 0 HD22 LEU A 416 -0.694 1.113 1.980 1.00 0.00 H new ATOM 0 HD23 LEU A 416 0.273 2.183 0.937 1.00 0.00 H new ATOM 773 N THR A 417 3.451 2.956 5.123 1.00 0.00 N ATOM 774 CA THR A 417 3.544 3.858 6.264 1.00 0.00 C ATOM 775 C THR A 417 4.597 4.936 6.018 1.00 0.00 C ATOM 776 O THR A 417 4.483 6.054 6.520 1.00 0.00 O ATOM 777 CB THR A 417 3.884 3.074 7.532 1.00 0.00 C ATOM 778 OG1 THR A 417 3.246 1.810 7.526 1.00 0.00 O ATOM 779 CG2 THR A 417 3.478 3.788 8.804 1.00 0.00 C ATOM 0 H THR A 417 3.729 1.995 5.321 1.00 0.00 H new ATOM 0 HA THR A 417 2.577 4.343 6.395 1.00 0.00 H new ATOM 0 HB THR A 417 4.969 2.968 7.524 1.00 0.00 H new ATOM 0 HG1 THR A 417 3.834 1.149 7.104 1.00 0.00 H new ATOM 0 HG21 THR A 417 3.748 3.178 9.666 1.00 0.00 H new ATOM 0 HG22 THR A 417 3.993 4.747 8.863 1.00 0.00 H new ATOM 0 HG23 THR A 417 2.401 3.954 8.800 1.00 0.00 H new ATOM 787 N LYS A 418 5.623 4.591 5.245 1.00 0.00 N ATOM 788 CA LYS A 418 6.698 5.528 4.936 1.00 0.00 C ATOM 789 C LYS A 418 6.170 6.738 4.171 1.00 0.00 C ATOM 790 O LYS A 418 6.484 7.878 4.510 1.00 0.00 O ATOM 791 CB LYS A 418 7.789 4.833 4.119 1.00 0.00 C ATOM 792 CG LYS A 418 8.828 4.124 4.973 1.00 0.00 C ATOM 793 CD LYS A 418 9.940 3.533 4.122 1.00 0.00 C ATOM 794 CE LYS A 418 10.332 2.142 4.599 1.00 0.00 C ATOM 795 NZ LYS A 418 11.781 2.057 4.929 1.00 0.00 N ATOM 0 H LYS A 418 5.732 3.670 4.821 1.00 0.00 H new ATOM 0 HA LYS A 418 7.121 5.875 5.879 1.00 0.00 H new ATOM 0 HB2 LYS A 418 7.325 4.109 3.450 1.00 0.00 H new ATOM 0 HB3 LYS A 418 8.288 5.572 3.492 1.00 0.00 H new ATOM 0 HG2 LYS A 418 9.252 4.827 5.690 1.00 0.00 H new ATOM 0 HG3 LYS A 418 8.349 3.332 5.548 1.00 0.00 H new ATOM 0 HD2 LYS A 418 9.616 3.484 3.082 1.00 0.00 H new ATOM 0 HD3 LYS A 418 10.811 4.188 4.154 1.00 0.00 H new ATOM 0 HE2 LYS A 418 9.743 1.880 5.478 1.00 0.00 H new ATOM 0 HE3 LYS A 418 10.092 1.412 3.826 1.00 0.00 H new ATOM 0 HZ1 LYS A 418 11.932 1.316 5.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 418 12.320 1.825 4.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 418 12.106 2.971 5.305 1.00 0.00 H new ATOM 809 N GLU A 419 5.363 6.488 3.143 1.00 0.00 N ATOM 810 CA GLU A 419 4.797 7.571 2.348 1.00 0.00 C ATOM 811 C GLU A 419 3.883 8.432 3.210 1.00 0.00 C ATOM 812 O GLU A 419 3.814 9.648 3.042 1.00 0.00 O ATOM 813 CB GLU A 419 4.030 7.019 1.143 1.00 0.00 C ATOM 814 CG GLU A 419 2.897 6.077 1.513 1.00 0.00 C ATOM 815 CD GLU A 419 1.804 6.041 0.463 1.00 0.00 C ATOM 816 OE1 GLU A 419 1.413 7.122 -0.024 1.00 0.00 O ATOM 817 OE2 GLU A 419 1.339 4.931 0.128 1.00 0.00 O ATOM 0 H GLU A 419 5.089 5.552 2.844 1.00 0.00 H new ATOM 0 HA GLU A 419 5.615 8.188 1.976 1.00 0.00 H new ATOM 0 HB2 GLU A 419 3.624 7.853 0.570 1.00 0.00 H new ATOM 0 HB3 GLU A 419 4.727 6.494 0.490 1.00 0.00 H new ATOM 0 HG2 GLU A 419 3.295 5.072 1.652 1.00 0.00 H new ATOM 0 HG3 GLU A 419 2.470 6.385 2.467 1.00 0.00 H new ATOM 824 N LEU A 420 3.194 7.788 4.149 1.00 0.00 N ATOM 825 CA LEU A 420 2.295 8.492 5.055 1.00 0.00 C ATOM 826 C LEU A 420 3.098 9.367 6.013 1.00 0.00 C ATOM 827 O LEU A 420 2.657 10.445 6.410 1.00 0.00 O ATOM 828 CB LEU A 420 1.450 7.489 5.847 1.00 0.00 C ATOM 829 CG LEU A 420 -0.058 7.750 5.834 1.00 0.00 C ATOM 830 CD1 LEU A 420 -0.771 6.782 6.764 1.00 0.00 C ATOM 831 CD2 LEU A 420 -0.358 9.191 6.229 1.00 0.00 C ATOM 0 H LEU A 420 3.242 6.781 4.301 1.00 0.00 H new ATOM 0 HA LEU A 420 1.631 9.126 4.467 1.00 0.00 H new ATOM 0 HB2 LEU A 420 1.633 6.491 5.449 1.00 0.00 H new ATOM 0 HB3 LEU A 420 1.793 7.487 6.882 1.00 0.00 H new ATOM 0 HG LEU A 420 -0.426 7.591 4.820 1.00 0.00 H new ATOM 0 HD11 LEU A 420 -1.843 6.980 6.744 1.00 0.00 H new ATOM 0 HD12 LEU A 420 -0.585 5.759 6.437 1.00 0.00 H new ATOM 0 HD13 LEU A 420 -0.397 6.911 7.780 1.00 0.00 H new ATOM 0 HD21 LEU A 420 -1.435 9.356 6.213 1.00 0.00 H new ATOM 0 HD22 LEU A 420 0.024 9.380 7.232 1.00 0.00 H new ATOM 0 HD23 LEU A 420 0.123 9.869 5.524 1.00 0.00 H new ATOM 843 N LEU A 421 4.281 8.886 6.377 1.00 0.00 N ATOM 844 CA LEU A 421 5.159 9.611 7.285 1.00 0.00 C ATOM 845 C LEU A 421 5.738 10.853 6.611 1.00 0.00 C ATOM 846 O LEU A 421 5.991 11.864 7.266 1.00 0.00 O ATOM 847 CB LEU A 421 6.285 8.691 7.766 1.00 0.00 C ATOM 848 CG LEU A 421 6.136 8.189 9.204 1.00 0.00 C ATOM 849 CD1 LEU A 421 4.797 7.490 9.391 1.00 0.00 C ATOM 850 CD2 LEU A 421 7.281 7.254 9.562 1.00 0.00 C ATOM 0 H LEU A 421 4.655 7.993 6.055 1.00 0.00 H new ATOM 0 HA LEU A 421 4.573 9.938 8.144 1.00 0.00 H new ATOM 0 HB2 LEU A 421 6.341 7.830 7.100 1.00 0.00 H new ATOM 0 HB3 LEU A 421 7.232 9.223 7.679 1.00 0.00 H new ATOM 0 HG LEU A 421 6.170 9.048 9.874 1.00 0.00 H new ATOM 0 HD11 LEU A 421 4.710 7.140 10.420 1.00 0.00 H new ATOM 0 HD12 LEU A 421 