USER MOD reduce.3.24.130724 H: found=0, std=0, add=548, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 537 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 387 TYR OH : rot 15:sc= -4.68! USER MOD Set 1.2: A 404 CYS SG : rot 107:sc= -0.466 USER MOD Single : A 369 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 371 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 373 GLN :FLIP amide:sc= -3.7! C(o=-7.5!,f=-3.7!) USER MOD Single : A 375 TYR OH : rot 180:sc= 0 USER MOD Single : A 376 SER OG : rot 80:sc= 1.03 USER MOD Single : A 380 TYR OH : rot -148:sc= 1.04 USER MOD Single : A 382 SER OG : rot 180:sc= 0 USER MOD Single : A 386 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 389 THR OG1 : rot 180:sc= 0 USER MOD Single : A 399 ASN : amide:sc= -0.591 K(o=-0.59,f=-2.8!) USER MOD Single : A 400 SER OG : rot -90:sc= -1.71 USER MOD Single : A 410 THR OG1 : rot 36:sc= 0.0507 USER MOD Single : A 414 THR OG1 : rot 180:sc= -1.05 USER MOD Single : A 419 ASN : amide:sc= -3.53 K(o=-3.5,f=-19!) USER MOD Single : A 421 LYS NZ :NH3+ -112:sc= -2.47! (180deg=-5.69!) USER MOD Single : A 430 ASN :FLIP amide:sc= -0.229 F(o=-0.83,f=-0.23) USER MOD Single : A 435 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 LYS NZ :NH3+ -157:sc= -0.129 (180deg=-0.785) USER MOD Single : A 437 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 441 TYR OH : rot 30:sc= -0.0632 USER MOD Single : A 443 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 444 GLN : amide:sc= -0.479 X(o=-0.48,f=-0.3) USER MOD ----------------------------------------------------------------- ATOM 102 N ASN A 369 -3.743 -2.729 8.128 1.00 0.00 N ATOM 103 CA ASN A 369 -2.714 -2.149 8.987 1.00 0.00 C ATOM 104 C ASN A 369 -1.822 -1.192 8.205 1.00 0.00 C ATOM 105 O ASN A 369 -2.008 0.024 8.254 1.00 0.00 O ATOM 106 CB ASN A 369 -1.870 -3.255 9.626 1.00 0.00 C ATOM 107 CG ASN A 369 -2.650 -4.062 10.644 1.00 0.00 C ATOM 108 OD1 ASN A 369 -2.582 -3.801 11.845 1.00 0.00 O ATOM 109 ND2 ASN A 369 -3.397 -5.050 10.167 1.00 0.00 N ATOM 0 HA ASN A 369 -3.211 -1.583 9.774 1.00 0.00 H new ATOM 0 HB2 ASN A 369 -1.498 -3.920 8.847 1.00 0.00 H new ATOM 0 HB3 ASN A 369 -0.999 -2.811 10.108 1.00 0.00 H new ATOM 0 HD21 ASN A 369 -3.945 -5.629 10.804 1.00 0.00 H new ATOM 0 HD22 ASN A 369 -3.423 -5.231 9.163 1.00 0.00 H new ATOM 116 N ALA A 370 -0.856 -1.745 7.481 1.00 0.00 N ATOM 117 CA ALA A 370 0.062 -0.935 6.686 1.00 0.00 C ATOM 118 C ALA A 370 -0.702 0.035 5.791 1.00 0.00 C ATOM 119 O ALA A 370 -0.193 1.095 5.430 1.00 0.00 O ATOM 120 CB ALA A 370 0.970 -1.826 5.852 1.00 0.00 C ATOM 0 H ALA A 370 -0.687 -2.750 7.427 1.00 0.00 H new ATOM 0 HA ALA A 370 0.679 -0.351 7.369 1.00 0.00 H new ATOM 0 HB1 ALA A 370 1.648 -1.207 5.265 1.00 0.00 H new ATOM 0 HB2 ALA A 370 1.548 -2.474 6.510 1.00 0.00 H new ATOM 0 HB3 ALA A 370 0.365 -2.437 5.182 1.00 0.00 H new ATOM 126 N LYS A 371 -1.932 -0.334 5.440 1.00 0.00 N ATOM 127 CA LYS A 371 -2.768 0.507 4.593 1.00 0.00 C ATOM 128 C LYS A 371 -3.292 1.705 5.374 1.00 0.00 C ATOM 129 O LYS A 371 -3.387 2.811 4.843 1.00 0.00 O ATOM 130 CB LYS A 371 -3.937 -0.302 4.027 1.00 0.00 C ATOM 131 CG LYS A 371 -4.656 0.388 2.879 1.00 0.00 C ATOM 132 CD LYS A 371 -5.656 -0.541 2.211 1.00 0.00 C ATOM 133 CE LYS A 371 -6.096 -0.008 0.857 1.00 0.00 C ATOM 134 NZ LYS A 371 -7.458 0.590 0.910 1.00 0.00 N ATOM 0 H LYS A 371 -2.369 -1.209 5.730 1.00 0.00 H new ATOM 0 HA LYS A 371 -2.158 0.871 3.766 1.00 0.00 H new ATOM 0 HB2 LYS A 371 -3.567 -1.268 3.684 1.00 0.00 H new ATOM 0 HB3 LYS A 371 -4.652 -0.499 4.826 1.00 0.00 H new ATOM 0 HG2 LYS A 371 -5.172 1.273 3.251 1.00 0.00 H new ATOM 0 HG3 LYS A 371 -3.927 0.729 2.144 1.00 0.00 H new ATOM 0 HD2 LYS A 371 -5.210 -1.528 2.087 1.00 0.00 H new ATOM 0 HD3 LYS A 371 -6.527 -0.663 2.855 1.00 0.00 H new ATOM 0 HE2 LYS A 371 -5.384 0.742 0.514 1.00 0.00 H new ATOM 0 HE3 LYS A 371 -6.083 -0.817 0.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 371 -7.720 0.941 -0.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 371 -8.143 -0.132 1.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 371 -7.465 1.379 1.587 1.00 0.00 H new ATOM 148 N ARG A 372 -3.623 1.480 6.641 1.00 0.00 N ATOM 149 CA ARG A 372 -4.128 2.549 7.494 1.00 0.00 C ATOM 150 C ARG A 372 -2.985 3.448 7.947 1.00 0.00 C ATOM 151 O ARG A 372 -3.166 4.648 8.155 1.00 0.00 O ATOM 152 CB ARG A 372 -4.864 1.968 8.708 1.00 0.00 C ATOM 153 CG ARG A 372 -3.957 1.282 9.720 1.00 0.00 C ATOM 154 CD ARG A 372 -4.525 1.373 11.127 1.00 0.00 C ATOM 155 NE ARG A 372 -4.059 0.279 11.976 1.00 0.00 N ATOM 156 CZ ARG A 372 -4.090 0.309 13.307 1.00 0.00 C ATOM 157 NH1 ARG A 372 -4.564 1.373 13.944 1.00 0.00 N ATOM 158 NH2 ARG A 372 -3.646 -0.728 14.004 1.00 0.00 N ATOM 0 H ARG A 372 -3.551 0.571 7.098 1.00 0.00 H new ATOM 0 HA ARG A 372 -4.834 3.146 6.917 1.00 0.00 H new ATOM 0 HB2 ARG A 372 -5.406 2.771 9.208 1.00 0.00 H new ATOM 0 HB3 ARG A 372 -5.607 1.251 8.359 1.00 0.00 H new ATOM 0 HG2 ARG A 372 -3.829 0.235 9.445 1.00 0.00 H new ATOM 0 HG3 ARG A 372 -2.969 1.741 9.695 1.00 0.00 H new ATOM 0 HD2 ARG A 372 -4.239 2.325 11.573 1.00 0.00 H new ATOM 0 HD3 ARG A 372 -5.614 1.357 11.080 1.00 0.00 H new ATOM 0 HE ARG A 372 -3.688 -0.556 11.523 1.00 0.00 H new ATOM 0 HH11 ARG A 372 -4.907 2.174 13.414 1.00 0.00 H new ATOM 0 HH12 ARG A 372 -4.585 1.390 14.964 1.00 0.00 H new ATOM 0 HH21 ARG A 372 -3.281 -1.549 13.521 1.00 0.00 H new ATOM 0 HH22 ARG A 372 -3.670 -0.705 15.023 1.00 0.00 H new ATOM 170 N GLN A 373 -1.806 2.856 8.088 1.00 0.00 N ATOM 171 CA GLN A 373 -0.623 3.591 8.507 1.00 0.00 C ATOM 172 C GLN A 373 -0.116 4.474 7.376 1.00 0.00 C ATOM 173 O GLN A 373 0.371 5.583 7.603 1.00 0.00 O ATOM 174 CB GLN A 373 0.473 2.618 8.954 1.00 0.00 C ATOM 175 CG GLN A 373 1.572 3.263 9.787 1.00 0.00 C ATOM 176 CD GLN A 373 1.028 4.157 10.886 1.00 0.00 C ATOM 177 OE1 GLN A 373 0.461 5.292 10.497 1.00 0.00 O flip ATOM 178 NE2 GLN A 373 1.117 3.828 12.070 1.00 0.00 N flip ATOM 0 H GLN A 373 -1.645 1.863 7.917 1.00 0.00 H new ATOM 0 HA GLN A 373 -0.891 4.229 9.349 1.00 0.00 H new ATOM 0 HB2 GLN A 373 0.017 1.814 9.532 1.00 0.00 H new ATOM 0 HB3 GLN A 373 0.921 2.161 8.072 1.00 0.00 H new ATOM 0 HG2 GLN A 373 2.190 2.483 10.232 1.00 0.00 H new ATOM 0 HG3 GLN A 373 2.219 3.849 9.135 1.00 0.00 H new ATOM 0 HE21 GLN A 373 1.562 2.945 12.322 1.00 0.00 H new ATOM 0 HE22 GLN A 373 0.746 4.438 12.798 1.00 0.00 H new ATOM 187 N LEU A 374 -0.248 3.980 6.156 1.00 0.00 N ATOM 188 CA LEU A 374 0.184 4.720 4.984 1.00 0.00 C ATOM 189 C LEU A 374 -0.703 5.939 4.760 1.00 0.00 C ATOM 190 O LEU A 374 -0.213 7.038 4.502 1.00 0.00 O ATOM 191 CB LEU A 374 0.148 3.810 3.763 1.00 0.00 C ATOM 192 CG LEU A 374 1.495 3.591 3.073 1.00 0.00 C ATOM 193 CD1 LEU A 374 1.492 2.278 2.306 1.00 0.00 C ATOM 194 CD2 LEU A 374 1.812 4.752 2.144 1.00 0.00 C ATOM 0 H LEU A 374 -0.653 3.066 5.952 1.00 0.00 H new ATOM 0 HA LEU A 374 1.205 5.067 5.144 1.00 0.00 H new ATOM 0 HB2 LEU A 374 -0.250 2.841 4.064 1.00 0.00 H new ATOM 0 HB3 LEU A 374 -0.549 4.229 3.038 1.00 0.00 H new ATOM 0 HG LEU A 374 2.271 3.541 3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 374 2.458 2.138 1.821 1.00 0.00 H new ATOM 0 HD12 LEU A 374 1.309 1.454 2.996 1.00 0.00 H new ATOM 0 HD13 LEU A 374 0.707 2.300 1.551 1.00 0.00 H new ATOM 0 HD21 LEU A 374 2.774 4.580 1.661 1.00 0.00 H new ATOM 0 HD22 LEU A 374 1.034 4.833 1.385 1.00 0.00 H new ATOM 0 HD23 LEU A 374 1.855 5.677 2.719 1.00 0.00 H new ATOM 206 N TYR A 375 -2.010 5.733 4.865 1.00 0.00 N ATOM 207 CA TYR A 375 -2.969 6.814 4.677 1.00 0.00 C ATOM 208 C TYR A 