USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 537 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 387 TYR OH : rot 30:sc= -4.86! USER MOD Set 1.2: A 404 CYS SG : rot 109:sc= 0.751 USER MOD Single : A 369 ASN : amide:sc= -2.87! K(o=-2.9!,f=-1.2) USER MOD Single : A 371 LYS NZ :NH3+ 146:sc=-0.00498 (180deg=-0.293) USER MOD Single : A 373 GLN : amide:sc= -8.29! K(o=-8.3!,f=-3.9) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 92:sc= 0.269 USER MOD Single : A 380 TYR OH : rot -125:sc= 0.726 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= -2.93! K(o=-2.9!,f=-1.4) USER MOD Single : A 389 THR OG1 : rot 150:sc= -2.21! USER MOD Single : A 399 ASN : amide:sc= -1.03 K(o=-1,f=-0.35) USER MOD Single : A 400 SER OG : rot 62:sc= -0.785 USER MOD Single : A 410 THR OG1 : rot 36:sc= 0.117 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.33 USER MOD Single : A 419 ASN : amide:sc= -4.78! K(o=-4.8!,f=-1) USER MOD Single : A 421 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 ASN : amide:sc= -2.26 K(o=-2.3,f=-3.4!) USER MOD Single : A 435 LYS NZ :NH3+ -167:sc=-0.00419 (180deg=-0.115) USER MOD Single : A 436 LYS NZ :NH3+ -176:sc= 0.0968 (180deg=0.0948) USER MOD Single : A 437 MET CE :methyl -122:sc= 0 (180deg=-0.629) USER MOD Single : A 441 TYR OH : rot 30:sc= 0 USER MOD Single : A 443 LYS NZ :NH3+ -136:sc= 0.0408 (180deg=-0.291) USER MOD Single : A 444 GLN : amide:sc= -0.285 X(o=-0.29,f=0) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.540 -1.978 9.373 1.00 0.00 N ATOM 103 CA ASN A 369 -2.414 -1.286 9.988 1.00 0.00 C ATOM 104 C ASN A 369 -1.458 -0.720 8.941 1.00 0.00 C ATOM 105 O ASN A 369 -0.959 0.395 9.083 1.00 0.00 O ATOM 106 CB ASN A 369 -1.665 -2.227 10.936 1.00 0.00 C ATOM 107 CG ASN A 369 -0.863 -3.283 10.199 1.00 0.00 C ATOM 108 OD1 ASN A 369 -1.262 -4.446 10.125 1.00 0.00 O ATOM 109 ND2 ASN A 369 0.277 -2.881 9.651 1.00 0.00 N ATOM 0 HA ASN A 369 -2.814 -0.448 10.558 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -0.995 -1.643 11.567 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -2.381 -2.716 11.597 1.00 0.00 H new ATOM 0 HD21 ASN A 369 0.861 -3.546 9.144 1.00 0.00 H new ATOM 0 HD22 ASN A 369 0.569 -1.907 9.737 1.00 0.00 H new ATOM 116 N ALA A 370 -1.202 -1.494 7.894 1.00 0.00 N ATOM 117 CA ALA A 370 -0.300 -1.058 6.833 1.00 0.00 C ATOM 118 C ALA A 370 -0.959 -0.007 5.949 1.00 0.00 C ATOM 119 O ALA A 370 -0.296 0.903 5.453 1.00 0.00 O ATOM 120 CB ALA A 370 0.157 -2.248 6.000 1.00 0.00 C ATOM 0 H ALA A 370 -1.603 -2.422 7.756 1.00 0.00 H new ATOM 0 HA ALA A 370 0.574 -0.603 7.299 1.00 0.00 H new ATOM 0 HB1 ALA A 370 0.829 -1.905 5.213 1.00 0.00 H new ATOM 0 HB2 ALA A 370 0.680 -2.960 6.639 1.00 0.00 H new ATOM 0 HB3 ALA A 370 -0.710 -2.732 5.551 1.00 0.00 H new ATOM 126 N LYS A 371 -2.269 -0.131 5.760 1.00 0.00 N ATOM 127 CA LYS A 371 -3.007 0.822 4.940 1.00 0.00 C ATOM 128 C LYS A 371 -3.298 2.093 5.727 1.00 0.00 C ATOM 129 O LYS A 371 -3.362 3.183 5.162 1.00 0.00 O ATOM 130 CB LYS A 371 -4.312 0.203 4.434 1.00 0.00 C ATOM 131 CG LYS A 371 -4.557 0.433 2.952 1.00 0.00 C ATOM 132 CD LYS A 371 -6.028 0.292 2.600 1.00 0.00 C ATOM 133 CE LYS A 371 -6.822 1.523 3.010 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.685 1.256 4.193 1.00 0.00 N ATOM 0 H LYS A 371 -2.838 -0.877 6.161 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.389 1.079 4.080 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -4.296 -0.869 4.629 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -5.145 0.618 5.001 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -4.210 1.429 2.675 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.973 -0.281 2.371 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -6.132 0.132 1.527 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.439 -0.588 3.095 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -6.136 2.339 3.237 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -7.441 1.851 2.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.746 2.113 4.779 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.637 0.986 3.874 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.275 0.482 4.754 1.00 0.00 H new ATOM 148 N ARG A 372 -3.458 1.949 7.040 1.00 0.00 N ATOM 149 CA ARG A 372 -3.724 3.094 7.901 1.00 0.00 C ATOM 150 C ARG A 372 -2.434 3.867 8.157 1.00 0.00 C ATOM 151 O ARG A 372 -2.448 5.084 8.339 1.00 0.00 O ATOM 152 CB ARG A 372 -4.355 2.635 9.222 1.00 0.00 C ATOM 153 CG ARG A 372 -3.358 2.115 10.247 1.00 0.00 C ATOM 154 CD ARG A 372 -3.101 3.135 11.345 1.00 0.00 C ATOM 155 NE ARG A 372 -1.796 2.942 11.975 1.00 0.00 N ATOM 156 CZ ARG A 372 -1.495 3.359 13.204 1.00 0.00 C ATOM 157 NH1 ARG A 372 -2.398 3.999 13.938 1.00 0.00 N ATOM 158 NH2 ARG A 372 -0.286 3.137 13.701 1.00 0.00 N ATOM 0 H ARG A 372 -3.408 1.054 7.528 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.430 3.756 7.400 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -4.904 3.470 9.658 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.082 1.851 9.010 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -3.736 1.193 10.688 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -2.419 1.870 9.750 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -3.157 4.140 10.927 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -3.883 3.060 12.100 1.00 0.00 H new ATOM 0 HE ARG A 372 -1.073 2.459 11.442 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -3.330 4.174 13.562 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -2.160 4.315 14.878 1.00 0.00 H new ATOM 0 HH21 ARG A 372 0.413 2.647 13.142 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -0.055 3.456 14.642 1.00 0.00 H new ATOM 170 N GLN A 373 -1.321 3.141 8.152 1.00 0.00 N ATOM 171 CA GLN A 373 -0.012 3.738 8.364 1.00 0.00 C ATOM 172 C GLN A 373 0.383 4.581 7.160 1.00 0.00 C ATOM 173 O GLN A 373 0.852 5.710 7.305 1.00 0.00 O ATOM 174 CB GLN A 373 1.026 2.636 8.615 1.00 0.00 C ATOM 175 CG GLN A 373 2.462 3.133 8.638 1.00 0.00 C ATOM 176 CD GLN A 373 2.766 3.971 9.863 1.00 0.00 C ATOM 177 OE1 GLN A 373 3.516 3.554 10.746 1.00 0.00 O ATOM 178 NE2 GLN A 373 2.181 5.159 9.921 1.00 0.00 N ATOM 0 H GLN A 373 -1.302 2.132 8.002 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.053 4.388 9.238 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.804 2.152 9.566 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.928 1.875 7.840 1.00 0.00 H new ATOM 0 HG2 GLN A 373 3.139 2.279 8.609 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.653 3.723 7.742 1.00 0.00 H new ATOM 0 HE21 GLN A 373 1.567 5.463 9.165 1.00 0.00 H new ATOM 0 HE22 GLN A 373 2.345 5.770 10.721 1.00 0.00 H new ATOM 187 N LEU A 374 0.178 4.031 5.970 1.00 0.00 N ATOM 188 CA LEU A 374 0.503 4.736 4.739 1.00 0.00 C ATOM 189 C LEU A 374 -0.425 5.927 4.543 1.00 0.00 C ATOM 190 O LEU A 374 0.015 7.020 4.188 1.00 0.00 O ATOM 191 CB LEU A 374 0.403 3.785 3.546 1.00 0.00 C ATOM 192 CG LEU A 374 1.254 4.167 2.332 1.00 0.00 C ATOM 193 CD1 LEU A 374 2.696 4.417 2.746 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.186 3.078 1.271 1.00 0.00 C ATOM 0 H LEU A 374 -0.212 3.099 5.832 1.00 0.00 H new ATOM 0 HA LEU A 374 1.526 5.105 4.811 1.00 0.00 H new ATOM 0 HB2 LEU A 374 0.693 2.787 3.873 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.640 3.728 3.234 1.00 0.00 H new ATOM 0 HG LEU A 374 0.854 5.088 1.909 1.00 0.00 H new ATOM 0 HD11 LEU A 374 3.285 4.687 1.869 1.00 0.00 H new ATOM 0 HD12 LEU A 374 2.731 5.230 3.471 1.00 0.00 H new ATOM 0 HD13 LEU A 374 3.108 3.513 3.195 1.00 0.00 H new ATOM 0 HD21 LEU A 374 1.796 3.365 0.415 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.560 2.142 1.686 1.00 0.00 H new ATOM 0 HD23 LEU A 374 0.152 2.945 0.951 1.00 0.00 H new ATOM 206 N TYR A 375 -1.712 5.711 4.783 1.00 0.00 N ATOM 207 CA TYR A 375 -2.702 6.770 4.638 1.00 0.00 C ATOM 208 C TYR A 375 -2.477 7.867 5.672 1.00 0.00 C ATOM 209 O TYR A 375 -2.785 9.035 5.429 1.00 0.00 O ATOM 210 CB TYR A 375 -4.114 6.202 4.779 1.00 0.00 C ATOM 211 CG TYR A 375 -5.132 6.881 3.892 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.743 8.065 4.284 1.00 0.00 C ATOM 213 CD2 TYR A 375 -5.480 6.338 2.663 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.674 