3.989 8.189 9.176 1.00 0.00 H new ATOM 0 HD13 LEU A 421 4.732 6.640 8.712 1.00 0.00 H new ATOM 0 HD21 LEU A 421 7.160 6.906 10.588 1.00 0.00 H new ATOM 0 HD22 LEU A 421 7.277 6.399 8.886 1.00 0.00 H new ATOM 0 HD23 LEU A 421 8.228 7.786 9.469 1.00 0.00 H new ATOM 862 N GLU A 422 5.945 10.770 5.300 1.00 0.00 N ATOM 863 CA GLU A 422 6.493 11.889 4.540 1.00 0.00 C ATOM 864 C GLU A 422 5.467 13.011 4.411 1.00 0.00 C ATOM 865 O GLU A 422 5.783 14.182 4.622 1.00 0.00 O ATOM 866 CB GLU A 422 6.936 11.422 3.150 1.00 0.00 C ATOM 867 CG GLU A 422 8.331 11.889 2.768 1.00 0.00 C ATOM 868 CD GLU A 422 8.655 11.625 1.310 1.00 0.00 C ATOM 869 OE1 GLU A 422 7.735 11.715 0.472 1.00 0.00 O ATOM 870 OE2 GLU A 422 9.831 11.329 1.009 1.00 0.00 O ATOM 0 H GLU A 422 5.742 9.940 4.742 1.00 0.00 H new ATOM 0 HA GLU A 422 7.360 12.273 5.078 1.00 0.00 H new ATOM 0 HB2 GLU A 422 6.904 10.333 3.114 1.00 0.00 H new ATOM 0 HB3 GLU A 422 6.224 11.786 2.409 1.00 0.00 H new ATOM 0 HG2 GLU A 422 8.421 12.957 2.969 1.00 0.00 H new ATOM 0 HG3 GLU A 422 9.064 11.384 3.397 1.00 0.00 H new ATOM 877 N LEU A 423 4.237 12.645 4.062 1.00 0.00 N ATOM 878 CA LEU A 423 3.164 13.620 3.905 1.00 0.00 C ATOM 879 C LEU A 423 2.774 14.224 5.251 1.00 0.00 C ATOM 880 O LEU A 423 2.352 15.377 5.326 1.00 0.00 O ATOM 881 CB LEU A 423 1.944 12.973 3.246 1.00 0.00 C ATOM 882 CG LEU A 423 1.385 11.745 3.969 1.00 0.00 C ATOM 883 CD1 LEU A 423 0.481 12.166 5.120 1.00 0.00 C ATOM 884 CD2 LEU A 423 0.632 10.852 2.993 1.00 0.00 C ATOM 0 H LEU A 423 3.959 11.680 3.883 1.00 0.00 H new ATOM 0 HA LEU A 423 3.529 14.421 3.262 1.00 0.00 H new ATOM 0 HB2 LEU A 423 1.154 13.720 3.169 1.00 0.00 H new ATOM 0 HB3 LEU A 423 2.211 12.685 2.229 1.00 0.00 H new ATOM 0 HG LEU A 423 2.219 11.177 4.382 1.00 0.00 H new ATOM 0 HD11 LEU A 423 0.093 11.279 5.621 1.00 0.00 H new ATOM 0 HD12 LEU A 423 1.051 12.764 5.830 1.00 0.00 H new ATOM 0 HD13 LEU A 423 -0.350 12.756 4.733 1.00 0.00 H new ATOM 0 HD21 LEU A 423 0.241 9.983 3.522 1.00 0.00 H new ATOM 0 HD22 LEU A 423 -0.194 11.410 2.552 1.00 0.00 H new ATOM 0 HD23 LEU A 423 1.309 10.522 2.205 1.00 0.00 H new ATOM 896 N ASP A 424 2.917 13.435 6.313 1.00 0.00 N ATOM 897 CA ASP A 424 2.577 13.893 7.657 1.00 0.00 C ATOM 898 C ASP A 424 3.794 14.482 8.364 1.00 0.00 C ATOM 899 O ASP A 424 3.899 14.425 9.589 1.00 0.00 O ATOM 900 CB ASP A 424 2.005 12.739 8.482 1.00 0.00 C ATOM 901 CG ASP A 424 1.364 13.212 9.772 1.00 0.00 C ATOM 902 OD1 ASP A 424 0.159 13.541 9.751 1.00 0.00 O ATOM 903 OD2 ASP A 424 2.068 13.256 10.803 1.00 0.00 O ATOM 0 H ASP A 424 3.265 12.477 6.269 1.00 0.00 H new ATOM 0 HA ASP A 424 1.824 14.675 7.563 1.00 0.00 H new ATOM 0 HB2 ASP A 424 1.265 12.203 7.887 1.00 0.00 H new ATOM 0 HB3 ASP A 424 2.802 12.032 8.713 1.00 0.00 H new ATOM 908 N SER A 425 4.711 15.051 7.588 1.00 0.00 N ATOM 909 CA SER A 425 5.917 15.654 8.144 1.00 0.00 C ATOM 910 C SER A 425 5.870 17.177 8.028 1.00 0.00 C ATOM 911 O SER A 425 6.619 17.882 8.704 1.00 0.00 O ATOM 912 CB SER A 425 7.158 15.117 7.428 1.00 0.00 C ATOM 913 OG SER A 425 8.329 15.786 7.864 1.00 0.00 O ATOM 0 H SER A 425 4.642 15.107 6.572 1.00 0.00 H new ATOM 0 HA SER A 425 5.970 15.389 9.200 1.00 0.00 H new ATOM 0 HB2 SER A 425 7.255 14.048 7.615 1.00 0.00 H new ATOM 0 HB3 SER A 425 7.043 15.243 6.351 1.00 0.00 H new ATOM 0 HG SER A 425 9.108 15.423 7.392 1.00 0.00 H new ATOM 919 N VAL A 426 4.984 17.678 7.169 1.00 0.00 N ATOM 920 CA VAL A 426 4.842 19.115 6.969 1.00 0.00 C ATOM 921 C VAL A 426 4.301 19.794 8.222 1.00 0.00 C ATOM 922 O VAL A 426 3.382 19.289 8.868 1.00 0.00 O ATOM 923 CB VAL A 426 3.904 19.427 5.788 1.00 0.00 C ATOM 924 CG1 VAL A 426 4.569 19.074 4.467 1.00 0.00 C ATOM 925 CG2 VAL A 426 2.585 18.684 5.944 1.00 0.00 C ATOM 0 H VAL A 426 4.355 17.109 6.602 1.00 0.00 H new ATOM 0 HA VAL A 426 5.837 19.503 6.748 1.00 0.00 H new ATOM 0 HB VAL A 426 3.696 20.497 5.787 1.00 0.00 H new ATOM 0 HG11 VAL A 426 3.890 19.302 3.645 1.00 0.00 H new ATOM 0 HG12 VAL A 426 5.484 19.655 4.353 1.00 0.00 H new ATOM 0 HG13 VAL A 426 4.811 18.011 4.454 1.00 0.00 H new ATOM 0 HG21 VAL A 426 1.935 18.916 5.101 1.00 0.00 H new ATOM 0 HG22 VAL A 426 2.773 17.611 5.972 1.00 0.00 H new ATOM 0 HG23 VAL A 426 2.101 18.992 6.871 1.00 0.00 H new ATOM 935 N GLU A 427 4.876 20.943 8.563 1.00 0.00 N ATOM 936 CA GLU A 427 4.451 21.693 9.740 1.00 0.00 C ATOM 937 C GLU A 427 3.250 22.577 9.419 1.00 0.00 C ATOM 938 O GLU A 427 2.272 22.606 10.167 1.00 0.00 O ATOM 939 CB GLU A 427 5.603 22.548 10.270 1.00 0.00 C ATOM 940 CG GLU A 427 5.710 22.551 11.786 1.00 0.00 C ATOM 941 CD GLU A 427 7.098 22.186 12.276 1.00 0.00 C ATOM 942 OE1 GLU A 427 7.461 20.994 12.195 1.00 0.00 O ATOM 943 OE2 GLU