375 -2.730 7.928 5.687 1.00 0.00 C ATOM 209 O TYR A 375 -2.904 9.107 5.380 1.00 0.00 O ATOM 210 CB TYR A 375 -4.399 6.284 4.809 1.00 0.00 C ATOM 211 CG TYR A 375 -5.399 7.025 3.952 1.00 0.00 C ATOM 212 CD1 TYR A 375 -5.183 7.198 2.591 1.00 0.00 C ATOM 213 CD2 TYR A 375 -6.560 7.552 4.504 1.00 0.00 C ATOM 214 CE1 TYR A 375 -6.094 7.873 1.804 1.00 0.00 C ATOM 215 CE2 TYR A 375 -7.477 8.230 3.722 1.00 0.00 C ATOM 216 CZ TYR A 375 -7.241 8.388 2.374 1.00 0.00 C ATOM 217 OH TYR A 375 -8.151 9.061 1.594 1.00 0.00 O ATOM 0 H TYR A 375 -2.430 4.828 5.079 1.00 0.00 H new ATOM 0 HA TYR A 375 -2.833 7.221 3.675 1.00 0.00 H new ATOM 0 HB2 TYR A 375 -4.413 5.228 4.539 1.00 0.00 H new ATOM 0 HB3 TYR A 375 -4.707 6.350 5.852 1.00 0.00 H new ATOM 0 HD1 TYR A 375 -4.287 6.797 2.141 1.00 0.00 H new ATOM 0 HD2 TYR A 375 -6.749 7.430 5.560 1.00 0.00 H new ATOM 0 HE1 TYR A 375 -5.910 7.998 0.747 1.00 0.00 H new ATOM 0 HE2 TYR A 375 -8.375 8.634 4.166 1.00 0.00 H new ATOM 0 HH TYR A 375 -8.902 9.358 2.150 1.00 0.00 H new ATOM 227 N SER A 376 -2.321 7.546 6.891 1.00 0.00 N ATOM 228 CA SER A 376 -2.047 8.515 7.944 1.00 0.00 C ATOM 229 C SER A 376 -0.636 9.082 7.809 1.00 0.00 C ATOM 230 O SER A 376 -0.306 10.100 8.417 1.00 0.00 O ATOM 231 CB SER A 376 -2.220 7.868 9.319 1.00 0.00 C ATOM 232 OG SER A 376 -3.447 7.163 9.401 1.00 0.00 O ATOM 0 H SER A 376 -2.172 6.574 7.162 1.00 0.00 H new ATOM 0 HA SER A 376 -2.759 9.334 7.844 1.00 0.00 H new ATOM 0 HB2 SER A 376 -1.392 7.186 9.510 1.00 0.00 H new ATOM 0 HB3 SER A 376 -2.186 8.635 10.092 1.00 0.00 H new ATOM 0 HG SER A 376 -3.352 6.289 8.967 1.00 0.00 H new ATOM 238 N LEU A 377 0.200 8.413 7.015 1.00 0.00 N ATOM 239 CA LEU A 377 1.574 8.852 6.813 1.00 0.00 C ATOM 240 C LEU A 377 1.720 9.680 5.539 1.00 0.00 C ATOM 241 O LEU A 377 2.598 10.538 5.449 1.00 0.00 O ATOM 242 CB LEU A 377 2.513 7.646 6.760 1.00 0.00 C ATOM 243 CG LEU A 377 3.254 7.354 8.063 1.00 0.00 C ATOM 244 CD1 LEU A 377 2.290 6.831 9.115 1.00 0.00 C ATOM 245 CD2 LEU A 377 4.381 6.359 7.827 1.00 0.00 C ATOM 0 H LEU A 377 -0.053 7.567 6.504 1.00 0.00 H new ATOM 0 HA LEU A 377 1.844 9.485 7.658 1.00 0.00 H new ATOM 0 HB2 LEU A 377 1.935 6.765 6.482 1.00 0.00 H new ATOM 0 HB3 LEU A 377 3.246 7.808 5.970 1.00 0.00 H new ATOM 0 HG LEU A 377 3.691 8.284 8.427 1.00 0.00 H new ATOM 0 HD11 LEU A 377 2.834 6.628 10.038 1.00 0.00 H new ATOM 0 HD12 LEU A 377 1.519 7.578 9.305 1.00 0.00 H new ATOM 0 HD13 LEU A 377 1.825 5.912 8.758 1.00 0.00 H new ATOM 0 HD21 LEU A 377 4.897 6.164 8.767 1.00 0.00 H new ATOM 0 HD22 LEU A 377 3.969 5.427 7.439 1.00 0.00 H new ATOM 0 HD23 LEU A 377 5.086 6.772 7.105 1.00 0.00 H new ATOM 257 N ILE A 378 0.871 9.418 4.547 1.00 0.00 N ATOM 258 CA ILE A 378 0.944 10.150 3.288 1.00 0.00 C ATOM 259 C ILE A 378 -0.441 10.499 2.746 1.00 0.00 C ATOM 260 O ILE A 378 -0.666 11.612 2.269 1.00 0.00 O ATOM 261 CB ILE A 378 1.731 9.356 2.223 1.00 0.00 C ATOM 262 CG1 ILE A 378 0.927 8.154 1.722 1.00 0.00 C ATOM 263 CG2 ILE A 378 3.068 8.901 2.789 1.00 0.00 C ATOM 264 CD1 ILE A 378 1.647 7.352 0.662 1.00 0.00 C ATOM 0 H ILE A 378 0.134 8.714 4.590 1.00 0.00 H new ATOM 0 HA ILE A 378 1.471 11.080 3.502 1.00 0.00 H new ATOM 0 HB ILE A 378 1.912 10.015 1.374 1.00 0.00 H new ATOM 0 HG12 ILE A 378 0.696 7.503 2.565 1.00 0.00 H new ATOM 0 HG13 ILE A 378 -0.024 8.504 1.320 1.00 0.00 H new ATOM 0 HG21 ILE A 378 3.614 8.342 2.029 1.00 0.00 H new ATOM 0 HG22 ILE A 378 3.652 9.772 3.088 1.00 0.00 H new ATOM 0 HG23 ILE A 378 2.898 8.263 3.656 1.00 0.00 H new ATOM 0 HD11 ILE A 378 1.021 6.515 0.351 1.00 0.00 H new ATOM 0 HD12 ILE A 378 1.854 7.989 -0.198 1.00 0.00 H new ATOM 0 HD13 ILE A 378 2.585 6.973 1.067 1.00 0.00 H new ATOM 276 N GLY A 379 -1.363 9.545 2.811 1.00 0.00 N ATOM 277 CA GLY A 379 -2.707 9.779 2.313 1.00 0.00 C ATOM 278 C GLY A 379 -3.353 11.011 2.919 1.00 0.00 C ATOM 279 O GLY A 379 -3.953 10.940 3.990 1.00 0.00 O ATOM 0 H GLY A 379 -1.205 8.615 3.199 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -2.674 9.888 1.229 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -3.326 8.908 2.527 1.00 0.00 H new ATOM 283 N TYR A 380 -3.232 12.145 2.231 1.00 0.00 N ATOM 284 CA TYR A 380 -3.818 13.391 2.716 1.00 0.00 C ATOM 285 C TYR A 380 -5.153 13.671 2.033 1.00 0.00 C ATOM 286 O TYR A 380 -6.083 14.181 2.659 1.00 0.00 O ATOM 287 CB TYR A 380 -2.865 14.577 2.509 1.00 0.00 C ATOM 288 CG TYR A 380 -1.923 14.436 1.332 1.00 0.00 C ATOM 289 CD1 TYR A 380 -2.396 14.454 0.026 1.00 0.00 C ATOM 290 CD2 TYR A 380 -0.556 14.296 1.530 1.00 0.00 C ATOM 291 CE1 TYR A 380 -1.532 14.336 -1.047 1.00 0.00 C ATOM 292 CE2 TYR A 380 0.314 14.176 0.465 1.00 0.00 C ATOM 293 CZ TYR A 380 -0.178 14.197 -0.823 1.00 0.00 C ATOM 294 OH TYR A 380 0.685 14.081 -1.888 1.00 0.00 O ATOM 0 H TYR A 380 -2.737 12.226 1.343 1.00 0.00 H new ATOM 0 HA TYR A 380 -3.990 13.271 3.786 1.00 0.00 H new ATOM 0 HB2 TYR A 380 -3.457 15.482 2.376 1.00 0.00 H new ATOM 0 HB3 TYR A 380 -2.274 14.713 3.415 1.00 0.00 H new ATOM 0 HD1 TYR A 380 -3.455 14.562 -0.154 1.00 0.00 H new ATOM 0 HD2 TYR A 380 -0.166 14.281 2.537 1.00 0.00 H new ATOM 0 HE1 TYR A 380 -1.916 14.353 -2.056 1.00 0.00 H new ATOM 0 HE2 TYR A 380 1.374 14.066 0.640 1.00 0.00 H new ATOM 0 HH TYR A 380 1.443 13.514 -1.635 1.00 0.00 H new ATOM 304 N ALA A 381 -5.243 13.336 0.750 1.00 0.00 N ATOM 305 CA ALA A 381 -6.469 13.555 -0.013 1.00 0.00 C ATOM 306 C ALA A 381 -6.299 13.126 -1.466 1.00 0.00 C ATOM 307 O ALA A 381 -6.802 12.082 -1.879 1.00 0.00 O ATOM 308 CB ALA A 381 -6.888 15.016 0.065 1.00 0.00 C ATOM 0 H ALA A 381 -4.484 12.913 0.217 1.00 0.00 H new ATOM 0 HA ALA A 381 -7.254 12.941 0.428 1.00 0.00 H new ATOM 0 HB1 ALA A 381 -7.803 15.163 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 381 -7.064 15.289 1.105 1.00 0.00 H new ATOM 0 HB3 ALA A 381 -6.097 15.644 -0.346 1.00 0.00 H new ATOM 314 N SER A 382 -5.586 13.942 -2.238 1.00 0.00 N ATOM 315 CA SER A 382 -5.348 13.650 -3.649 1.00 0.00 C ATOM 316 C SER A 382 -4.720 12.271 -3.825 1.00 0.00 C ATOM 317 O SER A 382 -4.896 11.626 -4.860 1.00 0.00 O ATOM 318 CB SER A 382 -4.442 14.717 -4.265 1.00 0.00 C ATOM 319 OG SER A 382 -5.205 15.766 -4.835 1.00 0.00 O ATOM 0 H SER A 382 -5.163 14.810 -1.910 1.00 0.00 H new ATOM 0 HA SER A 382 -6.310 13.657 -4.161 1.00 0.00 H new ATOM 0 HB2 SER A 382 -3.778 15.120 -3.501 1.00 0.00 H new ATOM 0 HB3 SER A 382 -3.811 14.265 -5.030 1.00 0.00 H new ATOM 0 HG SER A 382 -4.603 16.436 -5.221 1.00 0.00 H new ATOM 325 N LEU A 383 -3.988 11.824 -2.811 1.00 0.00 N ATOM 326 CA LEU A 383 -3.335 10.521 -2.857 1.00 0.00 C ATOM 327 C LEU A 383 -4.310 9.409 -2.482 1.00 0.00 C ATOM 328 O LEU A 383 -4.223 8.832 -1.397 1.00 0.00 O ATOM 329 CB LEU A 383 -2.128 10.500 -1.917 1.00 0.00 C ATOM 330 CG LEU A 383 -0.953 9.645 -2.394 1.00 0.00 C ATOM 331 CD1 LEU A 383 -0.207 10.345 -3.520 1.00 0.00 C ATOM 332 CD2 LEU A 383 -0.013 9.342 -1.237 1.00 0.00 C ATOM 0 H LEU A 383 -3.832 12.344 -1.948 1.00 0.00 H new ATOM 0 HA LEU A 383 -2.994 10.348 -3.878 1.00 0.00 H new ATOM 0 HB2 LEU A 383 -1.779 11.523 -1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 383 -2.452 10.135 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 383 -1.344 8.702 -2.776 1.00 0.00 H new ATOM 0 HD11 LEU A 383 0.626 9.722 -3.847 1.00 0.00 H new ATOM 0 HD12 LEU A 383 -0.885 10.513 -4.357 1.00 0.00 H new ATOM 0 HD13 LEU A 383 0.174 11.302 -3.164 1.00 0.00 H new ATOM 0 HD21 LEU A 383 0.818 8.733 -1.593 1.00 0.00 H new ATOM 0 HD22 LEU A 383 0.372 10.276 -0.827 1.00 0.00 H new ATOM 0 HD23 LEU A 383 -0.554 8.800 -0.461 1.00 0.00 H new ATOM 344 N ARG A 