8.688 3.475 1.00 0.00 C ATOM 215 CE2 TYR A 375 -6.409 6.954 1.849 1.00 0.00 C ATOM 216 CZ TYR A 375 -7.004 8.129 2.258 1.00 0.00 C ATOM 217 OH TYR A 375 -7.930 8.745 1.450 1.00 0.00 O ATOM 0 H TYR A 375 -2.094 4.813 5.079 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.592 7.203 3.644 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.093 5.138 4.545 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.431 6.294 5.818 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -5.486 8.506 5.236 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -5.016 5.418 2.338 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -7.141 9.608 3.794 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -6.669 6.518 0.896 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.047 8.223 0.629 1.00 0.00 H new ATOM 227 N SER A 376 -1.939 7.487 6.827 1.00 0.00 N ATOM 228 CA SER A 376 -1.675 8.444 7.893 1.00 0.00 C ATOM 229 C SER A 376 -0.291 9.073 7.742 1.00 0.00 C ATOM 230 O SER A 376 0.031 10.049 8.421 1.00 0.00 O ATOM 231 CB SER A 376 -1.791 7.762 9.256 1.00 0.00 C ATOM 232 OG SER A 376 -3.148 7.566 9.616 1.00 0.00 O ATOM 0 H SER A 376 -1.678 6.526 7.047 1.00 0.00 H new ATOM 0 HA SER A 376 -2.419 9.237 7.823 1.00 0.00 H new ATOM 0 HB2 SER A 376 -1.276 6.802 9.230 1.00 0.00 H new ATOM 0 HB3 SER A 376 -1.295 8.369 10.013 1.00 0.00 H new ATOM 0 HG SER A 376 -3.441 6.680 9.317 1.00 0.00 H new ATOM 238 N LEU A 377 0.531 8.507 6.859 1.00 0.00 N ATOM 239 CA LEU A 377 1.877 9.019 6.641 1.00 0.00 C ATOM 240 C LEU A 377 2.004 9.742 5.303 1.00 0.00 C ATOM 241 O LEU A 377 2.909 10.555 5.121 1.00 0.00 O ATOM 242 CB LEU A 377 2.895 7.879 6.717 1.00 0.00 C ATOM 243 CG LEU A 377 3.539 7.667 8.091 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.524 7.880 9.206 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.146 6.276 8.182 1.00 0.00 C ATOM 0 H LEU A 377 0.287 7.698 6.287 1.00 0.00 H new ATOM 0 HA LEU A 377 2.081 9.744 7.429 1.00 0.00 H new ATOM 0 HB2 LEU A 377 2.403 6.954 6.418 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.684 8.069 5.990 1.00 0.00 H new ATOM 0 HG LEU A 377 4.334 8.403 8.212 1.00 0.00 H new ATOM 0 HD11 LEU A 377 3.006 7.724 10.171 1.00 0.00 H new ATOM 0 HD12 LEU A 377 2.135 8.897 9.155 1.00 0.00 H new ATOM 0 HD13 LEU A 377 1.703 7.172 9.091 1.00 0.00 H new ATOM 0 HD21 LEU A 377 4.600 6.141 9.164 1.00 0.00 H new ATOM 0 HD22 LEU A 377 3.366 5.528 8.036 1.00 0.00 H new ATOM 0 HD23 LEU A 377 4.908 6.160 7.411 1.00 0.00 H new ATOM 257 N ILE A 378 1.110 9.449 4.363 1.00 0.00 N ATOM 258 CA ILE A 378 1.166 10.092 3.056 1.00 0.00 C ATOM 259 C ILE A 378 -0.225 10.393 2.497 1.00 0.00 C ATOM 260 O ILE A 378 -0.425 11.412 1.836 1.00 0.00 O ATOM 261 CB ILE A 378 1.967 9.247 2.041 1.00 0.00 C ATOM 262 CG1 ILE A 378 1.220 7.964 1.670 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.338 8.910 2.610 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.762 7.296 0.426 1.00 0.00 C ATOM 0 H ILE A 378 0.349 8.780 4.480 1.00 0.00 H new ATOM 0 HA ILE A 378 1.681 11.041 3.207 1.00 0.00 H new ATOM 0 HB ILE A 378 2.089 9.837 1.133 1.00 0.00 H new ATOM 0 HG12 ILE A 378 1.277 7.264 2.504 1.00 0.00 H new ATOM 0 HG13 ILE A 378 0.166 8.196 1.520 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.895 8.314 1.887 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.882 9.831 2.817 1.00 0.00 H new ATOM 0 HG23 ILE A 378 3.219 8.343 3.533 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.188 6.393 0.219 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.680 7.980 -0.419 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.809 7.034 0.581 1.00 0.00 H new ATOM 276 N GLY A 379 -1.183 9.510 2.762 1.00 0.00 N ATOM 277 CA GLY A 379 -2.533 9.717 2.270 1.00 0.00 C ATOM 278 C GLY A 379 -3.138 11.017 2.767 1.00 0.00 C ATOM 279 O GLY A 379 -3.564 11.109 3.917 1.00 0.00 O ATOM 0 H GLY A 379 -1.049 8.658 3.307 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.523 9.718 1.180 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.162 8.884 2.583 1.00 0.00 H new ATOM 283 N TYR A 380 -3.179 12.023 1.896 1.00 0.00 N ATOM 284 CA TYR A 380 -3.740 13.319 2.256 1.00 0.00 C ATOM 285 C TYR A 380 -4.914 13.680 1.351 1.00 0.00 C ATOM 286 O TYR A 380 -4.966 14.774 0.789 1.00 0.00 O ATOM 287 CB TYR A 380 -2.667 14.412 2.186 1.00 0.00 C ATOM 288 CG TYR A 380 -1.732 14.294 0.999 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.217 14.040 -0.279 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.359 14.443 1.160 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.361 13.939 -1.360 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.501 14.343 0.086 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.002 14.091 -1.173 1.00 0.00 C ATOM 294 OH TYR A 380 0.854 13.993 -2.247 1.00 0.00 O ATOM 0 H TYR A 380 -2.831 11.964 0.939 1.00 0.00 H new ATOM 0 HA TYR A 380 -4.105 13.249 3.281 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.158 15.385 2.152 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.077 14.385 3.102 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.280 13.920 -0.430 1.00 0.00 H new ATOM 0 HD2 TYR A 380 0.041 14.641 2.143 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.754 13.742 -2.346 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.565 14.462 0.231 1.00 0.00 H new ATOM 0 HH TYR A 380 1.535 13.314 -2.061 1.00 0.00 H new ATOM 304 N ALA A 381 -5.856 12.751 1.214 1.00 0.00 N ATOM 305 CA ALA A 381 -7.034 12.966 0.378 1.00 0.00 C ATOM 306 C ALA A 381 -6.664 12.975 -1.102 1.00 0.00 C ATOM 307 O ALA A 381 -7.094 12.108 -1.863 1.00 0.00 O ATOM 308 CB ALA A 381 -7.727 14.267 0.758 1.00 0.00 C ATOM 0 H ALA A 381 -5.827 11.840 1.672 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.723 12.139 0.550 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -8.603 14.411 0.125 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -8.037 14.223 1.802 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -7.038 15.100 0.619 1.00 0.00 H new ATOM 314 N SER A 382 -5.863 13.958 -1.505 1.00 0.00 N ATOM 315 CA SER A 382 -5.435 14.077 -2.896 1.00 0.00 C ATOM 316 C SER A 382 -4.830 12.768 -3.393 1.00 0.00 C ATOM 317 O SER A 382 -4.947 12.424 -4.570 1.00 0.00 O ATOM 318 CB SER A 382 -4.419 15.211 -3.042 1.00 0.00 C ATOM 319 OG SER A 382 -5.046 16.405 -3.477 1.00 0.00 O ATOM 0 H SER A 382 -5.497 14.683 -0.888 1.00 0.00 H new ATOM 0 HA SER A 382 -6.312 14.303 -3.503 1.00 0.00 H new ATOM 0 HB2 SER A 382 -3.923 15.384 -2.087 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.647 14.922 -3.755 1.00 0.00 H new ATOM 0 HG SER A 382 -4.376 17.115 -3.561 1.00 0.00 H new ATOM 325 N LEU A 383 -4.186 12.039 -2.487 1.00 0.00 N ATOM 326 CA LEU A 383 -3.566 10.766 -2.828 1.00 0.00 C ATOM 327 C LEU A 383 -4.503 9.606 -2.509 1.00 0.00 C ATOM 328 O LEU A 383 -4.429 9.017 -1.431 1.00 0.00 O ATOM 329 CB LEU A 383 -2.247 10.596 -2.072 1.00 0.00 C ATOM 330 CG LEU A 383 -1.235 9.661 -2.736 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.423 10.409 -3.781 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.320 9.039 -1.691 1.00 0.00 C ATOM 0 H LEU A 383 -4.080 12.310 -1.509 1.00 0.00 H new ATOM 0 HA LEU A 383 -3.363 10.763 -3.899 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.787 11.577 -1.950 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.465 10.220 -1.072 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.781 8.861 -3.235 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.292 9.728 -4.243 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -1.091 10.806 -4.545 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.114 11.230 -3.306 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.394 8.377 -2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.218 9.827 -1.164 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.916 8.468 -0.979 1.00 0.00 H new ATOM 344 N ARG A 384 -5.384 9.286 -3.450 1.00 0.00 N ATOM 345 CA ARG A 384 -6.338 8.199 -3.268 1.00 0.00 C ATOM 346 C ARG A 384 -5.619 6.861 -3.131 1.00 0.00 C ATOM 347 O ARG A 384 -5.529 6.092 -4.086 1.00 0.00 O ATOM 348 CB ARG A 384 -7.314 8.147 -4.445 1.00 0.00 C ATOM 349 CG ARG A 384 -8.642 7.491 -4.103 1.00 