A 427 7.822 23.092 12.741 1.00 0.00 O ATOM 0 H GLU A 427 5.638 21.375 8.041 1.00 0.00 H new ATOM 0 HA GLU A 427 4.156 20.978 10.508 1.00 0.00 H new ATOM 0 HB2 GLU A 427 6.540 22.183 9.849 1.00 0.00 H new ATOM 0 HB3 GLU A 427 5.475 23.573 9.921 1.00 0.00 H new ATOM 0 HG2 GLU A 427 5.444 23.539 12.163 1.00 0.00 H new ATOM 0 HG3 GLU A 427 4.987 21.847 12.198 1.00 0.00 H new ATOM 950 N THR A 428 3.332 23.298 8.302 1.00 0.00 N ATOM 951 CA THR A 428 2.257 24.190 7.872 1.00 0.00 C ATOM 952 C THR A 428 1.737 25.034 9.033 1.00 0.00 C ATOM 953 O THR A 428 2.349 25.085 10.099 1.00 0.00 O ATOM 954 CB THR A 428 1.110 23.385 7.251 1.00 0.00 C ATOM 955 OG1 THR A 428 0.159 24.249 6.654 1.00 0.00 O ATOM 956 CG2 THR A 428 0.376 22.512 8.245 1.00 0.00 C ATOM 0 H THR A 428 4.137 23.281 7.675 1.00 0.00 H new ATOM 0 HA THR A 428 2.666 24.865 7.120 1.00 0.00 H new ATOM 0 HB THR A 428 1.582 22.740 6.510 1.00 0.00 H new ATOM 0 HG1 THR A 428 -0.688 23.771 6.535 1.00 0.00 H new ATOM 0 HG21 THR A 428 -0.422 21.972 7.735 1.00 0.00 H new ATOM 0 HG22 THR A 428 1.072 21.799 8.687 1.00 0.00 H new ATOM 0 HG23 THR A 428 -0.052 23.135 9.030 1.00 0.00 H new ATOM 964 N GLY A 429 0.603 25.696 8.818 1.00 0.00 N ATOM 965 CA GLY A 429 0.025 26.529 9.855 1.00 0.00 C ATOM 966 C GLY A 429 -1.377 26.994 9.514 1.00 0.00 C ATOM 967 O GLY A 429 -2.301 26.839 10.312 1.00 0.00 O ATOM 0 H GLY A 429 0.076 25.670 7.945 1.00 0.00 H new ATOM 0 HA2 GLY A 429 0.002 25.973 10.792 1.00 0.00 H new ATOM 0 HA3 GLY A 429 0.663 27.398 10.016 1.00 0.00 H new ATOM 971 N GLY A 430 -1.535 27.568 8.325 1.00 0.00 N ATOM 972 CA GLY A 430 -2.837 28.049 7.902 1.00 0.00 C ATOM 973 C GLY A 430 -3.164 27.658 6.474 1.00 0.00 C ATOM 974 O GLY A 430 -3.791 28.423 5.742 1.00 0.00 O ATOM 0 H GLY A 430 -0.785 27.708 7.648 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -3.602 27.651 8.569 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -2.867 29.135 7.994 1.00 0.00 H new ATOM 978 N GLN A 431 -2.738 26.463 6.078 1.00 0.00 N ATOM 979 CA GLN A 431 -2.989 25.973 4.729 1.00 0.00 C ATOM 980 C GLN A 431 -4.108 24.935 4.726 1.00 0.00 C ATOM 981 O GLN A 431 -3.901 23.784 5.109 1.00 0.00 O ATOM 982 CB GLN A 431 -1.713 25.369 4.137 1.00 0.00 C ATOM 983 CG GLN A 431 -1.031 26.266 3.117 1.00 0.00 C ATOM 984 CD GLN A 431 -0.166 27.330 3.762 1.00 0.00 C ATOM 985 OE1 GLN A 431 -0.471 28.522 3.691 1.00 0.00 O ATOM 986 NE2 GLN A 431 0.920 26.907 4.396 1.00 0.00 N ATOM 0 H GLN A 431 -2.218 25.817 6.672 1.00 0.00 H new ATOM 0 HA GLN A 431 -3.301 26.818 4.115 1.00 0.00 H new ATOM 0 HB2 GLN A 431 -1.014 25.155 4.945 1.00 0.00 H new ATOM 0 HB3 GLN A 431 -1.957 24.417 3.666 1.00 0.00 H new ATOM 0 HG2 GLN A 431 -0.417 25.656 2.455 1.00 0.00 H new ATOM 0 HG3 GLN A 431 -1.788 26.746 2.497 1.00 0.00 H new ATOM 0 HE21 GLN A 431 1.135 25.910 4.430 1.00 0.00 H new ATOM 0 HE22 GLN A 431 1.540 27.578 4.849 1.00 0.00 H new ATOM 995 N ASP A 432 -5.293 25.352 4.293 1.00 0.00 N ATOM 996 CA ASP A 432 -6.445 24.460 4.240 1.00 0.00 C ATOM 997 C ASP A 432 -6.243 23.372 3.189 1.00 0.00 C ATOM 998 O ASP A 432 -6.603 22.215 3.403 1.00 0.00 O ATOM 999 CB ASP A 432 -7.716 25.253 3.931 1.00 0.00 C ATOM 1000 CG ASP A 432 -8.913 24.757 4.719 1.00 0.00 C ATOM 1001 OD1 ASP A 432 -9.323 23.597 4.508 1.00 0.00 O ATOM 1002 OD2 ASP A 432 -9.439 25.529 5.547 1.00 0.00 O ATOM 0 H ASP A 432 -5.481 26.302 3.974 1.00 0.00 H new ATOM 0 HA ASP A 432 -6.550 23.984 5.215 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -7.548 26.306 4.156 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -7.933 25.185 2.865 1.00 0.00 H new ATOM 1007 N SER A 433 -5.665 23.753 2.054 1.00 0.00 N ATOM 1008 CA SER A 433 -5.415 22.811 0.968 1.00 0.00 C ATOM 1009 C SER A 433 -4.521 21.667 1.434 1.00 0.00 C ATOM 1010 O SER A 433 -4.742 20.509 1.079 1.00 0.00 O ATOM 1011 CB SER A 433 -4.769 23.529 -0.218 1.00 0.00 C ATOM 1012 OG SER A 433 -5.745 23.935 -1.161 1.00 0.00 O ATOM 0 H SER A 433 -5.361 24.708 1.862 1.00 0.00 H new ATOM 0 HA SER A 433 -6.372 22.394 0.654 1.00 0.00 H new ATOM 0 HB2 SER A 433 -4.217 24.399 0.137 1.00 0.00 H new ATOM 0 HB3 SER A 433 -4.048 22.868 -0.698 1.00 0.00 H new ATOM 0 HG SER A 433 -5.307 24.393 -1.909 1.00 0.00 H new ATOM 1018 N VAL A 434 -3.508 21.999 2.227 1.00 0.00 N ATOM 1019 CA VAL A 434 -2.578 20.998 2.738 1.00 0.00 C ATOM 1020 C VAL A 434 -3.253 20.091 3.762 1.00 0.00 C ATOM 1021 O VAL A 434 -3.112 18.870 3.712 1.00 0.00 O ATOM 1022 CB VAL A 434 -1.344 21.658 3.385 1.00 0.00 C ATOM 1023 CG1 VAL A 434 -0.326 20.607 3.797 1.00 0.00 C ATOM 1024 CG2 VAL A 434 -0.720 22.669 2.435 1.00 0.00 C ATOM 0 H VAL A 434 -3.310 22.953 2.530 1.00 0.00 H new ATOM 0 HA VAL A 434 -2.256 20.400 1.886 1.00 0.00 H