384 -5.236 9.112 -3.387 1.00 0.00 N ATOM 345 CA ARG A 384 -6.226 8.067 -3.155 1.00 0.00 C ATOM 346 C ARG A 384 -5.556 6.703 -3.032 1.00 0.00 C ATOM 347 O ARG A 384 -5.529 5.926 -3.986 1.00 0.00 O ATOM 348 CB ARG A 384 -7.250 8.045 -4.291 1.00 0.00 C ATOM 349 CG ARG A 384 -8.608 7.501 -3.876 1.00 0.00 C ATOM 350 CD ARG A 384 -9.599 7.540 -5.028 1.00 0.00 C ATOM 351 NE ARG A 384 -10.942 7.905 -4.583 1.00 0.00 N ATOM 352 CZ ARG A 384 -11.787 7.055 -4.005 1.00 0.00 C ATOM 353 NH1 ARG A 384 -11.432 5.794 -3.795 1.00 0.00 N ATOM 354 NH2 ARG A 384 -12.991 7.469 -3.632 1.00 0.00 N ATOM 0 H ARG A 384 -5.322 9.581 -4.289 1.00 0.00 H new ATOM 0 HA ARG A 384 -6.738 8.286 -2.218 1.00 0.00 H new ATOM 0 HB2 ARG A 384 -7.375 9.057 -4.675 1.00 0.00 H new ATOM 0 HB3 ARG A 384 -6.860 7.439 -5.109 1.00 0.00 H new ATOM 0 HG2 ARG A 384 -8.498 6.475 -3.524 1.00 0.00 H new ATOM 0 HG3 ARG A 384 -8.996 8.085 -3.041 1.00 0.00 H new ATOM 0 HD2 ARG A 384 -9.258 8.256 -5.776 1.00 0.00 H new ATOM 0 HD3 ARG A 384 -9.630 6.564 -5.512 1.00 0.00 H new ATOM 0 HE ARG A 384 -11.250 8.867 -4.724 1.00 0.00 H new ATOM 0 HH11 ARG A 384 -10.507 5.471 -4.077 1.00 0.00 H new ATOM 0 HH12 ARG A 384 -12.085 5.148 -3.351 1.00 0.00 H new ATOM 0 HH21 ARG A 384 -13.268 8.438 -3.788 1.00 0.00 H new ATOM 0 HH22 ARG A 384 -13.639 6.818 -3.189 1.00 0.00 H new ATOM 366 N LEU A 385 -5.015 6.420 -1.851 1.00 0.00 N ATOM 367 CA LEU A 385 -4.341 5.150 -1.601 1.00 0.00 C ATOM 368 C LEU A 385 -5.271 3.973 -1.885 1.00 0.00 C ATOM 369 O LEU A 385 -6.214 3.720 -1.137 1.00 0.00 O ATOM 370 CB LEU A 385 -3.849 5.088 -0.153 1.00 0.00 C ATOM 371 CG LEU A 385 -3.186 3.768 0.250 1.00 0.00 C ATOM 372 CD1 LEU A 385 -1.676 3.933 0.338 1.00 0.00 C ATOM 373 CD2 LEU A 385 -3.746 3.270 1.575 1.00 0.00 C ATOM 0 H LEU A 385 -5.030 7.053 -1.052 1.00 0.00 H new ATOM 0 HA LEU A 385 -3.485 5.083 -2.273 1.00 0.00 H new ATOM 0 HB2 LEU A 385 -3.138 5.898 0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 385 -4.695 5.270 0.510 1.00 0.00 H new ATOM 0 HG LEU A 385 -3.407 3.026 -0.517 1.00 0.00 H new ATOM 0 HD11 LEU A 385 -1.222 2.984 0.626 1.00 0.00 H new ATOM 0 HD12 LEU A 385 -1.287 4.242 -0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 385 -1.436 4.691 1.084 1.00 0.00 H new ATOM 0 HD21 LEU A 385 -3.262 2.331 1.844 1.00 0.00 H new ATOM 0 HD22 LEU A 385 -3.557 4.011 2.351 1.00 0.00 H new ATOM 0 HD23 LEU A 385 -4.820 3.111 1.479 1.00 0.00 H new ATOM 385 N HIS A 386 -4.997 3.257 -2.971 1.00 0.00 N ATOM 386 CA HIS A 386 -5.807 2.109 -3.353 1.00 0.00 C ATOM 387 C HIS A 386 -4.924 0.929 -3.746 1.00 0.00 C ATOM 388 O HIS A 386 -3.837 1.111 -4.293 1.00 0.00 O ATOM 389 CB HIS A 386 -6.738 2.473 -4.510 1.00 0.00 C ATOM 390 CG HIS A 386 -7.982 1.643 -4.561 1.00 0.00 C ATOM 391 ND1 HIS A 386 -9.091 1.898 -3.780 1.00 0.00 N ATOM 392 CD2 HIS A 386 -8.292 0.555 -5.307 1.00 0.00 C ATOM 393 CE1 HIS A 386 -10.026 1.004 -4.043 1.00 0.00 C ATOM 394 NE2 HIS A 386 -9.567 0.178 -4.966 1.00 0.00 N ATOM 0 H HIS A 386 -4.219 3.453 -3.601 1.00 0.00 H new ATOM 0 HA HIS A 386 -6.410 1.819 -2.492 1.00 0.00 H new ATOM 0 HB2 HIS A 386 -7.015 3.524 -4.426 1.00 0.00 H new ATOM 0 HB3 HIS A 386 -6.197 2.361 -5.450 1.00 0.00 H new ATOM 0 HD2 HIS A 386 -7.655 0.074 -6.034 1.00 0.00 H new ATOM 0 HE1 HIS A 386 -11.001 0.956 -3.582 1.00 0.00 H new ATOM 0 HE2 HIS A 386 -10.077 -0.612 -5.361 1.00 0.00 H new ATOM 403 N TYR A 387 -5.397 -0.281 -3.462 1.00 0.00 N ATOM 404 CA TYR A 387 -4.647 -1.487 -3.785 1.00 0.00 C ATOM 405 C TYR A 387 -5.372 -2.323 -4.832 1.00 0.00 C ATOM 406 O TYR A 387 -6.527 -2.710 -4.646 1.00 0.00 O ATOM 407 CB TYR A 387 -4.405 -2.315 -2.524 1.00 0.00 C ATOM 408 CG TYR A 387 -3.290 -1.770 -1.664 1.00 0.00 C ATOM 409 CD1 TYR A 387 -3.431 -0.556 -1.007 1.00 0.00 C ATOM 410 CD2 TYR A 387 -2.093 -2.460 -1.522 1.00 0.00 C ATOM 411 CE1 TYR A 387 -2.412 -0.044 -0.230 1.00 0.00 C ATOM 412 CE2 TYR A 387 -1.071 -1.957 -0.744 1.00 0.00 C ATOM 413 CZ TYR A 387 -1.234 -0.748 -0.101 1.00 0.00 C ATOM 414 OH TYR A 387 -0.216 -0.238 0.670 1.00 0.00 O ATOM 0 H TYR A 387 -6.295 -0.451 -3.009 1.00 0.00 H new ATOM 0 HA TYR A 387 -3.686 -1.184 -4.200 1.00 0.00 H new ATOM 0 HB2 TYR A 387 -5.323 -2.351 -1.938 1.00 0.00 H new ATOM 0 HB3 TYR A 387 -4.168 -3.340 -2.809 1.00 0.00 H new ATOM 0 HD1 TYR A 387 -4.353 -0.003 -1.105 1.00 0.00 H new ATOM 0 HD2 TYR A 387 -1.960 -3.405 -2.028 1.00 0.00 H new ATOM 0 HE1 TYR A 387 -2.537 0.903 0.274 1.00 0.00 H new ATOM 0 HE2 TYR A 387 -0.148 -2.507 -0.639 1.00 0.00 H new ATOM 0 HH TYR A 387 -0.563 0.485 1.234 1.00 0.00 H new ATOM 424 N VAL A 388 -4.685 -2.595 -5.935 1.00 0.00 N ATOM 425 CA VAL A 388 -5.252 -3.379 -7.019 1.00 0.00 C ATOM 426 C VAL A 388 -4.385 -4.597 -7.327 1.00 0.00 C ATOM 427 O VAL A 388 -3.241 -4.461 -7.761 1.00 0.00 O ATOM 428 CB VAL A 388 -5.402 -2.528 -8.293 1.00 0.00 C ATOM 429 CG1 VAL A 388 -5.979 -3.352 -9.435 1.00 0.00 C ATOM 430 CG2 VAL A 388 -6.266 -1.307 -8.018 1.00 0.00 C ATOM 0 H VAL A 388 -3.729 -2.281 -6.100 1.00 0.00 H new ATOM 0 HA VAL A 388 -6.237 -3.716 -6.695 1.00 0.00 H new ATOM 0 HB VAL A 388 -4.411 -2.188 -8.594 1.00 0.00 H new ATOM 0 HG11 VAL A 388 -6.075 -2.727 -10.323 1.00 0.00 H new ATOM 0 HG12 VAL A 388 -5.316 -4.190 -9.651 1.00 0.00 H new ATOM 0 HG13 VAL A 388 -6.961 -3.731 -9.151 1.00 0.00 H new ATOM 0 HG21 VAL A 388 -6.362 -0.716 -8.929 1.00 0.00 H new ATOM 0 HG22 VAL A 388 -7.254 -1.627 -7.688 1.00 0.00 H new ATOM 0 HG23 VAL A 388 -5.802 -0.701 -7.240 1.00 0.00 H new ATOM 440 N THR A 389 -4.936 -5.785 -7.103 1.00 0.00 N ATOM 441 CA THR A 389 -4.211 -7.023 -7.363 1.00 0.00 C ATOM 442 C THR A 389 -4.169 -7.316 -8.859 1.00 0.00 C ATOM 443 O THR A 389 -5.100 -6.980 -9.592 1.00 0.00 O ATOM 444 CB THR A 389 -4.859 -8.190 -6.616 1.00 0.00 C ATOM 445 OG1 THR A 389 -6.007 -8.651 -7.305 1.00 0.00 O ATOM 446 CG2 THR A 389 -5.278 -7.838 -5.205 1.00 0.00 C ATOM 0 H THR A 389 -5.881 -5.917 -6.742 1.00 0.00 H new ATOM 0 HA THR A 389 -3.189 -6.902 -7.003 1.00 0.00 H new ATOM 0 HB THR A 389 -4.093 -8.963 -6.567 1.00 0.00 H new ATOM 0 HG1 THR A 389 -6.406 -9.398 -6.812 1.00 0.00 H new ATOM 0 HG21 THR A 389 -5.730 -8.709 -4.732 1.00 0.00 H new ATOM 0 HG22 THR A 389 -4.404 -7.527 -4.633 1.00 0.00 H new ATOM 0 HG23 THR A 389 -6.002 -7.024 -5.233 1.00 0.00 H new ATOM 594 N ASN A 399 0.757 -16.210 -7.723 1.00 0.00 N ATOM 595 CA ASN A 399 1.064 -15.509 -6.484 1.00 0.00 C ATOM 596 C ASN A 399 0.124 -14.326 -6.286 1.00 0.00 C ATOM 597 O ASN A 399 -0.460 -13.820 -7.243 1.00 0.00 O ATOM 598 CB ASN A 399 2.518 -15.031 -6.491 1.00 0.00 C ATOM 599 CG ASN A 399 3.323 -15.601 -5.339 1.00 0.00 C ATOM 600 OD1 ASN A 399 4.129 -14.903 -4.725 1.00 0.00 O ATOM 601 ND2 ASN A 399 3.111 -16.876 -5.043 1.00 0.00 N ATOM 0 HA ASN A 399 0.924 -16.203 -5.655 1.00 0.00 H new ATOM 0 HB2 ASN A 399 2.986 -15.316 -7.433 1.00 0.00 H new ATOM 0 HB3 ASN A 399 2.539 -13.942 -6.441 1.00 0.00 H new ATOM 0 HD21 ASN A 399 3.626 -17.315 -4.280 1.00 0.00 H new ATOM 0 HD22 ASN A 399 2.433 -17.418 -5.579 1.00 0.00 H new ATOM 608 N SER A 400 -0.012 -13.883 -5.040 1.00 0.00 N ATOM 609 CA SER A 400 -0.875 -12.754 -4.727 1.00 0.00 C ATOM 610 C SER A 400 -0.121 -11.450 -4.930 1.00 0.00 C ATOM 611 O SER A 400 0.457 -10.903 -3.993 1.00 0.00 O ATOM 612 CB SER A 400 -1.382 -12.849 -3.287 1.00 0.00 C ATOM 613 OG SER A 400 -1.919 -14.133 -3.019 1.00 0.00 O ATOM 0 H SER A 400 0.464 -14.289 -4.234 1.00 0.00 H new ATOM 0 HA SER A 400 -1.733 -12.777 -5.398 1.00 0.00 H new ATOM 0 HB2 SER A 400 -0.565 -12.642 -2.596 1.00 0.00 H new ATOM 0 HB3 SER A 400 -2.145 -12.089 -3.116 1.00 0.00 H new ATOM 0 HG SER A 400 -2.876 -14.138 -3.229 1.00 0.00 H new ATOM 619 N ILE A 401 -0.118 -10.964 -6.163 1.00 0.00 N ATOM 620 CA ILE A 401 0.579 -9.732 -6.486 1.00 0.00 C ATOM 621 C ILE A 401 -0.358 -8.532 -6.375 1.00 0.00 C ATOM 622 O ILE A 401 -1.413 -8.495 -7.009 1.00 0.00 O ATOM 623 CB ILE A 401 1.213 -9.805 -7.901 1.00 0.00 C ATOM 624 CG1 ILE A 401 2.711 -9.509 -7.828 1.00 0.00 C ATOM 625 CG2 ILE A 401 0.530 -8.857 -8.879 1.00 0.00 C ATOM 626 CD1 ILE A 401 3.028 -8.142 -7.262 1.00 0.00 C ATOM 0 H ILE A 401 -0.590 -11.404 -6.953 1.00 0.00 H new ATOM 0 HA ILE A 401 1.384 -9.603 -5.762 1.00 0.00 H new ATOM 0 HB ILE A 401 1.068 -10.819 -8.274 1.00 0.00 H new ATOM 0 HG12 ILE A 401 3.194 -10.269 -7.214 1.00 0.00 H new ATOM 0 HG13 ILE A 401 3.138 -9.588 -8.828 1.00 0.00 H new ATOM 0 HG21 ILE A 401 1.004 -8.939 -9.857 1.00 0.00 H new ATOM 0 HG22 ILE A 401 -0.525 -9.119 -8.964 1.00 0.00 H new ATOM 0 HG23 ILE A 401 0.621 -7.833 -8.517 1.00 0.00 H new ATOM 0 HD11 ILE A 401 4.108 -7.999 -7.239 1.00 0.00 H new ATOM 0 HD12 ILE A 401 2.574 -7.374 -7.889 1.00 0.00 H new ATOM 0 HD13 ILE A 401 2.631 -8.066 -6.250 1.00 0.00 H new ATOM 638 N VAL A 402 0.033 -7.554 -5.567 1.00 0.00 N ATOM 639 CA VAL A 402 -0.770 -6.358 -5.375 1.00 0.00 C ATOM 640 C VAL A 402 0.079 -5.100 -5.519 1.00 0.00 C ATOM 641 O VAL A 402 1.235 -5.065 -5.095 1.00 0.00 O ATOM 642 CB VAL A 402 -1.460 -6.356 -3.998 1.00 0.00 C ATOM 643 CG1 VAL A 402 -2.371 -5.146 -3.854 1.00 0.00 C ATOM 644 CG2 VAL A 402 -2.240 -7.645 -3.793 1.00 0.00 C ATOM 0 H VAL A 402 0.903 -7.568 -5.035 1.00 0.00 H new ATOM 0 HA VAL A 402 -1.537 -6.362 -6.149 1.00 0.00 H new ATOM 0 HB VAL A 402 -0.691 -6.294 -3.228 1.00 0.00 H new ATOM 0 HG11 VAL A 402 -2.848 -5.164 -2.874 1.00 0.00 H new ATOM 0 HG12 VAL A 402 -1.783 -4.234 -3.954 1.00 0.00 H new ATOM 0 HG13 VAL A 402 -3.136 -5.172 -4.630 1.00 0.00 H new ATOM 0 HG21 VAL A 402 -2.721 -7.627 -2.815 1.00 0.00 H new ATOM 0 HG22 VAL A 402 -2.999 -7.738 -4.570 1.00 0.00 H new ATOM 0 HG23 VAL A 402 -1.559 -8.495 -3.847 1.00 0.00 H new ATOM 654 N GLU A 403 -0.502 -4.073 -6.127 1.00 0.00 N ATOM 655 CA GLU A 403 0.195 -2.813 -6.337 1.00 0.00 C ATOM 656 C GLU A 403 -0.640 -1.639 -5.840 1.00 0.00 C ATOM 657 O GLU A 403 -1.782 -1.454 -6.260 1.00 0.00 O ATOM 658 CB GLU A 403 0.523 -2.632 -7.820 1.00 0.00 C ATOM 659 CG GLU A 403 1.734 -3.428 -8.278 1.00 0.00 C ATOM 660 CD GLU A 403 2.104 -3.147 -9.721 1.00 0.00 C ATOM 661 OE1 GLU A 403 2.123 -1.960 -10.109 1.00 0.00 O ATOM 662 OE2 GLU A 403 2.374 -4.114 -10.463 1.00 0.00 O ATOM 0 H GLU A 403 -1.457 -4.090 -6.484 1.00 0.00 H new ATOM 0 HA GLU A 403 1.123 -2.839 -5.767 1.00 0.00 H new ATOM 0 HB2 GLU A 403 -0.342 -2.929 -8.413 1.00 0.00 H new ATOM 0 HB3 GLU A 403 0.698 -1.575 -8.018 1.00 0.00 H new ATOM 0 HG2 GLU A 403 2.583 -3.192 -7.636 1.00 0.00 H new ATOM 0 HG3 GLU A 403 1.531 -4.492 -8.159 1.00 0.00 H new ATOM 669 N CYS A 404 -0.060 -0.846 -4.947 1.00 0.00 N ATOM 670 CA CYS A 404 -0.746 0.315 -4.393 1.00 0.00 C ATOM 671 C CYS A 404 -0.567 1.527 -5.298 1.00 0.00 C ATOM 672 O CYS A 404 0.530 2.072 -5.409 1.00 0.00 O ATOM 673 CB CYS A 404 -0.214 0.629 -2.995 1.00 0.00 C ATOM 674 SG CYS A 404 -1.030 2.029 -2.191 1.00 0.00 S ATOM 0 H CYS A 404 0.885 -0.986 -4.591 1.00 0.00 H new ATOM 0 HA CYS A 404 -1.809 0.082 -4.325 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -0.330 -0.254 -2.367 1.00 0.00 H new ATOM 0 HB3 CYS A 404 0.854 0.835 -3.062 1.00 0.00 H new ATOM 0 HG CYS A 404 -1.814 1.593 -1.250 1.00 0.00 H new ATOM 680 N ARG A 405 -1.652 1.947 -5.937 1.00 0.00 N ATOM 681 CA ARG A 405 -1.614 3.094 -6.829 1.00 0.00 C ATOM 682 C ARG A 405 -2.332 4.279 -6.203 1.00 0.00 C ATOM 683 O ARG A 405 -3.376 4.122 -5.569 1.00 0.00 O ATOM 684 CB ARG A 405 -2.252 2.749 -8.175 1.00 0.00 C ATOM 685 CG ARG A 405 -1.776 1.426 -8.753 1.00 0.00 C ATOM 686 CD ARG A 405 -2.787 0.316 -8.517 1.00 0.00 C ATOM 687 NE ARG A 405 -2.422 -0.915 -9.216 1.00 0.00 N ATOM 688 CZ ARG A 405 -2.530 -1.079 -10.532 1.00 0.00 C ATOM 689 NH1 ARG A 405 -2.990 -0.095 -11.295 1.00 0.00 N ATOM 690 NH2 ARG A 405 -2.175 -2.230 -11.087 1.00 0.00 N ATOM 0 H ARG A 405 -2.569 1.508 -5.852 1.00 0.00 H new ATOM 0 HA ARG A 405 -0.571 3.362 -6.994 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -3.335 2.715 -8.056 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -2.034 3.546 -8.886 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -1.601 1.538 -9.823 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -0.823 1.153 -8.301 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -2.864 0.117 -7.448 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -3.771 0.645 -8.851 1.00 0.00 H new ATOM 0 HE ARG A 405 -2.064 -1.693 -8.663 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -3.263 0.793 -10.873 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -3.071 -0.227 -12.303 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -1.820 -2.989 -10.505 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -2.257 -2.357 -12.096 1.00 0.00 H new ATOM 702 N VAL A 406 -1.767 5.464 -6.382 1.00 0.00 N ATOM 703 CA VAL A 406 -2.359 6.673 -5.828 1.00 0.00 C ATOM 704 C VAL A 406 -3.429 7.239 -6.756 1.00 0.00 C ATOM 705 O VAL A 406 -3.563 6.809 -7.901 1.00 0.00 O ATOM 706 CB VAL A 406 -1.293 7.755 -5.565 1.00 0.00 C ATOM 707 CG1 VAL A 406 -0.282 7.269 -4.538 1.00 0.00 C ATOM 708 CG2 VAL A 406 -0.600 8.154 -6.860 1.00 0.00 C ATOM 0 H VAL A 406 -0.904 5.614 -6.904 1.00 0.00 H new ATOM 0 HA VAL A 406 -2.818 6.392 -4.880 1.00 0.00 H new ATOM 0 HB VAL A 406 -1.791 8.637 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL A 406 0.463 8.046 -4.365 1.00 0.00 H new ATOM 0 HG12 VAL A 406 -0.794 7.042 -3.603 1.00 0.00 H new ATOM 0 HG13 VAL A 406 0.211 6.370 -4.909 1.00 0.00 H new ATOM 0 HG21 VAL A 406 0.148 8.919 -6.652 1.00 0.00 H new ATOM 0 HG22 VAL A 406 -0.115 7.281 -7.297 1.00 0.00 H new ATOM 0 HG23 VAL A 406 -1.336 8.548 -7.560 1.00 0.00 H new ATOM 744 N THR A 410 0.219 6.402 -10.039 1.00 0.00 N ATOM 745 CA THR A 410 1.582 6.175 -9.573 1.00 0.00 C ATOM 746 C THR A 410 1.613 5.112 -8.479 1.00 0.00 C ATOM 747 O THR A 410 1.179 5.354 -7.353 1.00 0.00 O ATOM 748 CB THR A 410 2.189 7.480 -9.051 1.00 0.00 C ATOM 749 OG1 THR A 410 2.259 8.447 -10.083 1.00 0.00 O ATOM 750 CG2 THR A 410 3.584 7.311 -8.486 1.00 0.00 C ATOM 0 HA THR A 410 2.174 5.819 -10.417 1.00 0.00 H new ATOM 0 HB THR A 410 1.527 7.804 -8.248 1.00 0.00 H new ATOM 0 HG1 THR A 410 1.474 8.363 -10.664 1.00 0.00 H new ATOM 0 HG21 THR A 410 3.953 8.274 -8.134 1.00 0.00 H new ATOM 0 HG22 THR A 410 3.557 6.607 -7.654 1.00 0.00 H new ATOM 0 HG23 THR A 410 4.247 6.930 -9.262 1.00 0.00 H new ATOM 758 N VAL A 411 2.134 3.938 -8.817 1.00 0.00 N ATOM 759 CA VAL A 411 2.227 2.843 -7.861 1.00 0.00 C ATOM 760 C VAL A 411 3.434 3.021 -6.951 1.00 0.00 C ATOM 761 O VAL A 411 4.570 3.103 -7.415 1.00 0.00 O ATOM 762 CB VAL A 411 2.327 1.478 -8.567 1.00 0.00 C ATOM 763 CG1 VAL A 411 2.200 0.347 -7.558 1.00 0.00 C ATOM 764 CG2 VAL A 411 1.269 1.358 -9.653 1.00 0.00 C ATOM 0 H VAL A 411 2.498 3.721 -9.745 1.00 0.00 H new ATOM 0 HA VAL A 411 1.314 2.863 -7.266 1.00 0.00 H new ATOM 0 HB VAL A 411 3.306 1.404 -9.040 1.00 0.00 H new ATOM 0 HG11 VAL A 411 2.273 -0.611 -8.074 1.00 0.00 H new ATOM 0 HG12 VAL A 411 3.000 0.425 -6.822 1.00 0.00 H new ATOM 0 HG13 VAL A 411 1.236 0.415 -7.054 1.00 0.00 H new ATOM 0 HG21 VAL A 411 1.356 0.387 -10.140 1.00 0.00 H new ATOM 0 HG22 VAL A 411 0.278 1.453 -9.208 1.00 0.00 H new ATOM 0 HG23 VAL A 411 1.413 2.148 -10.390 1.00 0.00 H new ATOM 774 N LEU A 412 3.175 3.088 -5.652 1.00 0.00 N ATOM 775 CA LEU