0.00 C ATOM 350 CD ARG A 384 -9.678 7.733 -5.190 1.00 0.00 C ATOM 351 NE ARG A 384 -11.041 7.563 -4.695 1.00 0.00 N ATOM 352 CZ ARG A 384 -12.121 7.574 -5.475 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.999 7.745 -6.785 1.00 0.00 N ATOM 354 NH2 ARG A 384 -13.325 7.412 -4.943 1.00 0.00 N ATOM 0 H ARG A 384 -5.457 9.765 -4.348 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.895 8.388 -2.350 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -7.499 9.161 -4.798 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -6.850 7.603 -5.268 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.496 6.419 -3.970 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -9.009 7.883 -3.155 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -9.559 8.742 -5.586 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.504 7.044 -6.016 1.00 0.00 H new ATOM 0 HE ARG A 384 -11.174 7.428 -3.693 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -11.075 7.869 -7.199 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.829 7.753 -7.378 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -13.424 7.279 -3.937 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -14.152 7.420 -5.540 1.00 0.00 H new ATOM 366 N LEU A 385 -5.109 6.591 -1.933 1.00 0.00 N ATOM 367 CA LEU A 385 -4.399 5.345 -1.669 1.00 0.00 C ATOM 368 C LEU A 385 -5.327 4.145 -1.841 1.00 0.00 C ATOM 369 O LEU A 385 -6.154 3.860 -0.975 1.00 0.00 O ATOM 370 CB LEU A 385 -3.809 5.362 -0.254 1.00 0.00 C ATOM 371 CG LEU A 385 -3.300 4.011 0.261 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.997 4.186 1.026 1.00 0.00 C ATOM 373 CD2 LEU A 385 -4.351 3.344 1.137 1.00 0.00 C ATOM 0 H LEU A 385 -5.174 7.218 -1.131 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.586 5.254 -2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -2.985 6.075 -0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.569 5.731 0.434 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.108 3.366 -0.597 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.652 3.216 1.383 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.244 4.619 0.368 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -2.160 4.849 1.876 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.973 2.386 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -4.575 3.986 1.989 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -5.259 3.182 0.556 1.00 0.00 H new ATOM 385 N HIS A 386 -5.181 3.444 -2.960 1.00 0.00 N ATOM 386 CA HIS A 386 -6.000 2.274 -3.240 1.00 0.00 C ATOM 387 C HIS A 386 -5.126 1.103 -3.675 1.00 0.00 C ATOM 388 O HIS A 386 -4.068 1.296 -4.273 1.00 0.00 O ATOM 389 CB HIS A 386 -7.044 2.592 -4.314 1.00 0.00 C ATOM 390 CG HIS A 386 -6.466 2.794 -5.682 1.00 0.00 C ATOM 391 ND1 HIS A 386 -6.260 1.762 -6.572 1.00 0.00 N ATOM 392 CD2 HIS A 386 -6.057 3.920 -6.313 1.00 0.00 C ATOM 393 CE1 HIS A 386 -5.748 2.243 -7.691 1.00 0.00 C ATOM 394 NE2 HIS A 386 -5.616 3.550 -7.559 1.00 0.00 N ATOM 0 H HIS A 386 -4.502 3.667 -3.688 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.523 1.994 -2.326 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.770 1.780 -4.353 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -7.588 3.491 -4.024 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -6.075 4.922 -5.911 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -5.483 1.666 -8.564 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -5.246 4.183 -8.268 1.00 0.00 H new ATOM 403 N TYR A 387 -5.565 -0.111 -3.362 1.00 0.00 N ATOM 404 CA TYR A 387 -4.808 -1.304 -3.713 1.00 0.00 C ATOM 405 C TYR A 387 -5.505 -2.115 -4.795 1.00 0.00 C ATOM 406 O TYR A 387 -6.728 -2.257 -4.794 1.00 0.00 O ATOM 407 CB TYR A 387 -4.580 -2.167 -2.475 1.00 0.00 C ATOM 408 CG TYR A 387 -3.467 -1.653 -1.596 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.554 -0.401 -1.002 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.327 -2.411 -1.370 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.535 0.081 -0.206 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.304 -1.936 -0.575 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.412 -0.689 0.005 1.00 0.00 C ATOM 414 OH TYR A 387 -0.397 -0.210 0.796 1.00 0.00 O ATOM 0 H TYR A 387 -6.438 -0.293 -2.868 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.846 -0.980 -4.109 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.502 -2.212 -1.895 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.349 -3.186 -2.786 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.433 0.205 -1.165 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -2.239 -3.387 -1.823 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.617 1.057 0.249 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.423 -2.538 -0.408 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.768 0.389 1.477 1.00 0.00 H new ATOM 424 N VAL A 388 -4.712 -2.646 -5.718 1.00 0.00 N ATOM 425 CA VAL A 388 -5.234 -3.445 -6.811 1.00 0.00 C ATOM 426 C VAL A 388 -4.740 -4.886 -6.717 1.00 0.00 C ATOM 427 O VAL A 388 -3.740 -5.251 -7.335 1.00 0.00 O ATOM 428 CB VAL A 388 -4.823 -2.857 -8.173 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.422 -3.664 -9.315 1.00 0.00 C ATOM 430 CG2 VAL A 388 -5.236 -1.396 -8.267 1.00 0.00 C ATOM 0 H VAL A 388 -3.698 -2.534 -5.727 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.321 -3.432 -6.731 1.00 0.00 H new ATOM 0 HB VAL A 388 -3.738 -2.913 -8.257 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -5.117 -3.229 -10.267 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.069 -4.694 -9.257 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.509 -3.648 -9.240 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -4.938 -0.995 -9.236 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -6.318 -1.316 -8.158 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -4.749 -0.828 -7.474 1.00 0.00 H new ATOM 440 N THR A 389 -5.450 -5.701 -5.943 1.00 0.00 N ATOM 441 CA THR A 389 -5.087 -7.102 -5.775 1.00 0.00 C ATOM 442 C THR A 389 -5.583 -7.920 -6.963 1.00 0.00 C ATOM 443 O THR A 389 -6.788 -8.051 -7.176 1.00 0.00 O ATOM 444 CB THR A 389 -5.678 -7.655 -4.474 1.00 0.00 C ATOM 445 OG1 THR A 389 -5.308 -6.864 -3.358 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.288 -9.092 -4.189 1.00 0.00 C ATOM 0 H THR A 389 -6.279 -5.415 -5.423 1.00 0.00 H new ATOM 0 HA THR A 389 -4.001 -7.175 -5.724 1.00 0.00 H new ATOM 0 HB THR A 389 -6.757 -7.621 -4.625 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.014 -6.905 -2.679 1.00 0.00 H new ATOM 0 HG21 THR A 389 -5.744 -9.414 -3.252 1.00 0.00 H new ATOM 0 HG22 THR A 389 -5.636 -9.731 -5.000 1.00 0.00 H new ATOM 0 HG23 THR A 389 -4.203 -9.166 -4.109 1.00 0.00 H new ATOM 594 N ASN A 399 0.904 -16.603 -6.966 1.00 0.00 N ATOM 595 CA ASN A 399 0.890 -15.757 -5.776 1.00 0.00 C ATOM 596 C ASN A 399 -0.158 -14.661 -5.903 1.00 0.00 C ATOM 597 O ASN A 399 -0.605 -14.339 -7.004 1.00 0.00 O ATOM 598 CB ASN A 399 2.262 -15.121 -5.541 1.00 0.00 C ATOM 599 CG ASN A 399 3.405 -15.985 -6.029 1.00 0.00 C ATOM 600 OD1 ASN A 399 4.158 -16.551 -5.236 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.538 -16.087 -7.342 1.00 0.00 N ATOM 0 HA ASN A 399 0.642 -16.392 -4.926 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.301 -14.156 -6.047 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.389 -14.927 -4.476 1.00 0.00 H new ATOM 0 HD21 ASN A 399 4.289 -16.653 -7.736 1.00 0.00 H new ATOM 0 HD22 ASN A 399 2.889 -15.599 -7.960 1.00 0.00 H new ATOM 608 N SER A 400 -0.534 -14.078 -4.771 1.00 0.00 N ATOM 609 CA SER A 400 -1.514 -13.005 -4.761 1.00 0.00 C ATOM 610 C SER A 400 -0.807 -11.657 -4.851 1.00 0.00 C ATOM 611 O SER A 400 -0.489 -11.038 -3.836 1.00 0.00 O ATOM 612 CB SER A 400 -2.381 -13.073 -3.502 1.00 0.00 C ATOM 613 OG SER A 400 -2.216 -14.312 -2.833 1.00 0.00 O ATOM 0 H SER A 400 -0.174 -14.331 -3.851 1.00 0.00 H new ATOM 0 HA SER A 400 -2.167 -13.121 -5.626 1.00 0.00 H new ATOM 0 HB2 SER A 400 -2.117 -12.256 -2.831 1.00 0.00 H new ATOM 0 HB3 SER A 400 -3.429 -12.938 -3.771 1.00 0.00 H new ATOM 0 HG SER A 400 -1.283 -14.409 -2.550 1.00 0.00 H new ATOM 619 N ILE A 401 -0.547 -11.228 -6.078 1.00 0.00 N ATOM 620 CA ILE A 401 