new ATOM 0 HB VAL A 434 -1.668 22.186 4.282 1.00 0.00 H new ATOM 0 HG11 VAL A 434 0.537 21.094 4.251 1.00 0.00 H new ATOM 0 HG12 VAL A 434 -0.778 19.925 4.517 1.00 0.00 H new ATOM 0 HG13 VAL A 434 -0.005 20.047 2.919 1.00 0.00 H new ATOM 0 HG21 VAL A 434 0.150 23.125 2.909 1.00 0.00 H new ATOM 0 HG22 VAL A 434 -0.412 22.165 1.519 1.00 0.00 H new ATOM 0 HG23 VAL A 434 -1.450 23.442 2.196 1.00 0.00 H new ATOM 1034 N ARG A 435 -3.985 20.696 4.693 1.00 0.00 N ATOM 1035 CA ARG A 435 -4.681 19.941 5.730 1.00 0.00 C ATOM 1036 C ARG A 435 -5.674 18.959 5.118 1.00 0.00 C ATOM 1037 O ARG A 435 -5.825 17.834 5.595 1.00 0.00 O ATOM 1038 CB ARG A 435 -5.409 20.894 6.680 1.00 0.00 C ATOM 1039 CG ARG A 435 -5.478 20.393 8.114 1.00 0.00 C ATOM 1040 CD ARG A 435 -4.094 20.097 8.673 1.00 0.00 C ATOM 1041 NE ARG A 435 -3.825 20.849 9.896 1.00 0.00 N ATOM 1042 CZ ARG A 435 -3.438 22.123 9.915 1.00 0.00 C ATOM 1043 NH1 ARG A 435 -3.275 22.792 8.780 1.00 0.00 N ATOM 1044 NH2 ARG A 435 -3.215 22.731 11.072 1.00 0.00 N ATOM 0 H ARG A 435 -4.112 21.706 4.751 1.00 0.00 H new ATOM 0 HA ARG A 435 -3.938 19.374 6.291 1.00 0.00 H new ATOM 0 HB2 ARG A 435 -4.906 21.861 6.666 1.00 0.00 H new ATOM 0 HB3 ARG A 435 -6.422 21.056 6.312 1.00 0.00 H new ATOM 0 HG2 ARG A 435 -5.970 21.140 8.737 1.00 0.00 H new ATOM 0 HG3 ARG A 435 -6.088 19.491 8.155 1.00 0.00 H new ATOM 0 HD2 ARG A 435 -4.006 19.030 8.877 1.00 0.00 H new ATOM 0 HD3 ARG A 435 -3.341 20.341 7.924 1.00 0.00 H new ATOM 0 HE ARG A 435 -3.941 20.370 10.789 1.00 0.00 H new ATOM 0 HH11 ARG A 435 -3.446 22.330 7.887 1.00 0.00 H new ATOM 0 HH12 ARG A 435 -2.978 23.768 8.801 1.00 0.00 H new ATOM 0 HH21 ARG A 435 -3.340 22.223 11.948 1.00 0.00 H new ATOM 0 HH22 ARG A 435 -2.919 23.707 11.086 1.00 0.00 H new ATOM 1058 N GLN A 436 -6.354 19.393 4.063 1.00 0.00 N ATOM 1059 CA GLN A 436 -7.336 18.554 3.388 1.00 0.00 C ATOM 1060 C GLN A 436 -6.662 17.398 2.657 1.00 0.00 C ATOM 1061 O GLN A 436 -7.113 16.254 2.735 1.00 0.00 O ATOM 1062 CB GLN A 436 -8.154 19.387 2.400 1.00 0.00 C ATOM 1063 CG GLN A 436 -9.563 18.859 2.182 1.00 0.00 C ATOM 1064 CD GLN A 436 -10.163 19.330 0.872 1.00 0.00 C ATOM 1065 OE1 GLN A 436 -11.020 20.213 0.851 1.00 0.00 O ATOM 1066 NE2 GLN A 436 -9.715 18.741 -0.230 1.00 0.00 N ATOM 0 H GLN A 436 -6.243 20.322 3.657 1.00 0.00 H new ATOM 0 HA GLN A 436 -8.001 18.140 4.146 1.00 0.00 H new ATOM 0 HB2 GLN A 436 -8.211 20.413 2.763 1.00 0.00 H new ATOM 0 HB3 GLN A 436 -7.633 19.416 1.443 1.00 0.00 H new ATOM 0 HG2 GLN A 436 -9.546 17.769 2.199 1.00 0.00 H new ATOM 0 HG3 GLN A 436 -10.200 19.181 3.006 1.00 0.00 H new ATOM 0 HE21 GLN A 436 -9.003 18.013 -0.166 1.00 0.00 H new ATOM 0 HE22 GLN A 436 -10.082 19.016 -1.141 1.00 0.00 H new ATOM 1075 N ALA A 437 -5.583 17.703 1.944 1.00 0.00 N ATOM 1076 CA ALA A 437 -4.850 16.689 1.196 1.00 0.00 C ATOM 1077 C ALA A 437 -4.132 15.721 2.132 1.00 0.00 C ATOM 1078 O ALA A 437 -4.056 14.522 1.861 1.00 0.00 O ATOM 1079 CB ALA A 437 -3.859 17.348 0.249 1.00 0.00 C ATOM 0 H ALA A 437 -5.197 18.644 1.869 1.00 0.00 H new ATOM 0 HA ALA A 437 -5.569 16.115 0.611 1.00 0.00 H new ATOM 0 HB1 ALA A 437 -3.318 16.580 -0.304 1.00 0.00 H new ATOM 0 HB2 ALA A 437 -4.395 17.989 -0.451 1.00 0.00 H new ATOM 0 HB3 ALA A 437 -3.152 17.948 0.822 1.00 0.00 H new ATOM 1085 N ARG A 438 -3.605 16.248 3.232 1.00 0.00 N ATOM 1086 CA ARG A 438 -2.893 15.427 4.205 1.00 0.00 C ATOM 1087 C ARG A 438 -3.825 14.401 4.843 1.00 0.00 C ATOM 1088 O ARG A 438 -3.469 13.232 4.994 1.00 0.00 O ATOM 1089 CB ARG A 438 -2.270 16.313 5.289 1.00 0.00 C ATOM 1090 CG ARG A 438 -0.767 16.487 5.141 1.00 0.00 C ATOM 1091 CD ARG A 438 -0.407 17.146 3.819 1.00 0.00 C ATOM 1092 NE ARG A 438 0.140 16.188 2.862 1.00 0.00 N ATOM 1093 CZ ARG A 438 0.934 16.521 1.847 1.00 0.00 C ATOM 1094 NH1 ARG A 438 1.271 17.789 1.645 1.00 0.00 N ATOM 1095 NH2 ARG A 438 1.391 15.583 1.028 1.00 0.00 N ATOM 0 H ARG A 438 -3.657 17.238 3.472 1.00 0.00 H new ATOM 0 HA ARG A 438 -2.102 14.891 3.681 1.00 0.00 H new ATOM 0 HB2 ARG A 438 -2.745 17.293 5.263 1.00 0.00 H new ATOM 0 HB3 ARG A 438 -2.483 15.881 6.267 1.00 0.00 H new ATOM 0 HG2 ARG A 438 -0.387 17.092 5.965 1.00 0.00 H new ATOM 0 HG3 ARG A 438 -0.279 15.515 5.208 1.00 0.00 H new ATOM 0 HD2 ARG A 438 -1.294 17.616 3.395 1.00 0.00 H new ATOM 0 HD3 ARG A 438 0.320 17.938 3.995 1.00 0.00 H new ATOM 0 HE ARG A 438 -0.101 15.204 2.979 1.00 0.00 H new ATOM 0 HH11 ARG A 438 0.921 18.515 2.270 1.00 0.00 H new ATOM 0 HH12 ARG A 438 1.880 18.037 0.865 1.00 0.00 H new ATOM 0 HH21 ARG A 438 1.134 14.607 1.176 1.00 0.00 H new ATOM 0 HH22 ARG A 438 1.999 15.838 0.250 1.00 0.00 H new ATOM 1109 N LYS A 439 -5.019 14.848 5.220 1.00 0.00 N ATOM 1110 