A 412 4.233 3.266 -4.671 1.00 0.00 C ATOM 776 C LEU A 412 4.403 2.020 -3.805 1.00 0.00 C ATOM 777 O LEU A 412 5.457 1.812 -3.205 1.00 0.00 O ATOM 778 CB LEU A 412 3.928 4.477 -3.791 1.00 0.00 C ATOM 779 CG LEU A 412 5.059 5.500 -3.691 1.00 0.00 C ATOM 780 CD1 LEU A 412 4.513 6.864 -3.301 1.00 0.00 C ATOM 781 CD2 LEU A 412 6.107 5.032 -2.694 1.00 0.00 C ATOM 0 H LEU A 412 2.238 3.021 -5.254 1.00 0.00 H new ATOM 0 HA LEU A 412 5.167 3.433 -5.207 1.00 0.00 H new ATOM 0 HB2 LEU A 412 3.040 4.976 -4.179 1.00 0.00 H new ATOM 0 HB3 LEU A 412 3.684 4.127 -2.788 1.00 0.00 H new ATOM 0 HG LEU A 412 5.532 5.592 -4.669 1.00 0.00 H new ATOM 0 HD11 LEU A 412 5.333 7.579 -3.235 1.00 0.00 H new ATOM 0 HD12 LEU A 412 3.799 7.199 -4.054 1.00 0.00 H new ATOM 0 HD13 LEU A 412 4.014 6.793 -2.334 1.00 0.00 H new ATOM 0 HD21 LEU A 412 6.907 5.770 -2.633 1.00 0.00 H new ATOM 0 HD22 LEU A 412 5.648 4.912 -1.713 1.00 0.00 H new ATOM 0 HD23 LEU A 412 6.519 4.077 -3.021 1.00 0.00 H new ATOM 793 N GLY A 413 3.360 1.201 -3.738 1.00 0.00 N ATOM 794 CA GLY A 413 3.422 -0.007 -2.932 1.00 0.00 C ATOM 795 C GLY A 413 3.203 -1.272 -3.740 1.00 0.00 C ATOM 796 O GLY A 413 2.077 -1.752 -3.856 1.00 0.00 O ATOM 0 H GLY A 413 2.476 1.349 -4.224 1.00 0.00 H new ATOM 0 HA2 GLY A 413 4.394 -0.060 -2.441 1.00 0.00 H new ATOM 0 HA3 GLY A 413 2.670 0.049 -2.145 1.00 0.00 H new ATOM 800 N THR A 414 4.281 -1.815 -4.294 1.00 0.00 N ATOM 801 CA THR A 414 4.200 -3.033 -5.089 1.00 0.00 C ATOM 802 C THR A 414 4.839 -4.206 -4.351 1.00 0.00 C ATOM 803 O THR A 414 6.047 -4.221 -4.117 1.00 0.00 O ATOM 804 CB THR A 414 4.889 -2.826 -6.438 1.00 0.00 C ATOM 805 OG1 THR A 414 4.265 -1.783 -7.164 1.00 0.00 O ATOM 806 CG2 THR A 414 4.884 -4.061 -7.313 1.00 0.00 C ATOM 0 H THR A 414 5.222 -1.430 -4.207 1.00 0.00 H new ATOM 0 HA THR A 414 3.148 -3.264 -5.256 1.00 0.00 H new ATOM 0 HB THR A 414 5.923 -2.578 -6.197 1.00 0.00 H new ATOM 0 HG1 THR A 414 4.721 -1.664 -8.023 1.00 0.00 H new ATOM 0 HG21 THR A 414 5.389 -3.842 -8.254 1.00 0.00 H new ATOM 0 HG22 THR A 414 5.404 -4.871 -6.802 1.00 0.00 H new ATOM 0 HG23 THR A 414 3.855 -4.360 -7.514 1.00 0.00 H new ATOM 814 N GLY A 415 4.020 -5.189 -3.984 1.00 0.00 N ATOM 815 CA GLY A 415 4.529 -6.349 -3.277 1.00 0.00 C ATOM 816 C GLY A 415 3.641 -7.566 -3.436 1.00 0.00 C ATOM 817 O GLY A 415 2.415 -7.460 -3.381 1.00 0.00 O ATOM 0 H GLY A 415 3.016 -5.202 -4.164 1.00 0.00 H new ATOM 0 HA2 GLY A 415 5.529 -6.583 -3.643 1.00 0.00 H new ATOM 0 HA3 GLY A 415 4.626 -6.110 -2.218 1.00 0.00 H new ATOM 821 N VAL A 416 4.260 -8.725 -3.633 1.00 0.00 N ATOM 822 CA VAL A 416 3.519 -9.969 -3.800 1.00 0.00 C ATOM 823 C VAL A 416 3.245 -10.627 -2.458 1.00 0.00 C ATOM 824 O VAL A 416 3.645 -10.128 -1.407 1.00 0.00 O ATOM 825 CB VAL A 416 4.275 -10.961 -4.712 1.00 0.00 C ATOM 826 CG1 VAL A 416 5.358 -11.711 -3.945 1.00 0.00 C ATOM 827 CG2 VAL A 416 3.312 -11.931 -5.377 1.00 0.00 C ATOM 0 H VAL A 416 5.274 -8.828 -3.681 1.00 0.00 H new ATOM 0 HA VAL A 416 2.571 -9.712 -4.273 1.00 0.00 H new ATOM 0 HB VAL A 416 4.766 -10.380 -5.493 1.00 0.00 H new ATOM 0 HG11 VAL A 416 5.869 -12.400 -4.617 1.00 0.00 H new ATOM 0 HG12 VAL A 416 6.077 -10.999 -3.540 1.00 0.00 H new ATOM 0 HG13 VAL A 416 4.903 -12.272 -3.128 1.00 0.00 H new ATOM 0 HG21 VAL A 416 3.869 -12.618 -6.013 1.00 0.00 H new ATOM 0 HG22 VAL A 416 2.779 -12.496 -4.612 1.00 0.00 H new ATOM 0 HG23 VAL A 416 2.596 -11.375 -5.983 1.00 0.00 H new ATOM 837 N GLY A 417 2.558 -11.751 -2.515 1.00 0.00 N ATOM 838 CA GLY A 417 2.228 -12.484 -1.308 1.00 0.00 C ATOM 839 C GLY A 417 1.453 -13.755 -1.588 1.00 0.00 C ATOM 840 O GLY A 417 1.162 -14.070 -2.741 1.00 0.00 O ATOM 0 H GLY A 417 2.219 -12.175 -3.379 1.00 0.00 H new ATOM 0 HA2 GLY A 417 3.147 -12.733 -0.777 1.00 0.00 H new ATOM 0 HA3 GLY A 417 1.642 -11.844 -0.648 1.00 0.00 H new ATOM 844 N ARG A 418 1.117 -14.484 -0.530 1.00 0.00 N ATOM 845 CA ARG A 418 0.366 -15.726 -0.668 1.00 0.00 C ATOM 846 C ARG A 418 -1.129 -15.443 -0.752 1.00 0.00 C ATOM 847 O ARG A 418 -1.873 -16.171 -1.407 1.00 0.00 O ATOM 848 CB ARG A 418 0.657 -16.661 0.508 1.00 0.00 C ATOM 849 CG ARG A 418 0.381 -16.039 1.867 1.00 0.00 C ATOM 850 CD ARG A 418 0.471 -17.072 2.979 1.00 0.00 C ATOM 851 NE ARG A 418 1.099 -16.529 4.181 1.00 0.00 N ATOM 852 CZ ARG A 418 1.670 -17.276 5.124 1.00 0.00 C ATOM 853 NH1 ARG A 418 1.691 -18.599 5.011 1.00 0.00 N ATOM 854 NH2 ARG A 418 2.220 -16.700 6.182 1.00 0.00 N ATOM 0 H ARG A 418 1.352 -14.237 0.431 1.00 0.00 H new ATOM 0 HA ARG A 418 0.681 -16.213 -1.591 1.00 0.00 H new ATOM 0 HB2 ARG A 418 0.053 -17.562 0.402 1.00 0.00 H new ATOM 0 HB3 ARG A 418 1.701 -16.970 0.465 1.00 0.00 H new ATOM 0 HG2 ARG A 418 1.096 -15.238 2.054 1.00 0.00 H new ATOM 0 HG3 ARG A 418 -0.611 -15.587 1.867 1.00 0.00 H new ATOM 0 HD2 ARG A 418 -0.529 -17.430 3.223 1.00 0.00 H new ATOM 0 HD3 ARG A 418 1.041 -17.932 2.629 1.00 0.00 H new ATOM 0 HE ARG A 418 1.100 -15.517 4.305 1.00 0.00 H new ATOM 0 HH11 ARG A 418 1.268 -19.048 4.199 1.00 0.00 H new ATOM 0 HH12 ARG A 418 2.130 -19.166 5.737 1.00 0.00 H new ATOM 0 HH21 ARG A 418 2.206 -15.684 6.275 1.00 0.00 H new ATOM 0 HH22 ARG A 418 2.657 -17.272 6.904 1.00 0.00 H new ATOM 866 N ASN A 419 -1.560 -14.375 -0.087 1.00 0.00 N ATOM 867 CA ASN A 419 -2.966 -13.991 -0.092 1.00 0.00 C ATOM 868 C ASN A 419 -3.112 -12.472 -0.078 1.00 0.00 C ATOM 869 O ASN A 419 -2.121 -11.743 -0.048 1.00 0.00 O ATOM 870 CB ASN A 419 -3.693 -14.601 1.109 1.00 0.00 C ATOM 871 CG ASN A 419 -3.044 -14.238 2.429 1.00 0.00 C ATOM 872 OD1 ASN A 419 -2.595 -13.108 2.623 1.00 0.00 O ATOM 873 ND2 ASN A 419 -2.991 -15.197 3.347 1.00 0.00 N ATOM 0 H ASN A 419 -0.956 -13.762 0.461 1.00 0.00 H new ATOM 0 HA ASN A 419 -3.418 -14.374 -1.007 1.00 0.00 H new ATOM 0 HB2 ASN A 419 -4.729 -14.262 1.112 1.00 0.00 H new ATOM 0 HB3 ASN A 419 -3.713 -15.686 1.004 1.00 0.00 H new ATOM 0 HD21 ASN A 419 -2.566 -15.011 4.255 1.00 0.00 H new ATOM 0 HD22 ASN A 419 -3.376 -16.120 3.144 1.00 0.00 H new ATOM 880 N ILE A 420 -4.355 -12.001 -0.108 1.00 0.00 N ATOM 881 CA ILE A 420 -4.631 -10.569 -0.105 1.00 0.00 C ATOM 882 C ILE A 420 -4.088 -9.902 1.156 1.00 0.00 C ATOM 883 O ILE A 420 -3.710 -8.731 1.136 1.00 0.00 O ATOM 884 CB ILE A 420 -6.143 -10.287 -0.214 1.00 0.00 C ATOM 885 CG1 ILE A 420 -6.729 -10.998 -1.435 1.00 0.00 C ATOM 886 CG2 ILE A 420 -6.402 -8.789 -0.294 1.00 0.00 C ATOM 887 CD1 ILE A 420 -7.351 -12.338 -1.114 1.00 0.00 C ATOM 0 H ILE A 420 -5.187 -12.591 -0.135 1.00 0.00 H new ATOM 0 HA ILE A 420 -4.127 -10.150 -0.976 1.00 0.00 H new ATOM 0 HB ILE A 420 -6.633 -10.672 0.680 1.00 0.00 H new ATOM 0 HG12 ILE A 420 -7.483 -10.357 -1.891 1.00 0.00 H new ATOM 0 HG13 ILE A 420 -5.941 -11.140 -2.175 1.00 0.00 H new ATOM 0 HG21 ILE A 420 -7.474 -8.609 -0.370 1.00 0.00 H new ATOM 0 HG22 ILE A 420 -6.016 -8.305 0.603 1.00 0.00 H new ATOM 0 HG23 ILE A 420 -5.902 -8.380 -1.172 1.00 0.00 H new ATOM 0 HD11 ILE A 420 -7.746 -12.784 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 420 -6.595 -12.997 -0.686 1.00 0.00 H new ATOM 0 HD13 ILE A 420 -8.161 -12.201 -0.398 1.00 0.00 H new ATOM 899 N LYS A 421 -4.053 -10.653 2.251 1.00 0.00 N ATOM 900 CA LYS A 421 -3.558 -10.130 3.519 1.00 0.00 C ATOM 901 C LYS A 421 -2.063 -9.847 3.448 1.00 0.00 C ATOM 902 O LYS A 421 -1.616 -8.730 3.712 1.00 0.00 O ATOM 903 CB LYS A 421 -3.848 -11.118 4.650 1.00 0.00 C ATOM 904 CG LYS A 421 -4.188 -10.448 5.971 1.00 0.00 C ATOM 905 CD LYS A 421 -2.983 -10.395 6.895 1.00 0.00 C ATOM 906 CE LYS A 421 -3.117 -9.280 7.920 1.00 0.00 C ATOM 907 NZ LYS A 421 -1.873 -9.107 8.721 1.00 0.00 N ATOM 0 H LYS A 421 -4.361 -11.625 2.286 1.00 0.00 H new ATOM 0 HA LYS A 421 -4.076 -9.193 3.721 1.00 0.00 H new ATOM 0 HB2 LYS A 421 -4.676 -11.762 4.355 1.00 0.00 H new ATOM 0 HB3 LYS A 421 -2.979 -11.761 4.791 1.00 0.00 H new ATOM 0 HG2 LYS A 421 -4.550 -9.437 5.785 1.00 0.00 H new ATOM 0 HG3 LYS A 421 -4.998 -10.991 6.458 1.00 0.00 H new ATOM 0 HD2 LYS A 421 -2.874 -11.351 7.407 1.00 0.00 H new ATOM 0 HD3 LYS A 421 -2.078 -10.243 6.307 1.00 0.00 H new ATOM 0 HE2 LYS A 421 -3.353 -8.346 7.411 1.00 0.00 H new ATOM 0 HE3 LYS A 421 -3.951 -9.499 8.