0.140 -9.974 -6.332 1.00 0.00 C ATOM 621 C ILE A 401 -0.811 -8.785 -6.218 1.00 0.00 C ATOM 622 O ILE A 401 -1.878 -8.766 -6.832 1.00 0.00 O ATOM 623 CB ILE A 401 0.805 -10.005 -7.731 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.228 -9.453 -7.658 1.00 0.00 C ATOM 625 CG2 ILE A 401 -0.015 -9.239 -8.763 1.00 0.00 C ATOM 626 CD1 ILE A 401 2.310 -8.059 -7.074 1.00 0.00 C ATOM 0 H ILE A 401 -0.806 -11.739 -6.922 1.00 0.00 H new ATOM 0 HA ILE A 401 0.914 -9.852 -5.574 1.00 0.00 H new ATOM 0 HB ILE A 401 0.847 -11.045 -8.053 1.00 0.00 H new ATOM 0 HG12 ILE A 401 2.839 -10.126 -7.056 1.00 0.00 H new ATOM 0 HG13 ILE A 401 2.657 -9.443 -8.660 1.00 0.00 H new ATOM 0 HG21 ILE A 401 0.484 -9.284 -9.731 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -1.006 -9.686 -8.845 1.00 0.00 H new ATOM 0 HG23 ILE A 401 -0.111 -8.199 -8.452 1.00 0.00 H new ATOM 0 HD11 ILE A 401 3.350 -7.734 -7.054 1.00 0.00 H new ATOM 0 HD12 ILE A 401 1.727 -7.373 -7.688 1.00 0.00 H new ATOM 0 HD13 ILE A 401 1.912 -8.066 -6.059 1.00 0.00 H new ATOM 638 N VAL A 402 -0.409 -7.790 -5.435 1.00 0.00 N ATOM 639 CA VAL A 402 -1.212 -6.592 -5.247 1.00 0.00 C ATOM 640 C VAL A 402 -0.367 -5.348 -5.495 1.00 0.00 C ATOM 641 O VAL A 402 0.842 -5.352 -5.263 1.00 0.00 O ATOM 642 CB VAL A 402 -1.826 -6.534 -3.833 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.502 -5.192 -3.584 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.815 -7.674 -3.640 1.00 0.00 C ATOM 0 H VAL A 402 0.471 -7.792 -4.920 1.00 0.00 H new ATOM 0 HA VAL A 402 -2.029 -6.627 -5.967 1.00 0.00 H new ATOM 0 HB VAL A 402 -1.020 -6.643 -3.107 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.926 -5.179 -2.580 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.768 -4.392 -3.678 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.297 -5.044 -4.315 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -3.241 -7.621 -2.638 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -3.613 -7.592 -4.378 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -2.301 -8.627 -3.766 1.00 0.00 H new ATOM 654 N GLU A 403 -1.005 -4.289 -5.976 1.00 0.00 N ATOM 655 CA GLU A 403 -0.299 -3.049 -6.262 1.00 0.00 C ATOM 656 C GLU A 403 -1.032 -1.842 -5.685 1.00 0.00 C ATOM 657 O GLU A 403 -2.217 -1.637 -5.948 1.00 0.00 O ATOM 658 CB GLU A 403 -0.122 -2.875 -7.772 1.00 0.00 C ATOM 659 CG GLU A 403 0.907 -3.819 -8.374 1.00 0.00 C ATOM 660 CD GLU A 403 1.284 -3.440 -9.794 1.00 0.00 C ATOM 661 OE1 GLU A 403 0.378 -3.069 -10.570 1.00 0.00 O ATOM 662 OE2 GLU A 403 2.485 -3.515 -10.128 1.00 0.00 O ATOM 0 H GLU A 403 -2.005 -4.264 -6.175 1.00 0.00 H new ATOM 0 HA GLU A 403 0.680 -3.110 -5.787 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -1.082 -3.035 -8.263 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.175 -1.847 -7.979 1.00 0.00 H new ATOM 0 HG2 GLU A 403 1.802 -3.820 -7.752 1.00 0.00 H new ATOM 0 HG3 GLU A 403 0.512 -4.835 -8.365 1.00 0.00 H new ATOM 669 N CYS A 404 -0.311 -1.042 -4.908 1.00 0.00 N ATOM 670 CA CYS A 404 -0.877 0.155 -4.301 1.00 0.00 C ATOM 671 C CYS A 404 -0.697 1.351 -5.227 1.00 0.00 C ATOM 672 O CYS A 404 0.424 1.810 -5.447 1.00 0.00 O ATOM 673 CB CYS A 404 -0.212 0.433 -2.951 1.00 0.00 C ATOM 674 SG CYS A 404 -0.815 1.922 -2.121 1.00 0.00 S ATOM 0 H CYS A 404 0.671 -1.202 -4.683 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.942 -0.009 -4.140 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.371 -0.424 -2.297 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.864 0.524 -3.100 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.534 1.584 -1.092 1.00 0.00 H new ATOM 680 N ARG A 405 -1.801 1.849 -5.771 1.00 0.00 N ATOM 681 CA ARG A 405 -1.754 2.985 -6.676 1.00 0.00 C ATOM 682 C ARG A 405 -2.425 4.204 -6.059 1.00 0.00 C ATOM 683 O ARG A 405 -3.435 4.088 -5.366 1.00 0.00 O ATOM 684 CB ARG A 405 -2.426 2.636 -8.005 1.00 0.00 C ATOM 685 CG ARG A 405 -1.522 1.877 -8.963 1.00 0.00 C ATOM 686 CD ARG A 405 -2.319 1.237 -10.090 1.00 0.00 C ATOM 687 NE ARG A 405 -1.508 0.315 -10.880 1.00 0.00 N ATOM 688 CZ ARG A 405 -0.591 0.704 -11.763 1.00 0.00 C ATOM 689 NH1 ARG A 405 -0.359 1.995 -11.964 1.00 0.00 N ATOM 690 NH2 ARG A 405 0.097 -0.200 -12.446 1.00 0.00 N ATOM 0 H ARG A 405 -2.737 1.483 -5.600 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.707 3.225 -6.859 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.315 2.038 -7.807 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.761 3.555 -8.486 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -0.780 2.557 -9.381 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -0.977 1.106 -8.418 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -3.172 0.702 -9.672 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -2.718 2.016 -10.739 1.00 0.00 H new ATOM 0 HE ARG A 405 -1.653 -0.686 -10.747 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -0.885 2.695 -11.441 1.00 0.00 H new ATOM 0 HH12 ARG A 405 0.345 2.287 -12.642 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -0.076 -1.194 -12.295 1.00 0.00 H new ATOM 0 HH22 ARG A 405 0.800 0.098 -13.123 1.00 0.00 H new ATOM 702 N VAL A 406 -1.854 5.373 -6.319 1.00 0.00 N ATOM 703 CA VAL A 406 -2.392 6.619 -5.793 1.00 0.00 C ATOM 704 C VAL A 406 -3.407 7.225 -6.755 1.00 0.00 C ATOM 705 O VAL A 406 -3.608 6.720 -7.860 1.00 0.00 O ATOM 706 CB VAL A 406 -1.278 7.646 -5.525 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.364 7.163 -4.409 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.486 7.917 -6.795 1.00 0.00 C ATOM 0 H VAL A 406 -1.017 5.484 -6.892 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.884 6.378 -4.851 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.739 8.581 -5.206 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.418 7.902 -4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.945 7.025 -3.497 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.091 6.215 -4.696 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.298 8.646 -6.587 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.035 6.989 -7.147 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.153 8.310 -7.562 1.00 0.00 H new ATOM 744 N THR A 410 -0.427 5.945 -10.380 1.00 0.00 N ATOM 745 CA THR A 410 0.958 5.759 -9.959 1.00 0.00 C ATOM 746 C THR A 410 1.052 4.783 -8.791 1.00 0.00 C ATOM 747 O THR A 410 0.435 4.988 -7.745 1.00 0.00 O ATOM 748 CB THR A 410 1.579 7.101 -9.568 1.00 0.00 C ATOM 749 OG1 THR A 410 1.471 8.032 -10.630 1.00 0.00 O ATOM 750 CG2 THR A 410 3.043 6.996 -9.196 1.00 0.00 C ATOM 0 HA THR A 410 1.510 5.340 -10.800 1.00 0.00 H new ATOM 0 HB THR A 410 1.021 7.434 -8.693 1.00 0.00 H new ATOM 0 HG1 THR A 410 0.618 7.900 -11.095 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.422 7.982 -8.929 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.155 6.322 -8.347 1.00 0.00 H new ATOM 0 HG23 THR A 410 3.607 6.608 -10.044 1.00 0.00 H new ATOM 758 N VAL A 411 1.831 3.721 -8.976 1.00 0.00 N ATOM 759 CA VAL A 411 2.010 2.713 -7.937 1.00 0.00 C ATOM 760 C VAL A 411 3.145 3.096 -6.992 1.00 0.00 C ATOM 761 O VAL A 411 4.298 3.215 -7.405 1.00 0.00 O ATOM 762 CB VAL A 411 2.299 1.325 -8.544 1.00 0.00 C ATOM 763 CG1 VAL A 411 3.621 1.327 -9.298 1.00 0.00 C ATOM 764 CG2 VAL A 411 2.297 0.259 -7.458 1.00 0.00 C ATOM 0 H VAL A 411 2.348 3.537 -9.836 1.00 0.00 H new ATOM 0 HA VAL A 411 1.077 2.664 -7.376 1.00 0.00 H new ATOM 0 HB VAL A 411 1.508 1.091 -9.256 1.00 0.00 H new ATOM 0 HG11 VAL A 411 3.802 0.337 -9.717 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.579 2.060 -10.104 1.00 0.00 H new ATOM 0 HG13 VAL A 411 4.430 1.585 -8.614 1.00 0.00 H new ATOM 0 HG21 VAL A 411 2.502 -0.714 -7.903 1.00 0.00 H new ATOM 0 HG22 VAL A 411 3.065 0.490 -6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.322 0.237 -6.972 1.00 0.00 H new ATOM 774 N LEU A 412 2.805 3.293 -5.724 1.00 0.00 N ATOM 775 CA LEU A 412 3.788 3.667 -4.718 1.00 0.00 C ATOM 776 C LEU A 412 4.232 2.458 -3.899 1.00 0.00 C ATOM 777 O LEU A 412 5.296 2.476 -3.281 1.00 0.00 O ATOM 778 CB LEU A 412 3.212 4.736 -3.791 1.00 0.00 C ATOM 779 CG LEU A 412 4.229 5.745 -3.255 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.283 6.972 -4.152 1.00 0.00 C ATOM 781 CD2 LEU