CA LYS A 439 -6.004 13.973 5.846 1.00 0.00 C ATOM 1111 C LYS A 439 -6.524 12.931 4.858 1.00 0.00 C ATOM 1112 O LYS A 439 -6.671 11.758 5.199 1.00 0.00 O ATOM 1113 CB LYS A 439 -7.169 14.798 6.396 1.00 0.00 C ATOM 1114 CG LYS A 439 -8.198 13.971 7.150 1.00 0.00 C ATOM 1115 CD LYS A 439 -9.086 14.846 8.018 1.00 0.00 C ATOM 1116 CE LYS A 439 -9.813 14.027 9.073 1.00 0.00 C ATOM 1117 NZ LYS A 439 -8.893 13.562 10.147 1.00 0.00 N ATOM 0 H LYS A 439 -5.328 15.813 5.103 1.00 0.00 H new ATOM 0 HA LYS A 439 -5.515 13.449 6.667 1.00 0.00 H new ATOM 0 HB2 LYS A 439 -6.776 15.568 7.060 1.00 0.00 H new ATOM 0 HB3 LYS A 439 -7.662 15.311 5.570 1.00 0.00 H new ATOM 0 HG2 LYS A 439 -8.813 13.417 6.440 1.00 0.00 H new ATOM 0 HG3 LYS A 439 -7.690 13.235 7.773 1.00 0.00 H new ATOM 0 HD2 LYS A 439 -8.481 15.612 8.503 1.00 0.00 H new ATOM 0 HD3 LYS A 439 -9.813 15.363 7.392 1.00 0.00 H new ATOM 0 HE2 LYS A 439 -10.610 14.627 9.512 1.00 0.00 H new ATOM 0 HE3 LYS A 439 -10.285 13.165 8.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 439 -9.449 13.219 10.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 439 -8.297 12.791 9.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 439 -8.289 14.351 10.452 1.00 0.00 H new ATOM 1131 N GLU A 440 -6.805 13.370 3.634 1.00 0.00 N ATOM 1132 CA GLU A 440 -7.312 12.475 2.598 1.00 0.00 C ATOM 1133 C GLU A 440 -6.282 11.408 2.242 1.00 0.00 C ATOM 1134 O GLU A 440 -6.630 10.248 2.016 1.00 0.00 O ATOM 1135 CB GLU A 440 -7.691 13.273 1.349 1.00 0.00 C ATOM 1136 CG GLU A 440 -8.620 12.524 0.407 1.00 0.00 C ATOM 1137 CD GLU A 440 -10.079 12.880 0.622 1.00 0.00 C ATOM 1138 OE1 GLU A 440 -10.404 14.085 0.609 1.00 0.00 O ATOM 1139 OE2 GLU A 440 -10.895 11.953 0.804 1.00 0.00 O ATOM 0 H GLU A 440 -6.690 14.339 3.336 1.00 0.00 H new ATOM 0 HA GLU A 440 -8.200 11.977 2.988 1.00 0.00 H new ATOM 0 HB2 GLU A 440 -8.170 14.204 1.654 1.00 0.00 H new ATOM 0 HB3 GLU A 440 -6.782 13.543 0.811 1.00 0.00 H new ATOM 0 HG2 GLU A 440 -8.343 12.747 -0.624 1.00 0.00 H new ATOM 0 HG3 GLU A 440 -8.487 11.451 0.548 1.00 0.00 H new ATOM 1146 N ALA A 441 -5.015 11.806 2.189 1.00 0.00 N ATOM 1147 CA ALA A 441 -3.938 10.882 1.857 1.00 0.00 C ATOM 1148 C ALA A 441 -3.797 9.795 2.917 1.00 0.00 C ATOM 1149 O ALA A 441 -3.669 8.614 2.594 1.00 0.00 O ATOM 1150 CB ALA A 441 -2.626 11.637 1.696 1.00 0.00 C ATOM 0 H ALA A 441 -4.710 12.762 2.372 1.00 0.00 H new ATOM 0 HA ALA A 441 -4.187 10.400 0.912 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -1.830 10.935 1.448 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -2.724 12.371 0.896 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -2.383 12.147 2.628 1.00 0.00 H new ATOM 1156 N VAL A 442 -3.823 10.200 4.182 1.00 0.00 N ATOM 1157 CA VAL A 442 -3.697 9.257 5.288 1.00 0.00 C ATOM 1158 C VAL A 442 -4.856 8.269 5.293 1.00 0.00 C ATOM 1159 O VAL A 442 -4.684 7.096 5.628 1.00 0.00 O ATOM 1160 CB VAL A 442 -3.653 9.984 6.645 1.00 0.00 C ATOM 1161 CG1 VAL A 442 -3.307 9.012 7.765 1.00 0.00 C ATOM 1162 CG2 VAL A 442 -2.664 11.143 6.604 1.00 0.00 C ATOM 0 H VAL A 442 -3.930 11.173 4.467 1.00 0.00 H new ATOM 0 HA VAL A 442 -2.760 8.719 5.143 1.00 0.00 H new ATOM 0 HB VAL A 442 -4.643 10.393 6.847 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -3.281 9.546 8.715 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -4.061 8.226 7.811 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -2.331 8.567 7.572 1.00 0.00 H new ATOM 0 HG21 VAL A 442 -2.649 11.643 7.573 1.00 0.00 H new ATOM 0 HG22 VAL A 442 -1.668 10.764 6.376 1.00 0.00 H new ATOM 0 HG23 VAL A 442 -2.967 11.853 5.834 1.00 0.00 H new ATOM 1172 N CYS A 443 -6.037 8.745 4.914 1.00 0.00 N ATOM 1173 CA CYS A 443 -7.221 7.897 4.870 1.00 0.00 C ATOM 1174 C CYS A 443 -7.037 6.778 3.850 1.00 0.00 C ATOM 1175 O CYS A 443 -7.491 5.652 4.057 1.00 0.00 O ATOM 1176 CB CYS A 443 -8.459 8.726 4.522 1.00 0.00 C ATOM 1177 SG CYS A 443 -9.237 9.524 5.946 1.00 0.00 S ATOM 0 H CYS A 443 -6.199 9.712 4.633 1.00 0.00 H new ATOM 0 HA CYS A 443 -7.362 7.453 5.855 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -8.179 9.491 3.798 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -9.191 8.080 4.036 1.00 0.00 H new ATOM 0 HG CYS A 443 -10.273 10.203 5.551 1.00 0.00 H new ATOM 1183 N LYS A 444 -6.361 7.097 2.751 1.00 0.00 N ATOM 1184 CA LYS A 444 -6.108 6.120 1.699 1.00 0.00 C ATOM 1185 C LYS A 444 -5.219 4.994 2.212 1.00 0.00 C ATOM 1186 O LYS A 444 -5.451 3.822 1.916 1.00 0.00 O ATOM 1187 CB LYS A 444 -5.451 6.796 0.494 1.00 0.00 C ATOM 1188 CG LYS A 444 -5.731 6.093 -0.825 1.00 0.00 C ATOM 1189 CD LYS A 444 -7.125 6.412 -1.342 1.00 0.00 C ATOM 1190 CE LYS A 444 -7.126 6.613 -2.848 1.00 0.00 C ATOM 1191 NZ LYS A 444 -7.228 5.322 -3.583 1.00 0.00 N ATOM 0 H LYS A 444 -5.979 8.024 2.566 1.00 0.00 H new ATOM 0 HA LYS A 444 -7.063 5.695 1.391 1.00 0.00 H new ATOM 0 HB2 LYS A 444 -5.802 7.826 0.429 1.00 0.00 H new ATOM 0 HB3 LYS A 444 -4.373 6.836 0.653 1.00 0.00 H new ATOM 0 HG2 LYS A 444 -4.990 6.396 -1.564 1.00 0.00 H new ATOM 0 HG3 LYS A 444 -5.628 5.016 -0.693 1.00 0.00 H new ATOM 0 HD2 LYS A 444 -7.806 5.601 -1.081 1.00 0.00 H new ATOM 0 HD3 LYS A 444 -7.499 7.312 -0.853 1.00 0.00 H new ATOM 0 HE2 LYS A 444 -7.961 7.256 -3.127 1.00 0.00 H new ATOM 0 HE3 LYS A 444 -6.213 7.128 -3.146 1.00 0.00 H new ATOM 0 HZ1 LYS A 444 -7.225 5.504 -4.