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 421 -2.051 -9.392 9.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 421 -1.117 -9.699 8.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 421 -1.581 -8.109 8.697 1.00 0.00 H new ATOM 921 N ILE A 422 -1.296 -10.868 3.092 1.00 0.00 N ATOM 922 CA ILE A 422 0.153 -10.739 2.986 1.00 0.00 C ATOM 923 C ILE A 422 0.539 -9.774 1.870 1.00 0.00 C ATOM 924 O ILE A 422 1.214 -8.772 2.108 1.00 0.00 O ATOM 925 CB ILE A 422 0.818 -12.113 2.745 1.00 0.00 C ATOM 926 CG1 ILE A 422 0.812 -12.933 4.036 1.00 0.00 C ATOM 927 CG2 ILE A 422 2.242 -11.952 2.231 1.00 0.00 C ATOM 928 CD1 ILE A 422 -0.499 -13.637 4.299 1.00 0.00 C ATOM 0 H ILE A 422 -1.653 -11.798 2.871 1.00 0.00 H new ATOM 0 HA ILE A 422 0.513 -10.338 3.933 1.00 0.00 H new ATOM 0 HB ILE A 422 0.242 -12.640 1.984 1.00 0.00 H new ATOM 0 HG12 ILE A 422 1.610 -13.674 3.990 1.00 0.00 H new ATOM 0 HG13 ILE A 422 1.036 -12.275 4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 422 2.684 -12.935 2.071 1.00 0.00 H new ATOM 0 HG22 ILE A 422 2.229 -11.402 1.290 1.00 0.00 H new ATOM 0 HG23 ILE A 422 2.833 -11.403 2.964 1.00 0.00 H new ATOM 0 HD11 ILE A 422 -0.430 -14.199 5.231 1.00 0.00 H new ATOM 0 HD12 ILE A 422 -1.298 -12.900 4.378 1.00 0.00 H new ATOM 0 HD13 ILE A 422 -0.716 -14.321 3.478 1.00 0.00 H new ATOM 940 N ALA A 423 0.110 -10.083 0.653 1.00 0.00 N ATOM 941 CA ALA A 423 0.413 -9.242 -0.501 1.00 0.00 C ATOM 942 C ALA A 423 0.113 -7.778 -0.208 1.00 0.00 C ATOM 943 O ALA A 423 0.920 -6.895 -0.500 1.00 0.00 O ATOM 944 CB ALA A 423 -0.367 -9.708 -1.719 1.00 0.00 C ATOM 0 H ALA A 423 -0.449 -10.909 0.438 1.00 0.00 H new ATOM 0 HA ALA A 423 1.479 -9.333 -0.712 1.00 0.00 H new ATOM 0 HB1 ALA A 423 -0.129 -9.070 -2.570 1.00 0.00 H new ATOM 0 HB2 ALA A 423 -0.097 -10.738 -1.952 1.00 0.00 H new ATOM 0 HB3 ALA A 423 -1.435 -9.651 -1.511 1.00 0.00 H new ATOM 950 N GLY A 424 -1.050 -7.531 0.379 1.00 0.00 N ATOM 951 CA GLY A 424 -1.437 -6.174 0.714 1.00 0.00 C ATOM 952 C GLY A 424 -0.436 -5.506 1.634 1.00 0.00 C ATOM 953 O GLY A 424 -0.052 -4.357 1.416 1.00 0.00 O ATOM 0 H GLY A 424 -1.733 -8.246 0.630 1.00 0.00 H new ATOM 0 HA2 GLY A 424 -1.534 -5.589 -0.201 1.00 0.00 H new ATOM 0 HA3 GLY A 424 -2.417 -6.184 1.192 1.00 0.00 H new ATOM 957 N ILE A 425 -0.004 -6.233 2.659 1.00 0.00 N ATOM 958 CA ILE A 425 0.968 -5.711 3.608 1.00 0.00 C ATOM 959 C ILE A 425 2.336 -5.574 2.950 1.00 0.00 C ATOM 960 O ILE A 425 3.105 -4.669 3.274 1.00 0.00 O ATOM 961 CB ILE A 425 1.088 -6.620 4.849 1.00 0.00 C ATOM 962 CG1 ILE A 425 -0.265 -6.739 5.553 1.00 0.00 C ATOM 963 CG2 ILE A 425 2.142 -6.083 5.808 1.00 0.00 C ATOM 964 CD1 ILE A 425 -0.368 -7.942 6.466 1.00 0.00 C ATOM 0 H ILE A 425 -0.313 -7.186 2.852 1.00 0.00 H new ATOM 0 HA ILE A 425 0.617 -4.730 3.928 1.00 0.00 H new ATOM 0 HB ILE A 425 1.398 -7.612 4.521 1.00 0.00 H new ATOM 0 HG12 ILE A 425 -0.443 -5.835 6.135 1.00 0.00 H new ATOM 0 HG13 ILE A 425 -1.053 -6.795 4.802 1.00 0.00 H new ATOM 0 HG21 ILE A 425 2.211 -6.738 6.676 1.00 0.00 H new ATOM 0 HG22 ILE A 425 3.108 -6.046 5.304 1.00 0.00 H new ATOM 0 HG23 ILE A 425 1.863 -5.080 6.131 1.00 0.00 H new ATOM 0 HD11 ILE A 425 -1.354 -7.962 6.931 1.00 0.00 H new ATOM 0 HD12 ILE A 425 -0.222 -8.853 5.886 1.00 0.00 H new ATOM 0 HD13 ILE A 425 0.397 -7.878 7.240 1.00 0.00 H new ATOM 976 N ARG A 426 2.629 -6.478 2.021 1.00 0.00 N ATOM 977 CA ARG A 426 3.901 -6.457 1.313 1.00 0.00 C ATOM 978 C ARG A 426 3.988 -5.235 0.407 1.00 0.00 C ATOM 979 O ARG A 426 5.025 -4.577 0.331 1.00 0.00 O ATOM 980 CB ARG A 426 4.075 -7.736 0.491 1.00 0.00 C ATOM 981 CG ARG A 426 5.478 -8.319 0.563 1.00 0.00 C ATOM 982 CD ARG A 426 6.122 -8.401 -0.813 1.00 0.00 C ATOM 983 NE ARG A 426 7.570 -8.560 -0.730 1.00 0.00 N ATOM 984 CZ ARG A 426 8.398 -8.360 -1.755 1.00 0.00 C ATOM 985 NH1 ARG A 426 7.922 -7.995 -2.939 1.00 0.00 N ATOM 986 NH2 ARG A 426 9.703 -8.524 -1.593 1.00 0.00 N ATOM 0 H ARG A 426 2.003 -7.233 1.742 1.00 0.00 H new ATOM 0 HA ARG A 426 4.703 -6.402 2.049 1.00 0.00 H new ATOM 0 HB2 ARG A 426 3.362 -8.483 0.840 1.00 0.00 H new ATOM 0 HB3 ARG A 426 3.831 -7.525 -0.550 1.00 0.00 H new ATOM 0 HG2 ARG A 426 6.095 -7.704 1.218 1.00 0.00 H new ATOM 0 HG3 ARG A 426 5.437 -9.314 1.006 1.00 0.00 H new ATOM 0 HD2 ARG A 426 5.696 -9.240 -1.363 1.00 0.00 H new ATOM 0 HD3 ARG A 426 5.888 -7.498 -1.377 1.00 0.00 H new ATOM 0 HE ARG A 426 7.972 -8.841 0.165 1.00 0.00 H new ATOM 0 HH11 ARG A 426 6.918 -7.866 -3.068 1.00 0.00 H new ATOM 0 HH12 ARG A 426 8.560 -7.843 -3.720 1.00 0.00 H new ATOM 0 HH21 ARG A 426 10.073 -8.803 -0.684 1.00 0.00 H new ATOM 0 HH22 ARG A 426 10.337 -8.371 -2.377 1.00 0.00 H new ATOM 998 N ALA A 427 2.887 -4.933 -0.271 1.00 0.00 N ATOM 999 CA ALA A 427 2.835 -3.783 -1.164 1.00 0.00 C ATOM 1000 C ALA A 427 2.972 -2.492 -0.372 1.00 0.00 C ATOM 1001 O ALA A 427 3.753 -1.610 -0.728 1.00 0.00 O ATOM 1002 CB ALA A 427 1.539 -3.789 -1.962 1.00 0.00 C ATOM 0 H ALA A 427 2.020 -5.468 -0.219 1.00 0.00 H new ATOM 0 HA ALA A 427 3.668 -3.847 -1.864 1.00 0.00 H new ATOM 0 HB1 ALA A 427 1.516 -2.924 -2.624 1.00 0.00 H new ATOM 0 HB2 ALA A 427 1.481 -4.702 -2.555 1.00 0.00 H new ATOM 0 HB3 ALA A 427 0.691 -3.746 -1.279 1.00 0.00 H new ATOM 1008 N ALA A 428 2.218 -2.399 0.716 1.00 0.00 N ATOM 1009 CA ALA A 428 2.262 -1.226 1.577 1.00 0.00 C ATOM 1010 C ALA A 428 3.643 -1.088 2.198 1.00 0.00 C ATOM 1011 O ALA A 428 4.192 0.010 2.288 1.00 0.00 O ATOM 1012 CB ALA A 428 1.202 -1.325 2.663 1.00 0.00 C ATOM 0 H ALA A 428 1.568 -3.123 1.023 1.00 0.00 H new ATOM 0 HA ALA A 428 2.057 -0.341 0.975 1.00 0.00 H new ATOM 0 HB1 ALA A 428 1.248 -0.440 3.298 1.00 0.00 H new ATOM 0 HB2 ALA A 428 0.216 -1.391 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 428 1.381 -2.215 3.267 1.00 0.00 H new ATOM 1018 N GLU A 429 4.202 -2.218 2.610 1.00 0.00 N ATOM 1019 CA GLU A 429 5.528 -2.236 3.212 1.00 0.00 C ATOM 1020 C GLU A 429 6.562 -1.734 2.212 1.00 0.00 C ATOM 1021 O GLU A 429 7.514 -1.044 2.577 1.00 0.00 O ATOM 1022 CB GLU A 429 5.886 -3.648 3.677 1.00 0.00 C ATOM 1023 CG GLU A 429 5.485 -3.932 5.114 1.00 0.00 C ATOM 1024 CD GLU A 429 5.767 -5.363 5.527 1.00 0.00 C ATOM 1025 OE1 GLU A 429 5.343 -6.285 4.800 1.00 0.00 O ATOM 1026 OE2 GLU A 429 6.411 -5.562 6.579 1.00 0.00 O ATOM 0 H GLU A 429 3.758 -3.134 2.538 1.00 0.00 H new ATOM 0 HA GLU A 429 5.525 -1.577 4.080 1.00 0.00 H new ATOM 0 HB2 GLU A 429 5.400 -4.372 3.023 1.00 0.00 H new ATOM 0 HB3 GLU A 429 6.961 -3.795 3.572 1.00 0.00 H new ATOM 0 HG2 GLU A 429 6.022 -3.254 5.778 1.00 0.00 H new ATOM 0 HG3 GLU A 429 4.422 -3.725 5.238 1.00 0.00 H new ATOM 1033 N ASN A 430 6.355 -2.076 0.945 1.00 0.00 N ATOM 1034 CA ASN A 430 7.254 -1.648 -0.117 1.00 0.00 C ATOM 1035 C ASN A 430 7.206 -0.133 -0.258 1.00 0.00 C ATOM 1036 O ASN A 430 8.215 0.511 -0.546 1.00 0.00 O ATOM 1037 CB ASN A 430 6.871 -2.317 -1.441 1.00 0.00 C ATOM 1038 CG ASN A 430 7.902 -3.333 -1.893 1.00 0.00 C ATOM 1039 OD1 ASN A 430 8.328 -3.225 -3.147 1.00 0.00 O flip ATOM 1040 ND2 ASN A 430 8.311 -4.204 -1.126 1.00 0.00 N flip ATOM 0 H ASN A 430 5.572 -2.649 0.630 1.00 0.00 H new ATOM 0 HA ASN A 430 8.270 -1.947 0.140 1.00 0.00 H new ATOM 0 HB2 ASN A 430 5.904 -2.808 -1.331 1.00 0.00 H new ATOM 0 HB3 ASN A 430 6.755 -1.554 -2.211 1.00 0.00 H new ATOM 0 HD21 ASN A 430 7.956 -4.250 -0.171 1.00 0.00 H new ATOM 0 HD22 ASN A 430 9.005 -4.880 -1.445 1.00 0.00 H new ATOM 1047 N ALA A 431 6.021 0.429 -0.037 1.00 0.00 N ATOM 1048 CA ALA A 431 5.826 1.869 -0.123 1.00 0.00 C ATOM 1049 C ALA A 431 6.381 2.559 1.119 1.00 0.00 C ATOM 1050 O ALA A 431 6.820 3.708 1.061 1.00 0.00 O ATOM 1051 CB ALA A 431 4.350 2.190 -0.295 1.00 0.00 C ATOM 0 H ALA A 431 5.180 -0.095 0.204 1.00 0.00 H new ATOM 0 HA ALA A 431 6.367 2.242 -0.993 1.00 0.00 H new ATOM 0 HB1 ALA A 431 4.217 3.270 -0.358 1.00 0.00 H new ATOM 0 HB2 ALA A 431 3.981 1.725 -1.209 1.00 0.00 H new ATOM 0 HB3 ALA A 431 3.792 1.805 0.559 1.00 0.00 H new ATOM 1057 N LEU A 432 6.362 1.846 2.242 1.00 0.00 N ATOM 1058 CA LEU A 432 6.865 2.384 3.500 1.00 0.00 C ATOM 1059 C LEU A 432 8.384 2.264 3.575 1.00 0.00 C ATOM 1060 O LEU A 432 9.047 3.061 4.239 1.00 0.00 O ATOM 1061 CB LEU A 432 6.226 1.653 4.683 1.00 0.00 C ATOM 1062 CG LEU A 432 4.702 1.759 4.766 1.00 0.00 C ATOM 1063 CD1 LEU A 432 4.105 0.476 5.322 1.00 0.00 C ATOM 1064 CD2 LEU A 432 4.298 2.951 5.621 1.00 0.00 C ATOM 0 H LEU A 432 6.003 0.893 2.305 1.00 0.00 H new ATOM 0 HA LEU A 432 6.599 3.440 3.547 1.00 0.00 H new ATOM 0 HB2 LEU A 432 6.499 0.599 4.629 1.00 0.00 H new ATOM 0 HB3 LEU A 432 6.653 2.046 5.606 1.00 0.00 H new ATOM 0 HG LEU A 432 4.312 1.909 3.759 1.00 0.00 H new ATOM 0 HD11 LEU A 432 3.020 0.572 5.373 1.00 0.00 H new ATOM 0 HD12 LEU A 432 4.365 -0.358 4.671 1.00 0.00 H new ATOM 0 HD13 LEU A 432 4.501 0.294 6.321 1.00 0.00 H new ATOM 0 HD21 LEU A 432 3.211 3.012 5.670 1.00 0.00 H new ATOM 0 HD22 LEU A 432 4.700 2.830 6.627 1.00 0.00 H new ATOM 0 HD23 LEU A 432 4.693 3.866 5.180 1.00 0.00 H new ATOM 1076 N ARG A 433 8.930 1.263 2.889 1.00 0.00 N ATOM 1077 CA ARG A 433 10.372 1.039 2.878 1.00 0.00 C ATOM 1078 C ARG A 433 11.116 2.296 2.439 1.00 0.00 C ATOM 1079 O ARG A 433 12.209 2.585 2.924 1.00 0.00 O ATOM 1080 CB ARG A 433 10.722 -0.124 1.947 1.00 0.00 C ATOM 1081 CG ARG A 433 10.626 -1.487 2.614 1.00 0.00 C ATOM 1082 CD ARG A 433 10.862 -2.613 1.620 1.00 0.00 C ATOM 1083 NE ARG A 433 10.613 -3.926 2.211 1.00 0.00 N ATOM 1084 CZ ARG A 433 10.671 -5.068 1.531 1.00 0.00 C ATOM 1085 NH1 ARG A 433 10.967 -5.064 0.236 1.00 0.00 N ATOM 1086 NH2 ARG A 433 10.432 -6.219 2.146 1.00 0.00 N ATOM 0 H ARG A 433 8.395 0.595 2.334 1.00 0.00 H new ATOM 0 HA ARG A 433 10.682 0.790 3.893 1.00 0.00 H new ATOM 0 HB2 ARG A 433 10.055 -0.102 1.085 1.00 0.00 H new ATOM 0 HB3 ARG A 433 11.735 0.016 1.569 1.00 0.00 H new ATOM 0 HG2 ARG A 433 11.358 -1.552 3.419 1.00 0.00 H new ATOM 0 HG3 ARG A 433 9.642 -1.602 3.069 1.00 0.00 H new ATOM 0 HD2 ARG A 433 10.213 -2.475 0.756 1.00 0.00 H new ATOM 0 HD3 ARG A 433 11.889 -2.567 1.258 1.00 0.00 H new ATOM 0 HE ARG A 433 10.381 -3.970 3.203 1.00 0.00 H new ATOM 0 HH11 ARG A 433 11.151 -4.182 -0.242 1.00 0.00 H new ATOM 0 HH12 ARG A 433 11.010 -5.943 -0.280 1.00 0.00 H new ATOM 0 HH21 ARG A 433 10.204 -6.228 3.140 1.00 0.00 H new ATOM 0 HH22 ARG A 433 10.476 -7.095 1.625 1.00 0.00 H new ATOM 1098 N ASP A 434 10.512 3.042 1.519 1.00 0.00 N ATOM 1099 CA ASP A 434 11.112 4.271 1.017 1.00 0.00 C ATOM 1100 C ASP A 434 10.954 5.402 2.028 1.00 0.00 C ATOM 1101 O ASP A 434 10.050 6.229 1.913 1.00 0.00 O ATOM 1102 CB ASP A 434 10.475 4.667 -0.316 1.00 0.00 C ATOM 1103 CG ASP A 434 11.446 5.390 -1.229 1.00 0.00 C ATOM 1104 OD1 ASP A 434 11.577 6.625 -1.098 1.00 0.00 O ATOM 1105 OD2 ASP A 434 12.077 4.720 -2.074 1.00 0.00 O ATOM 0 H ASP A 434 9.607 2.816 1.107 1.00 0.00 H new ATOM 0 HA ASP A 434 12.176 4.092 0.862 1.00 0.00 H new ATOM 0 HB2 ASP A 434 10.105 3.773 -0.818 1.00 0.00 H new ATOM 0 HB3 ASP A 434 9.613 5.307 -0.128 1.00 0.00 H new ATOM 1110 N LYS A 435 11.838 5.429 3.020 1.00 0.00 N ATOM 1111 CA LYS A 435 11.797 6.456 4.056 1.00 0.00 C ATOM 1112 C LYS A 435 11.884 7.852 3.448 1.00 0.00 C ATOM 1113 O LYS A 435 11.314 8.805 3.977 1.00 0.00 O ATOM 1114 CB LYS A 435 12.937 6.249 5.055 1.00 0.00 C ATOM 1115 CG LYS A 435 12.551 6.577 6.489 1.00 0.00 C ATOM 1116 CD LYS A 435 12.387 5.317 7.326 1.00 0.00 C ATOM 1117 CE LYS A 435 11.223 5.441 8.296 1.00 0.00 C ATOM 1118 NZ LYS A 435 11.139 4.272 9.215 1.00 0.00 N ATOM 0 H LYS A 435 12.592 4.751 3.129 1.00 0.00 H new ATOM 0 HA LYS A 435 10.844 6.368 4.579 1.00 0.00 H new ATOM 0 HB2 LYS A 435 13.271 5.213 5.004 1.00 0.00 H new ATOM 0 HB3 LYS A 435 13.783 6.871 4.763 1.00 0.00 H new ATOM 0 HG2 LYS A 435 13.314 7.214 6.935 1.00 0.00 H new ATOM 0 HG3 LYS A 435 11.619 7.143 6.496 1.00 0.00 H new ATOM 0 HD2 LYS A 435 12.226 4.461 6.670 1.00 0.00 H new ATOM 0 HD3 LYS A 435 13.306 5.125 7.881 1.00 0.00 H new ATOM 0 HE2 LYS A 435 11.333 6.355 8.880 1.00 0.00 H new ATOM 0 HE3 LYS A 435 10.292 5.530 7.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 435 10.333 4.395 9.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 435 11.009 3.402 8.660 1.00 0.00 H new ATOM 0 HZ3 LYS A 435 12.017 4.201 9.768 1.00 0.00 H new ATOM 1132 N LYS A 436 12.598 7.964 2.333 1.00 0.00 N ATOM 1133 CA LYS A 436 12.752 9.247 1.656 1.00 0.00 C ATOM 1134 C LYS A 436 11.429 9.692 1.051 1.00 0.00 C ATOM 1135 O LYS A 436 10.930 10.777 1.347 1.00 0.00 O ATOM 1136 CB LYS A 436 13.819 9.152 0.565 1.00 0.00 C ATOM 1137 CG LYS A 436 15.235 9.046 1.107 1.00 0.00 C ATOM 1138 CD LYS A 436 15.416 7.792 1.948 1.00 0.00 C ATOM 1139 CE LYS A 436 16.885 7.518 2.230 1.00 0.00 C ATOM 1140 NZ LYS A 436 17.677 7.395 0.975 1.00 0.00 N ATOM 0 H LYS A 436 13.077 7.186 1.880 1.00 0.00 H new ATOM 0 HA LYS A 436 13.068 9.986 2.393 1.00 0.00 H new ATOM 0 HB2 LYS A 436 13.612 8.283 -0.060 1.00 0.00 H new ATOM 0 HB3 LYS A 436 13.749 10.030 -0.077 1.00 0.00 H new ATOM 0 HG2 LYS A 436 15.943 9.035 0.279 1.00 0.00 H new ATOM 0 HG3 LYS A 436 15.462 9.926 1.709 1.00 0.00 H new ATOM 0 HD2 LYS A 436 14.878 7.903 2.890 1.00 0.00 H new ATOM 0 HD3 LYS A 436 14.978 6.939 1.430 1.00 0.00 H new ATOM 0 HE2 LYS A 436 17.294 8.323 2.840 1.00 0.00 H new ATOM 0 HE3 LYS A 436 16.978 6.600 2.810 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 18.539 6.844 1.161 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 17.107 6.912 0.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 17.938 8.343 0.635 1.00 0.00 H new ATOM 1154 N MET A 437 10.863 8.839 0.210 1.00 0.00 N ATOM 1155 CA MET A 437 9.591 9.131 -0.435 1.00 0.00 C ATOM 1156 C MET A 437 8.482 9.252 0.605 1.00 0.00 C ATOM 1157 O MET A 437 7.516 9.991 0.416 1.00 0.00 O ATOM 1158 CB MET A 437 9.248 8.038 -1.451 1.00 0.00 C ATOM 1159 CG MET A 437 7.855 8.171 -2.049 1.00 0.00 C ATOM 1160 SD MET A 437 7.841 7.967 -3.841 1.00 0.00 S ATOM 1161 CE MET A 437 7.892 9.676 -4.377 1.00 0.00 C ATOM 0 H MET A 437 11.266 7.936 -0.042 1.00 0.00 H new ATOM 0 HA MET A 437 9.679 10.082 -0.960 1.00 0.00 H new ATOM 0 HB2 MET A 437 9.982 8.060 -2.256 1.00 0.00 H new ATOM 0 HB3 MET A 437 9.334 7.065 -0.967 1.00 0.00 H new ATOM 0 HG2 MET A 437 7.199 7.427 -1.598 1.00 0.00 H new ATOM 0 HG3 MET A 437 7.448 9.150 -1.796 1.00 0.00 H new ATOM 0 HE1 MET A 437 7.889 9.716 -5.466 1.00 0.00 H new ATOM 0 HE2 MET A 437 7.020 10.204 -3.992 1.00 0.00 H new ATOM 0 HE3 MET A 437 8.799 10.149 -3.999 1.00 0.00 H new ATOM 1171 N LEU A 438 8.630 8.523 1.708 1.00 0.00 N ATOM 1172 CA LEU A 438 7.642 8.554 2.779 1.00 0.00 C ATOM 1173 C LEU A 438 7.749 9.853 3.569 1.00 0.00 C ATOM 1174 