A 412 3.887 6.139 -1.826 1.00 0.00 C ATOM 0 H LEU A 412 1.853 3.199 -5.369 1.00 0.00 H new ATOM 0 HA LEU A 412 4.660 4.067 -5.236 1.00 0.00 H new ATOM 0 HB2 LEU A 412 2.433 5.278 -4.327 1.00 0.00 H new ATOM 0 HB3 LEU A 412 2.733 4.242 -2.946 1.00 0.00 H new ATOM 0 HG LEU A 412 5.213 5.277 -3.254 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.011 7.680 -3.757 1.00 0.00 H new ATOM 0 HD12 LEU A 412 4.576 6.674 -5.159 1.00 0.00 H new ATOM 0 HD13 LEU A 412 3.300 7.442 -4.184 1.00 0.00 H new ATOM 0 HD21 LEU A 412 4.621 6.857 -1.461 1.00 0.00 H new ATOM 0 HD22 LEU A 412 2.895 6.589 -1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 412 3.900 5.253 -1.191 1.00 0.00 H new ATOM 793 N GLY A 413 3.410 1.412 -3.888 1.00 0.00 N ATOM 794 CA GLY A 413 3.747 0.220 -3.130 1.00 0.00 C ATOM 795 C GLY A 413 3.292 -1.060 -3.803 1.00 0.00 C ATOM 796 O GLY A 413 2.096 -1.285 -3.980 1.00 0.00 O ATOM 0 H GLY A 413 2.522 1.368 -4.387 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.826 0.183 -2.983 1.00 0.00 H new ATOM 0 HA3 GLY A 413 3.293 0.285 -2.141 1.00 0.00 H new ATOM 800 N THR A 414 4.251 -1.903 -4.173 1.00 0.00 N ATOM 801 CA THR A 414 3.952 -3.170 -4.823 1.00 0.00 C ATOM 802 C THR A 414 4.534 -4.333 -4.023 1.00 0.00 C ATOM 803 O THR A 414 5.669 -4.263 -3.550 1.00 0.00 O ATOM 804 CB THR A 414 4.519 -3.168 -6.244 1.00 0.00 C ATOM 805 OG1 THR A 414 3.846 -2.216 -7.049 1.00 0.00 O ATOM 806 CG2 THR A 414 4.421 -4.509 -6.941 1.00 0.00 C ATOM 0 H THR A 414 5.246 -1.728 -4.032 1.00 0.00 H new ATOM 0 HA THR A 414 2.870 -3.295 -4.870 1.00 0.00 H new ATOM 0 HB THR A 414 5.574 -2.919 -6.129 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.223 -2.228 -7.954 1.00 0.00 H new ATOM 0 HG21 THR A 414 4.843 -4.430 -7.943 1.00 0.00 H new ATOM 0 HG22 THR A 414 4.975 -5.256 -6.372 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.375 -4.808 -7.010 1.00 0.00 H new ATOM 814 N GLY A 415 3.755 -5.400 -3.872 1.00 0.00 N ATOM 815 CA GLY A 415 4.222 -6.554 -3.126 1.00 0.00 C ATOM 816 C GLY A 415 3.339 -7.773 -3.310 1.00 0.00 C ATOM 817 O GLY A 415 2.126 -7.650 -3.482 1.00 0.00 O ATOM 0 H GLY A 415 2.812 -5.486 -4.252 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.237 -6.796 -3.440 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.268 -6.301 -2.067 1.00 0.00 H new ATOM 821 N VAL A 416 3.951 -8.953 -3.274 1.00 0.00 N ATOM 822 CA VAL A 416 3.224 -10.202 -3.435 1.00 0.00 C ATOM 823 C VAL A 416 2.836 -10.785 -2.081 1.00 0.00 C ATOM 824 O VAL A 416 3.405 -10.421 -1.052 1.00 0.00 O ATOM 825 CB VAL A 416 4.073 -11.232 -4.197 1.00 0.00 C ATOM 826 CG1 VAL A 416 3.263 -12.482 -4.504 1.00 0.00 C ATOM 827 CG2 VAL A 416 4.641 -10.624 -5.472 1.00 0.00 C ATOM 0 H VAL A 416 4.955 -9.067 -3.134 1.00 0.00 H new ATOM 0 HA VAL A 416 2.321 -9.983 -4.005 1.00 0.00 H new ATOM 0 HB VAL A 416 4.908 -11.522 -3.559 1.00 0.00 H new ATOM 0 HG11 VAL A 416 3.886 -13.196 -5.044 1.00 0.00 H new ATOM 0 HG12 VAL A 416 2.920 -12.931 -3.572 1.00 0.00 H new ATOM 0 HG13 VAL A 416 2.402 -12.216 -5.117 1.00 0.00 H new ATOM 0 HG21 VAL A 416 5.239 -11.370 -5.996 1.00 0.00 H new ATOM 0 HG22 VAL A 416 3.824 -10.297 -6.115 1.00 0.00 H new ATOM 0 HG23 VAL A 416 5.268 -9.769 -5.219 1.00 0.00 H new ATOM 837 N GLY A 417 1.868 -11.693 -2.089 1.00 0.00 N ATOM 838 CA GLY A 417 1.425 -12.314 -0.856 1.00 0.00 C ATOM 839 C GLY A 417 0.672 -13.607 -1.096 1.00 0.00 C ATOM 840 O GLY A 417 0.093 -13.806 -2.163 1.00 0.00 O ATOM 0 H GLY A 417 1.382 -12.010 -2.928 1.00 0.00 H new ATOM 0 HA2 GLY A 417 2.289 -12.513 -0.222 1.00 0.00 H new ATOM 0 HA3 GLY A 417 0.784 -11.619 -0.313 1.00 0.00 H new ATOM 844 N ARG A 418 0.677 -14.487 -0.100 1.00 0.00 N ATOM 845 CA ARG A 418 -0.016 -15.765 -0.209 1.00 0.00 C ATOM 846 C ARG A 418 -1.512 -15.552 -0.415 1.00 0.00 C ATOM 847 O ARG A 418 -2.181 -16.356 -1.062 1.00 0.00 O ATOM 848 CB ARG A 418 0.223 -16.609 1.044 1.00 0.00 C ATOM 849 CG ARG A 418 1.585 -17.286 1.074 1.00 0.00 C ATOM 850 CD ARG A 418 2.090 -17.463 2.498 1.00 0.00 C ATOM 851 NE ARG A 418 3.354 -16.763 2.721 1.00 0.00 N ATOM 852 CZ ARG A 418 4.033 -16.805 3.864 1.00 0.00 C ATOM 853 NH1 ARG A 418 3.575 -17.508 4.893 1.00 0.00 N ATOM 854 NH2 ARG A 418 5.175 -16.140 3.981 1.00 0.00 N ATOM 0 H ARG A 418 1.152 -14.339 0.790 1.00 0.00 H new ATOM 0 HA ARG A 418 0.382 -16.295 -1.074 1.00 0.00 H new ATOM 0 HB2 ARG A 418 0.123 -15.973 1.924 1.00 0.00 H new ATOM 0 HB3 ARG A 418 -0.553 -17.371 1.112 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.519 -18.259 0.587 1.00 0.00 H new ATOM 0 HG3 ARG A 418 2.300 -16.692 0.505 1.00 0.00 H new ATOM 0 HD2 ARG A 418 1.341 -17.091 3.197 1.00 0.00 H new ATOM 0 HD3 ARG A 418 2.222 -18.525 2.707 1.00 0.00 H new ATOM 0 HE ARG A 418 3.738 -16.210 1.955 1.00 0.00 H new ATOM 0 HH11 ARG A 418 2.697 -18.021 4.810 1.00 0.00 H new ATOM 0 HH12 ARG A 418 4.101 -17.536 5.766 1.00 0.00 H new ATOM 0 HH21 ARG A 418 5.532 -15.597 3.195 1.00 0.00 H new ATOM 0 HH22 ARG A 418 5.696 -16.172 4.857 1.00 0.00 H new ATOM 866 N ASN A 419 -2.027 -14.459 0.140 1.00 0.00 N ATOM 867 CA ASN A 419 -3.442 -14.132 0.021 1.00 0.00 C ATOM 868 C ASN A 419 -3.633 -12.628 -0.160 1.00 0.00 C ATOM 869 O ASN A 419 -2.676 -11.899 -0.416 1.00 0.00 O ATOM 870 CB ASN A 419 -4.204 -14.612 1.258 1.00 0.00 C ATOM 871 CG ASN A 419 -3.874 -16.048 1.618 1.00 0.00 C ATOM 872 OD1 ASN A 419 -4.694 -16.948 1.443 1.00 0.00 O ATOM 873 ND2 ASN A 419 -2.667 -16.268 2.127 1.00 0.00 N ATOM 0 H ASN A 419 -1.483 -13.784 0.678 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.838 -14.641 -0.858 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -3.966 -13.965 2.102 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -5.275 -14.522 1.079 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.389 -17.214 2.390 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -2.018 -15.491 2.255 1.00 0.00 H new ATOM 880 N ILE A 420 -4.873 -12.171 -0.025 1.00 0.00 N ATOM 881 CA ILE A 420 -5.182 -10.755 -0.172 1.00 0.00 C ATOM 882 C ILE A 420 -4.724 -9.965 1.049 1.00 0.00 C ATOM 883 O ILE A 420 -4.315 -8.808 0.936 1.00 0.00 O ATOM 884 CB ILE A 420 -6.692 -10.528 -0.383 1.00 0.00 C ATOM 885 CG1 ILE A 420 -7.211 -11.419 -1.513 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.974 -9.063 -0.683 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.756 -12.746 -1.034 1.00 0.00 C ATOM 0 H ILE A 420 -5.679 -12.760 0.186 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.644 -10.402 -1.052 1.00 0.00 H new ATOM 0 HB ILE A 420 -7.215 -10.796 0.535 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.994 -10.887 -2.053 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -6.403 -11.602 -2.221 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -8.045 -8.921 -0.829 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.637 -8.449 0.152 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -6.442 -8.768 -1.588 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -8.106 -13.325 -1.888 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -6.970 -13.298 -0.519 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.586 -12.573 -0.349 1.00 0.00 H new ATOM 899 N LYS A 421 -4.792 -10.598 2.215 1.00 0.00 N ATOM 900 CA LYS A 421 -4.385 -9.956 3.458 1.00 0.00 C ATOM 901 C LYS A 421 -2.869 -9.803 3.523 1.00 0.00 C ATOM 902 O LYS A 421 -2.356 -8.739 3.870 1.00 0.00 O ATOM 903 CB LYS A 421 -4.880 -10.765 4.659 1.00 0.00 C ATOM 904 CG LYS A 421 -4.516 -10.148 6.001 1.00 0.00 C ATOM 905 CD LYS A 421 -3.541 -11.021 6.776 1.00 0.00 C ATOM 906 CE LYS A 421 -3.926 -11.120 8.244 1.00 0.00 C ATOM 907 NZ LYS A 421 -3.628 -12.465 8.806 1.00 0.00 N ATOM 0 H LYS A 421 -5.125 -11.556 2.325 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.832 -8.962 3.487 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -5.964 -10.866 4.597 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -4.463 -11.771 4.606 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -4.076 -9.164 5.841 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -5.421 -10.001 6.591 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -3.516 -12.019 6.337 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -2.535 -10.610 6.690 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -3.388 -10.362 8.812 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -4.989 -10.907 8.356 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -3.905 -12.492 9.