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 444 -6.418 4.717 -3.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 444 -8.112 4.841 -3.319 1.00 0.00 H new ATOM 1205 N ILE A 445 -4.200 5.356 2.988 1.00 0.00 N ATOM 1206 CA ILE A 445 -3.279 4.373 3.545 1.00 0.00 C ATOM 1207 C ILE A 445 -4.006 3.425 4.494 1.00 0.00 C ATOM 1208 O ILE A 445 -3.641 2.258 4.626 1.00 0.00 O ATOM 1209 CB ILE A 445 -2.105 5.055 4.291 1.00 0.00 C ATOM 1210 CG1 ILE A 445 -1.102 5.636 3.291 1.00 0.00 C ATOM 1211 CG2 ILE A 445 -1.405 4.075 5.225 1.00 0.00 C ATOM 1212 CD1 ILE A 445 -1.607 6.863 2.565 1.00 0.00 C ATOM 0 H ILE A 445 -3.993 6.321 3.244 1.00 0.00 H new ATOM 0 HA ILE A 445 -2.873 3.802 2.710 1.00 0.00 H new ATOM 0 HB ILE A 445 -2.516 5.866 4.892 1.00 0.00 H new ATOM 0 HG12 ILE A 445 -0.182 5.890 3.818 1.00 0.00 H new ATOM 0 HG13 ILE A 445 -0.848 4.870 2.558 1.00 0.00 H new ATOM 0 HG21 ILE A 445 -0.585 4.581 5.735 1.00 0.00 H new ATOM 0 HG22 ILE A 445 -2.117 3.703 5.962 1.00 0.00 H new ATOM 0 HG23 ILE A 445 -1.011 3.239 4.647 1.00 0.00 H new ATOM 0 HD11 ILE A 445 -0.842 7.218 1.874 1.00 0.00 H new ATOM 0 HD12 ILE A 445 -2.510 6.611 2.009 1.00 0.00 H new ATOM 0 HD13 ILE A 445 -1.834 7.646 3.288 1.00 0.00 H new ATOM 1224 N GLN A 446 -5.035 3.942 5.148 1.00 0.00 N ATOM 1225 CA GLN A 446 -5.822 3.159 6.084 1.00 0.00 C ATOM 1226 C GLN A 446 -6.577 2.048 5.357 1.00 0.00 C ATOM 1227 O GLN A 446 -6.652 0.917 5.839 1.00 0.00 O ATOM 1228 CB GLN A 446 -6.793 4.084 6.818 1.00 0.00 C ATOM 1229 CG GLN A 446 -7.857 3.365 7.624 1.00 0.00 C ATOM 1230 CD GLN A 446 -7.635 3.486 9.118 1.00 0.00 C ATOM 1231 OE1 GLN A 446 -8.567 3.749 9.878 1.00 0.00 O ATOM 1232 NE2 GLN A 446 -6.392 3.294 9.546 1.00 0.00 N ATOM 0 H GLN A 446 -5.345 4.908 5.045 1.00 0.00 H new ATOM 0 HA GLN A 446 -5.158 2.688 6.808 1.00 0.00 H new ATOM 0 HB2 GLN A 446 -6.224 4.731 7.486 1.00 0.00 H new ATOM 0 HB3 GLN A 446 -7.282 4.730 6.088 1.00 0.00 H new ATOM 0 HG2 GLN A 446 -8.836 3.772 7.371 1.00 0.00 H new ATOM 0 HG3 GLN A 446 -7.868 2.311 7.346 1.00 0.00 H new ATOM 0 HE21 GLN A 446 -5.651 3.078 8.879 1.00 0.00 H new ATOM 0 HE22 GLN A 446 -6.179 3.363 10.541 1.00 0.00 H new ATOM 1241 N ALA A 447 -7.133 2.378 4.197 1.00 0.00 N ATOM 1242 CA ALA A 447 -7.880 1.408 3.405 1.00 0.00 C ATOM 1243 C ALA A 447 -6.966 0.301 2.889 1.00 0.00 C ATOM 1244 O ALA A 447 -7.341 -0.871 2.876 1.00 0.00 O ATOM 1245 CB ALA A 447 -8.579 2.101 2.246 1.00 0.00 C ATOM 0 H ALA A 447 -7.081 3.309 3.784 1.00 0.00 H new ATOM 0 HA ALA A 447 -8.632 0.952 4.048 1.00 0.00 H new ATOM 0 HB1 ALA A 447 -9.133 1.365 1.663 1.00 0.00 H new ATOM 0 HB2 ALA A 447 -9.269 2.851 2.633 1.00 0.00 H new ATOM 0 HB3 ALA A 447 -7.837 2.584 1.610 1.00 0.00 H new ATOM 1251 N ILE A 448 -5.765 0.681 2.467 1.00 0.00 N ATOM 1252 CA ILE A 448 -4.795 -0.278 1.951 1.00 0.00 C ATOM 1253 C ILE A 448 -4.194 -1.111 3.076 1.00 0.00 C ATOM 1254 O ILE A 448 -3.923 -2.300 2.904 1.00 0.00 O ATOM 1255 CB ILE A 448 -3.656 0.426 1.187 1.00 0.00 C ATOM 1256 CG1 ILE A 448 -4.229 1.421 0.177 1.00 0.00 C ATOM 1257 CG2 ILE A 448 -2.775 -0.597 0.487 1.00 0.00 C ATOM 1258 CD1 ILE A 448 -3.179 2.298 -0.467 1.00 0.00 C ATOM 0 H ILE A 448 -5.440 1.648 2.472 1.00 0.00 H new ATOM 0 HA ILE A 448 -5.334 -0.931 1.264 1.00 0.00 H new ATOM 0 HB ILE A 448 -3.044 0.974 1.903 1.00 0.00 H new ATOM 0 HG12 ILE A 448 -4.760 0.872 -0.601 1.00 0.00 H new ATOM 0 HG13 ILE A 448 -4.962 2.053 0.678 1.00 0.00 H new ATOM 0 HG21 ILE A 448 -1.976 -0.084 -0.048 1.00 0.00 H new ATOM 0 HG22 ILE A 448 -2.342 -1.271 1.226 1.00 0.00 H new ATOM 0 HG23 ILE A 448 -3.375 -1.170 -0.220 1.00 0.00 H new ATOM 0 HD11 ILE A 448 -3.656 2.979 -1.172 1.00 0.00 H new ATOM 0 HD12 ILE A 448 -2.664 2.874 0.302 1.00 0.00 H new ATOM 0 HD13 ILE A 448 -2.459 1.674 -0.996 1.00 0.00 H new ATOM 1270 N LEU A 449 -3.983 -0.479 4.225 1.00 0.00 N ATOM 1271 CA LEU A 449 -3.408 -1.161 5.379 1.00 0.00 C ATOM 1272 C LEU A 449 -4.252 -2.369 5.776 1.00 0.00 C ATOM 1273 O LEU A 449 -3.721 -3.447 6.044 1.00 0.00 O ATOM 1274 CB LEU A 449 -3.286 -0.194 