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -4.161 -13.187 8.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -2.609 -12.658 8.723 1.00 0.00 H new ATOM 921 N ILE A 422 -2.161 -10.872 3.184 1.00 0.00 N ATOM 922 CA ILE A 422 -0.701 -10.860 3.200 1.00 0.00 C ATOM 923 C ILE A 422 -0.152 -9.896 2.156 1.00 0.00 C ATOM 924 O ILE A 422 0.590 -8.969 2.480 1.00 0.00 O ATOM 925 CB ILE A 422 -0.126 -12.273 2.950 1.00 0.00 C ATOM 926 CG1 ILE A 422 -0.425 -13.185 4.142 1.00 0.00 C ATOM 927 CG2 ILE A 422 1.375 -12.210 2.693 1.00 0.00 C ATOM 928 CD1 ILE A 422 -1.864 -13.649 4.202 1.00 0.00 C ATOM 0 H ILE A 422 -2.572 -11.759 2.894 1.00 0.00 H new ATOM 0 HA ILE A 422 -0.392 -10.526 4.190 1.00 0.00 H new ATOM 0 HB ILE A 422 -0.606 -12.686 2.063 1.00 0.00 H new ATOM 0 HG12 ILE A 422 0.228 -14.057 4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 422 -0.184 -12.656 5.064 1.00 0.00 H new ATOM 0 HG21 ILE A 422 1.757 -13.216 2.520 1.00 0.00 H new ATOM 0 HG22 ILE A 422 1.568 -11.592 1.816 1.00 0.00 H new ATOM 0 HG23 ILE A 422 1.875 -11.776 3.559 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -2.003 -14.291 5.072 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -2.522 -12.784 4.281 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -2.104 -14.207 3.297 1.00 0.00 H new ATOM 940 N ALA A 423 -0.519 -10.125 0.904 1.00 0.00 N ATOM 941 CA ALA A 423 -0.062 -9.283 -0.195 1.00 0.00 C ATOM 942 C ALA A 423 -0.306 -7.809 0.104 1.00 0.00 C ATOM 943 O ALA A 423 0.533 -6.957 -0.191 1.00 0.00 O ATOM 944 CB ALA A 423 -0.751 -9.684 -1.490 1.00 0.00 C ATOM 0 H ALA A 423 -1.134 -10.889 0.622 1.00 0.00 H new ATOM 0 HA ALA A 423 1.012 -9.429 -0.309 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.400 -9.047 -2.301 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.519 -10.724 -1.719 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.829 -9.569 -1.379 1.00 0.00 H new ATOM 950 N GLY A 424 -1.455 -7.519 0.700 1.00 0.00 N ATOM 951 CA GLY A 424 -1.786 -6.150 1.041 1.00 0.00 C ATOM 952 C GLY A 424 -0.804 -5.559 2.032 1.00 0.00 C ATOM 953 O GLY A 424 -0.400 -4.404 1.904 1.00 0.00 O ATOM 0 H GLY A 424 -2.164 -8.208 0.953 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.797 -5.543 0.136 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.791 -6.114 1.461 1.00 0.00 H new ATOM 957 N ILE A 425 -0.417 -6.359 3.021 1.00 0.00 N ATOM 958 CA ILE A 425 0.528 -5.915 4.037 1.00 0.00 C ATOM 959 C ILE A 425 1.928 -5.771 3.445 1.00 0.00 C ATOM 960 O ILE A 425 2.715 -4.934 3.888 1.00 0.00 O ATOM 961 CB ILE A 425 0.573 -6.895 5.228 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.803 -6.989 5.888 1.00 0.00 C ATOM 963 CG2 ILE A 425 1.619 -6.458 6.245 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.936 -8.150 6.847 1.00 0.00 C ATOM 0 H ILE A 425 -0.744 -7.318 3.139 1.00 0.00 H new ATOM 0 HA ILE A 425 0.187 -4.944 4.397 1.00 0.00 H new ATOM 0 HB ILE A 425 0.850 -7.880 4.853 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -1.004 -6.061 6.424 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.563 -7.080 5.112 1.00 0.00 H new ATOM 0 HG21 ILE A 425 1.634 -7.162 7.077 1.00 0.00 H new ATOM 0 HG22 ILE A 425 2.600 -6.435 5.771 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.372 -5.463 6.617 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.938 -8.154 7.277 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.767 -9.085 6.312 1.00 0.00 H new ATOM 0 HD13 ILE A 425 -0.199 -8.050 7.644 1.00 0.00 H new ATOM 976 N ARG A 426 2.229 -6.588 2.441 1.00 0.00 N ATOM 977 CA ARG A 426 3.531 -6.546 1.789 1.00 0.00 C ATOM 978 C ARG A 426 3.639 -5.327 0.882 1.00 0.00 C ATOM 979 O ARG A 426 4.660 -4.639 0.865 1.00 0.00 O ATOM 980 CB ARG A 426 3.768 -7.825 0.984 1.00 0.00 C ATOM 981 CG ARG A 426 5.157 -8.413 1.172 1.00 0.00 C ATOM 982 CD ARG A 426 5.155 -9.920 0.977 1.00 0.00 C ATOM 983 NE ARG A 426 6.107 -10.588 1.861 1.00 0.00 N ATOM 984 CZ ARG A 426 6.312 -11.903 1.870 1.00 0.00 C ATOM 985 NH1 ARG A 426 5.635 -12.692 1.045 1.00 0.00 N ATOM 986 NH2 ARG A 426 7.195 -12.430 2.707 1.00 0.00 N ATOM 0 H ARG A 426 1.589 -7.286 2.062 1.00 0.00 H new ATOM 0 HA ARG A 426 4.296 -6.472 2.561 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.025 -8.569 1.273 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.612 -7.613 -0.074 1.00 0.00 H new ATOM 0 HG2 ARG A 426 5.846 -7.954 0.463 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.522 -8.175 2.171 1.00 0.00 H new ATOM 0 HD2 ARG A 426 4.154 -10.308 1.163 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.399 -10.152 -0.060 1.00 0.00 H new ATOM 0 HE ARG A 426 6.646 -10.013 2.509 1.00 0.00 H new ATOM 0 HH11 ARG A 426 4.954 -12.291 0.400 1.00 0.00 H new ATOM 0 HH12 ARG A 426 5.796 -13.699 1.056 1.00 0.00 H new ATOM 0 HH21 ARG A 426 7.717 -11.828 3.344 1.00 0.00 H new ATOM 0 HH22 ARG A 426 7.352 -13.438 2.714 1.00 0.00 H new ATOM 998 N ALA A 427 2.574 -5.061 0.135 1.00 0.00 N ATOM 999 CA ALA A 427 2.544 -3.918 -0.768 1.00 0.00 C ATOM 1000 C ALA A 427 2.672 -2.617 0.010 1.00 0.00 C ATOM 1001 O ALA A 427 3.509 -1.771 -0.307 1.00 0.00 O ATOM 1002 CB ALA A 427 1.266 -3.926 -1.593 1.00 0.00 C ATOM 0 H ALA A 427 1.721 -5.621 0.137 1.00 0.00 H new ATOM 0 HA ALA A 427 3.393 -3.994 -1.448 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.260 -3.066 -2.262 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.218 -4.843 -2.180 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.404 -3.875 -0.928 1.00 0.00 H new ATOM 1008 N ALA A 428 1.847 -2.471 1.039 1.00 0.00 N ATOM 1009 CA ALA A 428 1.880 -1.280 1.878 1.00 0.00 C ATOM 1010 C ALA A 428 3.248 -1.132 2.520 1.00 0.00 C ATOM 1011 O ALA A 428 3.788 -0.030 2.620 1.00 0.00 O ATOM 1012 CB ALA A 428 0.796 -1.349 2.943 1.00 0.00 C ATOM 0 H ALA A 428 1.148 -3.161 1.312 1.00 0.00 H new ATOM 0 HA ALA A 428 1.691 -0.407 1.254 1.00 0.00 H new ATOM 0 HB1 ALA A 428 0.835 -0.452 3.561 1.00 0.00 H new ATOM 0 HB2 ALA A 428 -0.181 -1.418 2.464 1.00 0.00 H new ATOM 0 HB3 ALA A 428 0.956 -2.227 3.569 1.00 0.00 H new ATOM 1018 N GLU A 429 3.812 -2.258 2.938 1.00 0.00 N ATOM 1019 CA GLU A 429 5.131 -2.265 3.551 1.00 0.00 C ATOM 1020 C GLU A 429 6.172 -1.836 2.528 1.00 0.00 C ATOM 1021 O GLU A 429 7.145 -1.156 2.855 1.00 0.00 O ATOM 1022 CB GLU A 429 5.463 -3.655 4.090 1.00 0.00 C ATOM 1023 CG GLU A 429 5.065 -3.850 5.543 1.00 0.00 C ATOM 1024 CD GLU A 429 5.544 -5.173 6.107 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.570 -6.167 5.351 1.00 0.00 O ATOM 1026 OE2 GLU A 429 5.896 -5.214 7.306 1.00 0.00 O ATOM 0 H GLU A 429 3.376 -3.177 2.863 1.00 0.00 H new ATOM 0 HA GLU A 429 5.137 -1.563 4.385 1.00 0.00 H new ATOM 0 HB2 GLU A 429 4.958 -4.403 3.479 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.534 -3.830 3.988 1.00 0.00 H new ATOM 0 HG2 GLU A 429 5.474 -3.035 6.140 1.00 0.00 H new ATOM 0 HG3 GLU A 429 3.980 -3.794 5.629 1.00 0.00 H new ATOM 1033 N ASN A 430 5.945 -2.232 1.279 1.00 0.00 N ATOM 1034 CA ASN A 430 6.844 -1.886 0.190 1.00 0.00 C ATOM 1035 C ASN A 430 6.811 -0.383 -0.057 1.00 0.00 C ATOM 1036 O ASN A 430 7.818 0.222 -0.426 1.00 0.00 O ATOM 1037 CB ASN A 430 6.445 -2.638 -1.082 1.00 0.00 C ATOM 1038 CG ASN A 430 7.402 -2.384 -2.228 1.00 0.00 C ATOM 1039 OD1 ASN A 430 7.608 -1.242 -2.640 1.00 0.00 O ATOM 1040 ND2 ASN A 430 7.995 -3.451 -2.749 1.00 0.00 N ATOM 0 H ASN A 430 5.142 -2.795 0.998 1.00 0.00 H new ATOM 0 HA ASN A 430 7.858 -2.176 0.465 1.00 0.00 H new ATOM 0 HB2 ASN A 430 6.409 -3.707 -0.872 1.00 0.00 H new ATOM 0 HB3 ASN A 430 5.440 -2.337 -1.378 1.00 0.00 H new ATOM 0 HD21 ASN A 430 8.651 -3.343 -3.522 1.00 0.00 H new ATOM 0 HD22 ASN A 430 7.795 -4.379 -2.376 1.00 0.00 H new ATOM 1047 N ALA A 431 5.644 0.214 0.164 1.00 0.00 N ATOM 1048 CA ALA A 431 5.469 1.648 -0.018 1.00 0.00 C ATOM 1049 C ALA A 431 6.017 2.410 1.181 1.00 0.00 C ATOM 1050 O ALA A 431 6.493 3.538 1.049 1.00 0.00 O ATOM 1051 CB ALA A 431 3.998 1.977 -0.230 1.00 0.00 C ATOM 0 H ALA A 431 4.804 -0.276 0.470 1.00 0.00 H new ATOM 0 HA ALA A 