6.561 1.00 0.00 C ATOM 1275 CG LEU A 449 -1.854 0.064 7.041 1.00 0.00 C ATOM 1276 CD1 LEU A 449 -1.595 1.557 7.176 1.00 0.00 C ATOM 1277 CD2 LEU A 449 -1.598 -0.643 8.363 1.00 0.00 C ATOM 0 H LEU A 449 -4.201 0.505 4.382 1.00 0.00 H new ATOM 0 HA LEU A 449 -2.414 -1.513 5.103 1.00 0.00 H new ATOM 0 HB2 LEU A 449 -3.736 0.758 6.280 1.00 0.00 H new ATOM 0 HB3 LEU A 449 -3.867 -0.588 7.395 1.00 0.00 H new ATOM 0 HG LEU A 449 -1.166 -0.338 6.297 1.00 0.00 H new ATOM 0 HD11 LEU A 449 -0.573 1.720 7.518 1.00 0.00 H new ATOM 0 HD12 LEU A 449 -1.735 2.040 6.209 1.00 0.00 H new ATOM 0 HD13 LEU A 449 -2.291 1.983 7.898 1.00 0.00 H new ATOM 0 HD21 LEU A 449 -0.576 -0.448 8.688 1.00 0.00 H new ATOM 0 HD22 LEU A 449 -2.295 -0.272 9.115 1.00 0.00 H new ATOM 0 HD23 LEU A 449 -1.740 -1.716 8.235 1.00 0.00 H new ATOM 1289 N GLU A 450 -5.568 -2.185 5.810 1.00 0.00 N ATOM 1290 CA GLU A 450 -6.477 -3.266 6.173 1.00 0.00 C ATOM 1291 C GLU A 450 -6.559 -4.302 5.060 1.00 0.00 C ATOM 1292 O GLU A 450 -6.568 -5.505 5.322 1.00 0.00 O ATOM 1293 CB GLU A 450 -7.871 -2.713 6.482 1.00 0.00 C ATOM 1294 CG GLU A 450 -8.438 -1.837 5.377 1.00 0.00 C ATOM 1295 CD GLU A 450 -9.900 -1.498 5.596 1.00 0.00 C ATOM 1296 OE1 GLU A 450 -10.182 -0.563 6.374 1.00 0.00 O ATOM 1297 OE2 GLU A 450 -10.763 -2.168 4.990 1.00 0.00 O ATOM 0 H GLU A 450 -6.027 -1.301 5.591 1.00 0.00 H new ATOM 0 HA GLU A 450 -6.085 -3.751 7.067 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -8.552 -3.546 6.659 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -7.827 -2.135 7.405 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -7.860 -0.915 5.316 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -8.326 -2.347 4.420 1.00 0.00 H new ATOM 1304 N LYS A 451 -6.603 -3.833 3.817 1.00 0.00 N ATOM 1305 CA LYS A 451 -6.669 -4.733 2.672 1.00 0.00 C ATOM 1306 C LYS A 451 -5.472 -5.677 2.679 1.00 0.00 C ATOM 1307 O LYS A 451 -5.563 -6.820 2.231 1.00 0.00 O ATOM 1308 CB LYS A 451 -6.705 -3.934 1.366 1.00 0.00 C ATOM 1309 CG LYS A 451 -8.022 -4.058 0.614 1.00 0.00 C ATOM 1310 CD LYS A 451 -8.835 -2.774 0.687 1.00 0.00 C ATOM 1311 CE LYS A 451 -10.136 -2.979 1.449 1.00 0.00 C ATOM 1312 NZ LYS A 451 -9.905 -3.534 2.812 1.00 0.00 N ATOM 0 H LYS A 451 -6.594 -2.841 3.578 1.00 0.00 H new ATOM 0 HA LYS A 451 -7.583 -5.322 2.743 1.00 0.00 H new ATOM 0 HB2 LYS A 451 -6.520 -2.883 1.587 1.00 0.00 H new ATOM 0 HB3 LYS A 451 -5.894 -4.271 0.721 1.00 0.00 H new ATOM 0 HG2 LYS A 451 -7.824 -4.304 -0.429 1.00 0.00 H new ATOM 0 HG3 LYS A 451 -8.603 -4.881 1.031 1.00 0.00 H new ATOM 0 HD2 LYS A 451 -8.246 -1.997 1.174 1.00 0.00 H new ATOM 0 HD3 LYS A 451 -9.054 -2.423 -0.321 1.00 0.00 H new ATOM 0 HE2 LYS A 451 -10.662 -2.028 1.530 1.00 0.00 H new ATOM 0 HE3 LYS A 451 -10.782 -3.654 0.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 451 -10.275 -4.505 2.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 451 -8.885 -3.542 3.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 451 -10.393 -2.943 3.515 1.00 0.00 H new ATOM 1326 N LEU A 452 -4.353 -5.189 3.206 1.00 0.00 N ATOM 1327 CA LEU A 452 -3.134 -5.981 3.293 1.00 0.00 C ATOM 1328 C LEU A 452 -3.220 -6.971 4.449 1.00 0.00 C ATOM 1329 O LEU A 452 -2.733 -8.098 4.352 1.00 0.00 O ATOM 1330 CB LEU A 452 -1.917 -5.067 3.467 1.00 0.00 C ATOM 1331 CG LEU A 452 -0.848 -5.200 2.377 1.00 0.00 C ATOM 1332 CD1 LEU A 452 -0.557 -3.850 1.740 1.00 0.00 C ATOM 1333 CD2 LEU A 452 0.426 -5.806 2.950 1.00 0.00 C ATOM 0 H LEU A 452 -4.267 -4.244 3.580 1.00 0.00 H new ATOM 0 HA LEU A 452 -3.021 -6.542 2.365 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -2.259 -4.032 3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -1.458 -5.278 4.433 1.00 0.00 H new ATOM 0 HG LEU A 452 -1.230 -5.867 1.604 1.00 0.00 H new ATOM 0 HD11 LEU A 452 0.205 -3.968 0.969 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -1.469 -3.455 1.292 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -0.198 -3.158 2.502 1.00 0.00 H new ATOM 0 HD21 LEU A 452 1.174 -5.893 2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 452 0.809 -5.165 3.744 1.00 0.00 H new ATOM 0 HD23 LEU A 452 0.209 -6.795 3.355 1.00 0.00 H new ATOM 1345 N GLU A 453 -3.846 -6.546 5.546 1.00 0.00 N ATOM 1346 CA GLU A 453 -3.997 -7.402 6.717 1.00 0.00 C ATOM 1347 C GLU A 453 -4.693 -8.709 6.347 1.00 0.00 C ATOM 1348 O GLU A 453 -4.452 -9.748 6.963 1.00 0.00 O ATOM 1349 CB GLU A 453 -4.789 -6.677 7.806 1.00 0.00 C ATOM 1350 CG GLU A 453 -3.939 -5.757 8.667 1.00 0.00 C ATOM 1351 CD GLU A 453 -4.759 -4.698 9.375 1.00 0.00 C ATOM 1352 OE1 GLU A 453 -5.390 -5.024 10.403 1.00 0.00 O ATOM 1353 OE2 GLU A 453 -4.771 -3.541 8.903 1.00 0.00 O ATOM 0 H GLU A 453 -4.255 -5.617 5.646 1.00 