431 6.026 1.955 -0.903 1.00 0.00 H new ATOM 0 HB1 ALA A 431 3.881 3.052 -0.365 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.633 1.459 -1.117 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.424 1.656 0.640 1.00 0.00 H new ATOM 1057 N LEU A 432 5.950 1.783 2.353 1.00 0.00 N ATOM 1058 CA LEU A 432 6.443 2.396 3.580 1.00 0.00 C ATOM 1059 C LEU A 432 7.964 2.292 3.667 1.00 0.00 C ATOM 1060 O LEU A 432 8.613 3.101 4.328 1.00 0.00 O ATOM 1061 CB LEU A 432 5.804 1.729 4.799 1.00 0.00 C ATOM 1062 CG LEU A 432 4.294 1.937 4.931 1.00 0.00 C ATOM 1063 CD1 LEU A 432 3.639 0.714 5.556 1.00 0.00 C ATOM 1064 CD2 LEU A 432 3.999 3.181 5.755 1.00 0.00 C ATOM 0 H LEU A 432 5.558 0.849 2.477 1.00 0.00 H new ATOM 0 HA LEU A 432 6.169 3.451 3.566 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.006 0.659 4.757 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.288 2.109 5.698 1.00 0.00 H new ATOM 0 HG LEU A 432 3.877 2.077 3.934 1.00 0.00 H new ATOM 0 HD11 LEU A 432 2.565 0.880 5.642 1.00 0.00 H new ATOM 0 HD12 LEU A 432 3.822 -0.158 4.928 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.060 0.542 6.547 1.00 0.00 H new ATOM 0 HD21 LEU A 432 2.920 3.314 5.839 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.430 3.069 6.750 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.435 4.053 5.267 1.00 0.00 H new ATOM 1076 N ARG A 433 8.525 1.290 2.994 1.00 0.00 N ATOM 1077 CA ARG A 433 9.969 1.082 2.994 1.00 0.00 C ATOM 1078 C ARG A 433 10.699 2.328 2.507 1.00 0.00 C ATOM 1079 O ARG A 433 11.711 2.733 3.079 1.00 0.00 O ATOM 1080 CB ARG A 433 10.333 -0.115 2.112 1.00 0.00 C ATOM 1081 CG ARG A 433 10.435 -1.425 2.876 1.00 0.00 C ATOM 1082 CD ARG A 433 11.268 -2.448 2.119 1.00 0.00 C ATOM 1083 NE ARG A 433 10.684 -3.786 2.184 1.00 0.00 N ATOM 1084 CZ ARG A 433 10.814 -4.602 3.227 1.00 0.00 C ATOM 1085 NH1 ARG A 433 11.503 -4.220 4.296 1.00 0.00 N ATOM 1086 NH2 ARG A 433 10.252 -5.803 3.203 1.00 0.00 N ATOM 0 H ARG A 433 8.001 0.610 2.442 1.00 0.00 H new ATOM 0 HA ARG A 433 10.281 0.878 4.018 1.00 0.00 H new ATOM 0 HB2 ARG A 433 9.583 -0.219 1.328 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.285 0.084 1.619 1.00 0.00 H new ATOM 0 HG2 ARG A 433 10.881 -1.243 3.854 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.436 -1.825 3.050 1.00 0.00 H new ATOM 0 HD2 ARG A 433 11.358 -2.142 1.077 1.00 0.00 H new ATOM 0 HD3 ARG A 433 12.276 -2.472 2.533 1.00 0.00 H new ATOM 0 HE ARG A 433 10.145 -4.114 1.383 1.00 0.00 H new ATOM 0 HH11 ARG A 433 11.936 -3.297 4.321 1.00 0.00 H new ATOM 0 HH12 ARG A 433 11.599 -4.850 5.093 1.00 0.00 H new ATOM 0 HH21 ARG A 433 9.720 -6.101 2.385 1.00 0.00 H new ATOM 0 HH22 ARG A 433 10.352 -6.429 4.002 1.00 0.00 H new ATOM 1098 N ASP A 434 10.173 2.933 1.449 1.00 0.00 N ATOM 1099 CA ASP A 434 10.770 4.138 0.883 1.00 0.00 C ATOM 1100 C ASP A 434 10.684 5.295 1.871 1.00 0.00 C ATOM 1101 O ASP A 434 9.808 6.154 1.765 1.00 0.00 O ATOM 1102 CB ASP A 434 10.069 4.512 -0.425 1.00 0.00 C ATOM 1103 CG ASP A 434 11.016 5.146 -1.426 1.00 0.00 C ATOM 1104 OD1 ASP A 434 12.029 5.736 -0.995 1.00 0.00 O ATOM 1105 OD2 ASP A 434 10.744 5.051 -2.642 1.00 0.00 O ATOM 0 H ASP A 434 9.335 2.610 0.965 1.00 0.00 H new ATOM 0 HA ASP A 434 11.821 3.936 0.676 1.00 0.00 H new ATOM 0 HB2 ASP A 434 9.624 3.619 -0.864 1.00 0.00 H new ATOM 0 HB3 ASP A 434 9.253 5.203 -0.212 1.00 0.00 H new ATOM 1110 N LYS A 435 11.600 5.310 2.834 1.00 0.00 N ATOM 1111 CA LYS A 435 11.634 6.358 3.849 1.00 0.00 C ATOM 1112 C LYS A 435 11.668 7.740 3.207 1.00 0.00 C ATOM 1113 O LYS A 435 11.028 8.676 3.687 1.00 0.00 O ATOM 1114 CB LYS A 435 12.847 6.177 4.761 1.00 0.00 C ATOM 1115 CG LYS A 435 12.809 4.892 5.574 1.00 0.00 C ATOM 1116 CD LYS A 435 14.098 4.690 6.354 1.00 0.00 C ATOM 1117 CE LYS A 435 15.239 4.261 5.445 1.00 0.00 C ATOM 1118 NZ LYS A 435 15.075 2.859 4.971 1.00 0.00 N ATOM 0 H LYS A 435 12.331 4.606 2.933 1.00 0.00 H new ATOM 0 HA LYS A 435 10.725 6.278 4.445 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.752 6.187 4.154 1.00 0.00 H new ATOM 0 HB3 LYS A 435 12.910 7.026 5.441 1.00 0.00 H new ATOM 0 HG2 LYS A 435 11.965 4.921 6.264 1.00 0.00 H new ATOM 0 HG3 LYS A 435 12.648 4.044 4.909 1.00 0.00 H new ATOM 0 HD2 LYS A 435 14.365 5.616 6.863 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.943 3.936 7.126 1.00 0.00 H new ATOM 0 HE2 LYS A 435 15.290 4.931 4.587 1.00 0.00 H new ATOM 0 HE3 LYS A 435 16.184 4.355 5.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 15.964 2.531 4.543 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 14.832 2.247 5.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 14.314 2.819 4.263 1.00 0.00 H new ATOM 1132 N LYS A 436 12.416 7.861 2.117 1.00 0.00 N ATOM 1133 CA LYS A 436 12.528 9.129 1.409 1.00 0.00 C ATOM 1134 C LYS A 436 11.169 9.566 0.885 1.00 0.00 C ATOM 1135 O LYS A 436 10.645 10.611 1.274 1.00 0.00 O ATOM 1136 CB LYS A 436 13.522 9.010 0.252 1.00 0.00 C ATOM 1137 CG LYS A 436 14.636 10.043 0.304 1.00 0.00 C ATOM 1138 CD LYS A 436 14.080 11.457 0.386 1.00 0.00 C ATOM 1139 CE LYS A 436 14.399 12.256 -0.867 1.00 0.00 C ATOM 1140 NZ LYS A 436 13.786 13.612 -0.832 1.00 0.00 N ATOM 0 H LYS A 436 12.953 7.098 1.705 1.00 0.00 H new ATOM 0 HA LYS A 436 12.893 9.881 2.108 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.961 8.012 0.261 1.00 0.00 H new ATOM 0 HB3 LYS A 436 12.985 9.113 -0.691 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.273 9.850 1.168 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.264 9.948 -0.582 1.00 0.00 H new ATOM 0 HD2 LYS A 436 13.000 11.416 0.527 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.497 11.963 1.257 1.00 0.00 H new ATOM 0 HE2 LYS A 436 15.480 12.349 -0.973 1.00 0.00 H new ATOM 0 HE3 LYS A 436 14.038 11.717 -1.743 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 13.970 14.099 -1.732 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 12.760 13.525 -0.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 14.200 14.160 -0.051 1.00 0.00 H new ATOM 1154 N MET A 437 10.601 8.754 0.007 1.00 0.00 N ATOM 1155 CA MET A 437 9.296 9.042 -0.571 1.00 0.00 C ATOM 1156 C MET A 437 8.245 9.181 0.526 1.00 0.00 C ATOM 1157 O MET A 437 7.249 9.884 0.360 1.00 0.00 O ATOM 1158 CB MET A 437 8.893 7.935 -1.549 1.00 0.00 C ATOM 1159 CG MET A 437 7.499 8.110 -2.131 1.00 0.00 C ATOM 1160 SD MET A 437 7.508 8.306 -3.924 1.00 0.00 S ATOM 1161 CE MET A 437 7.776 6.615 -4.448 1.00 0.00 C ATOM 0 H MET A 437 11.025 7.887 -0.322 1.00 0.00 H new ATOM 0 HA MET A 437 9.360 9.985 -1.114 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.616 7.902 -2.364 1.00 0.00 H new ATOM 0 HB3 MET A 437 8.945 6.974 -1.037 1.00 0.00 H new ATOM 0 HG2 MET A 437 6.890 7.245 -1.868 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.028 8.982 -1.677 1.00 0.00 H new ATOM 0 HE1 MET A 437 8.679 6.561 -5.056 1.00 0.00 H new ATOM 0 HE2 MET A 437 7.890 5.976 -3.572 1.00 0.00 H new ATOM 0 HE3 MET A 437 6.922 6.276 -5.035 1.00 0.00 H new ATOM 1171 N LEU A 438 8.479 8.512 1.651 1.00 0.00 N ATOM 1172 CA LEU A 438 7.557 8.570 2.776 1.00 0.00 C ATOM 1173 C LEU A 438 7.724 9.881 3.533 1.00 0.00 C ATOM 1174 O LEU A 438 6.749 10.476 3.992 1.00 0.00 O ATOM 1175 CB LEU A 438 7.789 7.387 3.718 1.00 0.00 C ATOM 1176 CG LEU A 438 6.583 6.993 4.571 1.00 0.00 C ATOM 1177 CD1 LEU A 438 6.097 8.182 5.385 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.464 6.450 3.693 1.00 0.00 C ATOM 0 H LEU A 438 9.298 7.925 1.806 1.00 0.00 H new ATOM 0 HA LEU A 438 6.539 8.516 2.389 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.093 6.524 3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.620 7.627 4.381 1.00 0.00 H new ATOM 0 HG LEU A 438 6.889 6.207 5.261 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.238 7.884 5.987 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.897 8.526 6.040 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.807 8.989 4.712 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.613 6.174 4.317 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.158 7.215 2.979 1.00 0.00 H new ATOM 0 HD23 LEU A 438 5.818 5.571 3.154 1.00 0.00 H new ATOM 1190 N ASP A 439 8.970 10.328 3.651 1.00 0.00 N ATOM 1191 CA ASP A 439 9.270 11.573 4.344 1.00 0.00 C ATOM 1192 C ASP A 439 8.739 12.765 3.557 1.00 0.00 C ATOM 1193 O ASP A 439 8.241 13.731 4.133 1.00 0.00 O ATOM 1194 CB ASP A 439 10.780 11.715 4.553 1.00 0.00 C ATOM 1195 CG ASP A 439 11.118 12.623 5.719 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.403 13.627 5.918 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.100 12.329 6.434 1.00 0.00 O ATOM 0 H ASP A 439 9.787 9.846 3.276 1.00 0.00 H new ATOM 0 HA ASP A 439 8.779 11.550 5.317 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.215 10.730 4.725 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.234 12.110 3.644 1.00 0.00 H new ATOM 1202 N PHE A 440 8.847 12.684 2.235 1.00 0.00 N ATOM 1203 CA PHE A 440 8.373 13.754 1.364 1.00 0.00 C ATOM 1204 C PHE A 440 6.863 13.928 1.495 1.00 0.00 C ATOM 1205 O PHE A 440 6.352 15.047 1.446 1.00 0.00 O ATOM 1206 CB PHE A 440 8.741 13.457 -0.089 1.00 0.00 C ATOM 1207 CG PHE A 440 9.368 14.622 -0.800 1.00 0.00 C ATOM 1208 CD1 PHE A 440 10.659 15.025 -0.493 1.00 0.00 C ATOM 1209 CD2 PHE A 440 8.668 15.314 -1.775 1.00 0.00 C ATOM 1210 CE1 PHE A 440 11.238 16.097 -1.144 1.00 0.00 C ATOM 1211 CE2 PHE A 440 9.242 16.387 -2.429 1.00 0.00 C ATOM 1212 CZ PHE A 440 10.529 16.780 -2.114 1.00 0.00 C ATOM 0 H PHE A 440 9.258 11.890 1.744 1.00 0.00 H new ATOM 0 HA PHE A 440 8.856 14.682 1.670 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.430 12.612 -0.115 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.843 13.153 -0.628 1.00 0.00 H new ATOM 0 HD1 PHE A 440 11.218 14.495 0.264 1.00 0.00 H new ATOM 0 HD2 PHE A 440 7.662 15.011 -2.027 1.00 0.00 H new ATOM 0 HE1 PHE A 440 12.244 16.401 -0.895 1.00 0.00 H new ATOM 0 HE2 PHE A 440 8.685 16.919 -3.186 1.00 0.00 H new ATOM 0 HZ PHE A 440 10.979 17.618 -2.624 1.00 0.00 H new ATOM 1222 N TYR A 441 6.157 12.816 1.668 1.00 0.00 N ATOM 1223 CA TYR A 441 4.709 12.847 1.813 1.00 0.00 C ATOM 1224 C TYR A 441 4.327 13.150 3.251 1.00 0.00 C ATOM 1225 O TYR A 441 3.428 13.945 3.507 1.00 0.00 O ATOM 1226 CB TYR A 441 4.102 11.515 1.381 1.00 0.00 C ATOM 1227 CG TYR A 441 3.747 11.461 -0.087 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.718 11.210 -1.047 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.440 11.657 -0.511 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.398 11.157 -2.390 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.109 11.604 -1.852 1.00 0.00 C ATOM 1232 CZ TYR A 441 3.092 11.354 -2.787 1.00 0.00 C ATOM 1233 OH TYR A 441 2.766 11.301 -4.123 1.00 0.00 O ATOM 0 H TYR A 441 6.565 11.882 1.711 1.00 0.00 H new ATOM 0 HA TYR A 441 4.316 13.636 1.172 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.806 10.714 1.606 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.205 11.325 1.971 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.741 11.053 -0.739 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.669 11.854 0.219 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.166 10.963 -3.124 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.087 11.757 -2.166 1.00 0.00 H new ATOM 0 HH TYR A 441 3.374 10.686 -4.584 1.00 0.00 H new ATOM 1243 N ALA A 442 5.025 12.522 4.187 1.00 0.00 N ATOM 1244 CA ALA A 442 4.757 12.744 5.599 1.00 0.00 C ATOM 1245 C ALA A 442 4.933 14.216 5.952 1.00 0.00 C ATOM 1246 O ALA A 442 4.311 14.720 6.886 1.00 0.00 O ATOM 1247 CB ALA A 442 5.657 11.869 6.462 1.00 0.00 C ATOM 0 H ALA A 442 5.776 11.859 3.995 1.00 0.00 H new ATOM 0 HA ALA A 442 3.722 12.466 5.800 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.440 12.051 7.515 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.475 10.820 6.230 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.701 12.110 6.260 1.00 0.00 H new ATOM 1253 N LYS A 443 5.771 14.908 5.182 1.00 0.00 N ATOM 1254 CA LYS A 443 6.008 16.329 5.399 1.00 0.00 C ATOM 1255 C LYS A 443 4.937 17.163 4.698 1.00 0.00 C ATOM 1256 O LYS A 443 4.892 18.383 4.848 1.00 0.00 O ATOM 1257 CB LYS A 443 7.395 16.722 4.891 1.00 0.00 C ATOM 1258 CG LYS A 443 8.528 16.253 5.789 1.00 0.00 C ATOM 1259 CD LYS A 443 8.386 16.804 7.199 1.00 0.00 C ATOM 1260 CE LYS A 443 7.866 15.747 8.160 1.00 0.00 C ATOM 1261 NZ LYS A 443 8.812 14.605 8.294 1.00 0.00 N ATOM 0 H LYS A 443 6.295 14.506 4.404 1.00 0.00 H new ATOM 0 HA LYS A 443 5.958 16.525 6.470 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.538 16.307 3.893 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.444 17.807 4.795 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.540 15.164 5.822 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.482 16.570 5.368 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.352 17.170 7.547 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.706 17.656 7.191 1.00 0.00 H new ATOM 0 HE2 LYS A 443 7.699 16.197 9.139 1.00 0.00 H new ATOM 0 HE3 LYS A 443 6.901 15.380 7.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 8.283 13.710 8.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 9.498 14.629 7.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 9.317 14.677 9.200 1.00 0.00 H new ATOM 1275 N GLN A 444 4.071 16.492 3.940 1.00 0.00 N ATOM 1276 CA GLN A 444 2.994 17.159 3.227 1.00 0.00 C ATOM 1277 C GLN A 444 1.648 16.765 3.819 1.00 0.00 C ATOM 1278 O GLN A 444 0.823 17.620 4.138 1.00 0.00 O ATOM 1279 CB GLN A 444 3.038 16.809 1.738 1.00 0.00 C ATOM 1280 CG GLN A 444 4.272 17.339 1.025 1.00 0.00 C ATOM 1281 CD GLN A 444 4.017 18.658 0.324 1.00 0.00 C ATOM 1282 OE1 GLN A 444 3.997 18.728 -0.904 1.00 0.00 O ATOM 1283 NE2 GLN A 444 3.820 19.715 1.104 1.00 0.00 N ATOM 0 H GLN A 444 4.099 15.481 3.806 1.00 0.00 H new ATOM 0 HA GLN A 444 3.124 18.236 3.334 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.002 15.725 1.627 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.148 17.209 1.253 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.078 17.465 1.747 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.610 16.603 0.295 1.00 0.00 H new ATOM 0 HE21 GLN A 444 3.845 19.612 2.118 1.00 0.00 H new ATOM 0 HE22 GLN A 444 3.644 20.630 0.688 1.00 0.00 H new ATOM 1292 N ARG A 445 1.439 15.463 3.972 1.00 0.00 N ATOM 1293 CA ARG A 445 0.196 14.952 4.541 1.00 0.00 C ATOM 1294 C ARG A 445 0.068 15.359 6.003 1.00 0.00 C ATOM 1295 O ARG A 445 -0.989 15.805 6.446 1.00 0.00 O ATOM 1296 CB ARG A 445 0.137 13.427 4.416 1.00 0.00 C ATOM 1297 CG ARG A 445 -1.135 12.819 4.983 1.00 0.00 C ATOM 1298 CD ARG A 445 -0.910 12.245 6.374 1.00 0.00 C ATOM 1299 NE ARG A 445 -1.664 12.970 7.395 1.00 0.00 N ATOM 1300 CZ ARG A 445 -2.961 12.785 7.629 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -3.653 11.904 6.917 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -3.570 13.484 8.578 1.00 0.00 N ATOM 0 H ARG A 445 2.112 14.742 3.711 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.636 15.384 3.984 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.223 13.153 3.364 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.996 12.995 4.929 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -1.915 13.579 5.024 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -1.491 12.033 4.318 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -1.203 11.195 6.384 1.00 0.00 H new ATOM 0 HD3 ARG A 445 0.153 12.282 6.614 1.00 0.00 H new ATOM 0 HE ARG A 445 -1.167 13.658 7.961 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -3.191 11.364 6.185 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -4.647 11.767 7.102 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -3.044 14.163 9.128 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -4.564 13.342 8.757 1.00 0.00 H new ATOM 1314 N ALA A 446 1.158 15.207 6.743 1.00 0.00 N ATOM 1315 CA ALA A 446 1.181 15.561 8.156 1.00 0.00 C ATOM 1316 C ALA A 446 1.275 17.072 8.336 1.00 0.00 C ATOM 1317 O ALA A 446 0.844 17.614 9.355 1.00 0.00 O ATOM 1318 CB ALA A 446 2.347 14.874 8.851 1.00 0.00 C ATOM 0 H ALA A 446 2.040 14.840 6.387 1.00 0.00 H new ATOM 0 HA ALA A 446 0.250 15.221 8.609 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.353 15.147 9.906 1.00 0.00 H new ATOM 0 HB2 ALA A 446 2.242 13.793 8.756 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.283 15.189 8.389 1.00 0.00 H new