0.00 H new ATOM 0 HA GLU A 453 -3.003 -7.636 7.098 1.00 0.00 H new ATOM 0 HB2 GLU A 453 -5.582 -6.093 7.339 1.00 0.00 H new ATOM 0 HB3 GLU A 453 -5.271 -7.416 8.446 1.00 0.00 H new ATOM 0 HG2 GLU A 453 -3.403 -6.351 9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 453 -3.188 -5.273 8.043 1.00 0.00 H new ATOM 1360 N LYS A 454 -5.554 -8.649 5.337 1.00 0.00 N ATOM 1361 CA LYS A 454 -6.281 -9.828 4.883 1.00 0.00 C ATOM 1362 C LYS A 454 -5.511 -10.567 3.791 1.00 0.00 C ATOM 1363 O LYS A 454 -5.794 -11.730 3.501 1.00 0.00 O ATOM 1364 CB LYS A 454 -7.667 -9.433 4.369 1.00 0.00 C ATOM 1365 CG LYS A 454 -7.627 -8.457 3.204 1.00 0.00 C ATOM 1366 CD LYS A 454 -9.013 -8.231 2.616 1.00 0.00 C ATOM 1367 CE LYS A 454 -9.017 -8.419 1.108 1.00 0.00 C ATOM 1368 NZ LYS A 454 -10.347 -8.110 0.514 1.00 0.00 N ATOM 0 H LYS A 454 -5.765 -7.797 4.818 1.00 0.00 H new ATOM 0 HA LYS A 454 -6.393 -10.499 5.735 1.00 0.00 H new ATOM 0 HB2 LYS A 454 -8.201 -10.332 4.061 1.00 0.00 H new ATOM 0 HB3 LYS A 454 -8.235 -8.988 5.186 1.00 0.00 H new ATOM 0 HG2 LYS A 454 -7.214 -7.506 3.539 1.00 0.00 H new ATOM 0 HG3 LYS A 454 -6.961 -8.839 2.431 1.00 0.00 H new ATOM 0 HD2 LYS A 454 -9.720 -8.924 3.072 1.00 0.00 H new ATOM 0 HD3 LYS A 454 -9.352 -7.224 2.859 1.00 0.00 H new ATOM 0 HE2 LYS A 454 -8.261 -7.775 0.660 1.00 0.00 H new ATOM 0 HE3 LYS A 454 -8.743 -9.447 0.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -10.308 -8.250 -0.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 -11.065 -8.742 0.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 -10.598 -7.122 0.720 1.00 0.00 H new ATOM 1382 N LYS A 455 -4.533 -9.893 3.193 1.00 0.00 N ATOM 1383 CA LYS A 455 -3.724 -10.496 2.142 1.00 0.00 C ATOM 1384 C LYS A 455 -2.607 -11.344 2.742 1.00 0.00 C ATOM 1385 O LYS A 455 -2.092 -12.258 2.098 1.00 0.00 O ATOM 1386 CB LYS A 455 -3.123 -9.414 1.245 1.00 0.00 C ATOM 1387 CG LYS A 455 -3.969 -9.105 0.020 1.00 0.00 C ATOM 1388 CD LYS A 455 -4.034 -7.611 -0.252 1.00 0.00 C ATOM 1389 CE LYS A 455 -5.312 -7.235 -0.985 1.00 0.00 C ATOM 1390 NZ LYS A 455 -5.464 -7.991 -2.259 1.00 0.00 N ATOM 0 H LYS A 455 -4.283 -8.930 3.419 1.00 0.00 H new ATOM 0 HA LYS A 455 -4.371 -11.138 1.543 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -2.993 -8.501 1.827 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -2.131 -9.730 0.922 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -3.553 -9.616 -0.848 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -4.977 -9.493 0.166 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -3.979 -7.066 0.690 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -3.171 -7.310 -0.845 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.170 -7.431 -0.342 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -5.309 -6.166 -1.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -6.157 -7.510 -2.868 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -4.547 -8.037 -2.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -5.795 -8.955 -2.053 1.00 0.00 H new ATOM 1404 N GLY A 456 -2.239 -11.035 3.981 1.00 0.00 N ATOM 1405 CA GLY A 456 -1.187 -11.776 4.649 1.00 0.00 C ATOM 1406 C GLY A 456 -1.656 -13.129 5.144 1.00 0.00 C ATOM 1407 O GLY A 456 -1.600 -14.119 4.414 1.00 0.00 O ATOM 0 H GLY A 456 -2.651 -10.284 4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.351 -11.913 3.963 1.00 0.00 H new ATOM 0 HA3 GLY A 456 -0.815 -11.193 5.492 1.00 0.00 H new ATOM 1411 N LEU A 457 -2.118 -13.173 6.390 1.00 0.00 N ATOM 1412 CA LEU A 457 -2.598 -14.415 6.985 1.00 0.00 C ATOM 1413 C LEU A 457 -1.464 -15.427 7.120 1.00 0.00 C ATOM 1414 O LEU A 457 -1.139 -15.801 8.267 1.00 0.00 O ATOM 1415 CB LEU A 457 -3.734 -15.006 6.144 1.00 0.00 C ATOM 1416 CG LEU A 457 -5.120 -14.932 6.785 1.00 0.00 C ATOM 1417 CD1 LEU A 457 -6.186 -14.689 5.727 1.00 0.00 C ATOM 1418 CD2 LEU A 457 -5.416 -16.209 7.558 1.00 0.00 C ATOM 1419 OXT LEU A 457 -0.910 -15.836 6.078 1.00 0.00 O ATOM 0 H LEU A 457 -2.170 -12.362 7.007 1.00 0.00 H new ATOM 0 HA LEU A 457 -2.978 -14.189 7.981 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -3.765 -14.486 5.187 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -3.504 -16.050 5.932 1.00 0.00 H new ATOM 0 HG LEU A 457 -5.133 -14.095 7.483 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -7.166 -14.639 6.202 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -5.983 -13.748 5.215 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -6.174 -15.505 5.004 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -6.406 -16.140 8.008 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -5.384 -17.061 6.879 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -4.670 -16.341 8.341 1.00 0.00 H new