O LEU A 438 6.742 10.416 3.999 1.00 0.00 O ATOM 1175 CB LEU A 438 7.828 7.357 3.713 1.00 0.00 C ATOM 1176 CG LEU A 438 6.564 6.908 4.448 1.00 0.00 C ATOM 1177 CD1 LEU A 438 5.931 8.077 5.184 1.00 0.00 C ATOM 1178 CD2 LEU A 438 5.572 6.291 3.472 1.00 0.00 C ATOM 0 H LEU A 438 9.423 7.906 1.882 1.00 0.00 H new ATOM 0 HA LEU A 438 6.650 8.499 2.330 1.00 0.00 H new ATOM 0 HB2 LEU A 438 8.210 6.518 3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 438 8.590 7.606 4.451 1.00 0.00 H new ATOM 0 HG LEU A 438 6.842 6.151 5.181 1.00 0.00 H new ATOM 0 HD11 LEU A 438 5.033 7.738 5.701 1.00 0.00 H new ATOM 0 HD12 LEU A 438 6.639 8.476 5.910 1.00 0.00 H new ATOM 0 HD13 LEU A 438 5.666 8.856 4.469 1.00 0.00 H new ATOM 0 HD21 LEU A 438 4.678 5.977 4.011 1.00 0.00 H new ATOM 0 HD22 LEU A 438 5.299 7.027 2.716 1.00 0.00 H new ATOM 0 HD23 LEU A 438 6.027 5.426 2.989 1.00 0.00 H new ATOM 1190 N ASP A 439 8.977 10.327 3.749 1.00 0.00 N ATOM 1191 CA ASP A 439 9.218 11.565 4.480 1.00 0.00 C ATOM 1192 C ASP A 439 8.648 12.754 3.717 1.00 0.00 C ATOM 1193 O ASP A 439 8.112 13.689 4.311 1.00 0.00 O ATOM 1194 CB ASP A 439 10.717 11.762 4.712 1.00 0.00 C ATOM 1195 CG ASP A 439 11.005 12.732 5.841 1.00 0.00 C ATOM 1196 OD1 ASP A 439 10.133 13.578 6.134 1.00 0.00 O ATOM 1197 OD2 ASP A 439 12.102 12.645 6.433 1.00 0.00 O ATOM 0 H ASP A 439 9.820 9.873 3.399 1.00 0.00 H new ATOM 0 HA ASP A 439 8.718 11.497 5.446 1.00 0.00 H new ATOM 0 HB2 ASP A 439 11.176 10.800 4.938 1.00 0.00 H new ATOM 0 HB3 ASP A 439 11.179 12.129 3.795 1.00 0.00 H new ATOM 1202 N PHE A 440 8.766 12.706 2.394 1.00 0.00 N ATOM 1203 CA PHE A 440 8.260 13.775 1.542 1.00 0.00 C ATOM 1204 C PHE A 440 6.755 13.939 1.715 1.00 0.00 C ATOM 1205 O PHE A 440 6.240 15.057 1.730 1.00 0.00 O ATOM 1206 CB PHE A 440 8.585 13.480 0.078 1.00 0.00 C ATOM 1207 CG PHE A 440 8.662 14.709 -0.781 1.00 0.00 C ATOM 1208 CD1 PHE A 440 9.700 15.613 -0.627 1.00 0.00 C ATOM 1209 CD2 PHE A 440 7.695 14.959 -1.741 1.00 0.00 C ATOM 1210 CE1 PHE A 440 9.773 16.746 -1.416 1.00 0.00 C ATOM 1211 CE2 PHE A 440 7.763 16.090 -2.533 1.00 0.00 C ATOM 1212 CZ PHE A 440 8.804 16.984 -2.371 1.00 0.00 C ATOM 0 H PHE A 440 9.208 11.938 1.889 1.00 0.00 H new ATOM 0 HA PHE A 440 8.746 14.705 1.837 1.00 0.00 H new ATOM 0 HB2 PHE A 440 9.536 12.950 0.025 1.00 0.00 H new ATOM 0 HB3 PHE A 440 7.825 12.811 -0.326 1.00 0.00 H new ATOM 0 HD1 PHE A 440 10.461 15.431 0.118 1.00 0.00 H new ATOM 0 HD2 PHE A 440 6.880 14.263 -1.872 1.00 0.00 H new ATOM 0 HE1 PHE A 440 10.587 17.444 -1.286 1.00 0.00 H new ATOM 0 HE2 PHE A 440 7.003 16.275 -3.278 1.00 0.00 H new ATOM 0 HZ PHE A 440 8.860 17.867 -2.990 1.00 0.00 H new ATOM 1222 N TYR A 441 6.056 12.817 1.851 1.00 0.00 N ATOM 1223 CA TYR A 441 4.613 12.835 2.031 1.00 0.00 C ATOM 1224 C TYR A 441 4.270 13.125 3.479 1.00 0.00 C ATOM 1225 O TYR A 441 3.369 13.906 3.770 1.00 0.00 O ATOM 1226 CB TYR A 441 4.004 11.500 1.610 1.00 0.00 C ATOM 1227 CG TYR A 441 3.647 11.430 0.143 1.00 0.00 C ATOM 1228 CD1 TYR A 441 4.594 11.060 -0.804 1.00 0.00 C ATOM 1229 CD2 TYR A 441 2.364 11.730 -0.293 1.00 0.00 C ATOM 1230 CE1 TYR A 441 4.270 10.994 -2.146 1.00 0.00 C ATOM 1231 CE2 TYR A 441 2.032 11.667 -1.633 1.00 0.00 C ATOM 1232 CZ TYR A 441 2.989 11.298 -2.555 1.00 0.00 C ATOM 1233 OH TYR A 441 2.664 11.232 -3.891 1.00 0.00 O ATOM 0 H TYR A 441 6.468 11.884 1.840 1.00 0.00 H new ATOM 0 HA TYR A 441 4.198 13.622 1.402 1.00 0.00 H new ATOM 0 HB2 TYR A 441 4.708 10.701 1.842 1.00 0.00 H new ATOM 0 HB3 TYR A 441 3.107 11.317 2.202 1.00 0.00 H new ATOM 0 HD1 TYR A 441 5.598 10.820 -0.487 1.00 0.00 H new ATOM 0 HD2 TYR A 441 1.612 12.018 0.427 1.00 0.00 H new ATOM 0 HE1 TYR A 441 5.017 10.706 -2.871 1.00 0.00 H new ATOM 0 HE2 TYR A 441 1.029 11.905 -1.956 1.00 0.00 H new ATOM 0 HH TYR A 441 3.214 10.549 -4.328 1.00 0.00 H new ATOM 1243 N ALA A 442 5.005 12.501 4.388 1.00 0.00 N ATOM 1244 CA ALA A 442 4.781 12.710 5.808 1.00 0.00 C ATOM 1245 C ALA A 442 4.935 14.186 6.155 1.00 0.00 C ATOM 1246 O ALA A 442 4.276 14.695 7.062 1.00 0.00 O ATOM 1247 CB ALA A 442 5.733 11.857 6.633 1.00 0.00 C ATOM 0 H ALA A 442 5.758 11.849 4.168 1.00 0.00 H new ATOM 0 HA ALA A 442 3.762 12.405 6.048 1.00 0.00 H new ATOM 0 HB1 ALA A 442 5.549 12.028 7.694 1.00 0.00 H new ATOM 0 HB2 ALA A 442 5.571 10.804 6.402 1.00 0.00 H new ATOM 0 HB3 ALA A 442 6.762 12.127 6.395 1.00 0.00 H new ATOM 1253 N LYS A 443 5.796 14.873 5.408 1.00 0.00 N ATOM 1254 CA LYS A 443 6.020 16.297 5.617 1.00 0.00 C ATOM 1255 C LYS A 443 4.987 17.119 4.847 1.00 0.00 C ATOM 1256 O LYS A 443 4.995 18.349 4.894 1.00 0.00 O ATOM 1257 CB LYS A 443 7.434 16.685 5.181 1.00 0.00 C ATOM 1258 CG LYS A 443 8.412 16.817 6.337 1.00 0.00 C ATOM 1259 CD LYS A 443 8.248 18.145 7.057 1.00 0.00 C ATOM 1260 CE LYS A 443 7.191 18.060 8.146 1.00 0.00 C ATOM 1261 NZ LYS A 443 7.387 19.100 9.192 1.00 0.00 N ATOM 0 H LYS A 443 6.348 14.465 4.654 1.00 0.00 H new ATOM 0 HA LYS A 443 5.912 16.509 6.681 1.00 0.00 H new ATOM 0 HB2 LYS A 443 7.808 15.936 4.483 1.00 0.00 H new ATOM 0 HB3 LYS A 443 7.392 17.631 4.641 1.00 0.00 H new ATOM 0 HG2 LYS A 443 8.258 15.999 7.041 1.00 0.00 H new ATOM 0 HG3 LYS A 443 9.432 16.728 5.964 1.00 0.00 H new ATOM 0 HD2 LYS A 443 9.201 18.443 7.495 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.972 18.918 6.340 1.00 0.00 H new ATOM 0 HE2 LYS A 443 6.202 18.174 7.702 1.00 0.00 H new ATOM 0 HE3 LYS A 443 7.222 17.072 8.606 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 6.646 19.008 9.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 8.320 18.976 9.634 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 7.332 20.044 8.758 1.00 0.00 H new ATOM 1275 N GLN A 444 4.092 16.425 4.145 1.00 0.00 N ATOM 1276 CA GLN A 444 3.046 17.074 3.373 1.00 0.00 C ATOM 1277 C GLN A 444 1.684 16.766 3.977 1.00 0.00 C ATOM 1278 O GLN A 444 0.880 17.666 4.213 1.00 0.00 O ATOM 1279 CB GLN A 444 3.091 16.614 1.915 1.00 0.00 C ATOM 1280 CG GLN A 444 4.191 17.276 1.102 1.00 0.00 C ATOM 1281 CD GLN A 444 4.087 18.789 1.101 1.00 0.00 C ATOM 1282 OE1 GLN A 444 5.074 19.490 1.323 1.00 0.00 O ATOM 1283 NE2 GLN A 444 2.888 19.299 0.850 1.00 0.00 N ATOM 0 H GLN A 444 4.075 15.406 4.098 1.00 0.00 H new ATOM 0 HA GLN A 444 3.211 18.151 3.401 1.00 0.00 H new ATOM 0 HB2 GLN A 444 3.231 15.533 1.888 1.00 0.00 H new ATOM 0 HB3 GLN A 444 2.129 16.823 1.447 1.00 0.00 H new ATOM 0 HG2 GLN A 444 5.161 16.983 1.504 1.00 0.00 H new ATOM 0 HG3 GLN A 444 4.148 16.912 0.075 1.00 0.00 H new ATOM 0 HE21 GLN A 444 2.098 18.680 0.671 1.00 0.00 H new ATOM 0 HE22 GLN A 444 2.757 20.310 0.836 1.00 0.00 H new ATOM 1292 N ARG A 445 1.436 15.488 4.234 1.00 0.00 N ATOM 1293 CA ARG A 445 0.172 15.061 4.824 1.00 0.00 C ATOM 1294 C ARG A 445 0.018 15.619 6.232 1.00 0.00 C ATOM 1295 O ARG A 445 -1.026 16.166 6.587 1.00 0.00 O ATOM 1296 CB ARG A 445 0.084 13.534 4.860 1.00 0.00 C ATOM 1297 CG ARG A 445 -1.339 13.009 4.956 1.00 0.00 C ATOM 1298 CD ARG A 445 -1.444 11.853 5.938 1.00 0.00 C ATOM 1299 NE ARG A 445 -1.162 12.272 7.310 1.00 0.00 N ATOM 1300 CZ ARG A 445 -2.012 12.966 8.063 1.00 0.00 C ATOM 1301 NH1 ARG A 445 -3.195 13.327 7.582 1.00 0.00 N ATOM 1302 NH2 ARG A 445 -1.677 13.302 9.302 1.00 0.00 N ATOM 0 H ARG A 445 2.091 14.730 4.044 1.00 0.00 H new ATOM 0 HA ARG A 445 -0.636 15.448 4.203 1.00 0.00 H new ATOM 0 HB2 ARG A 445 0.552 13.130 3.962 1.00 0.00 H new ATOM 0 HB3 ARG A 445 0.657 13.165 5.711 1.00 0.00 H new ATOM 0 HG2 ARG A 445 -2.004 13.814 5.268 1.00 0.00 H new ATOM 0 HG3 ARG A 445 -1.674 12.682 3.972 1.00 0.00 H new ATOM 0 HD2 ARG A 445 -2.445 11.425 5.888 1.00 0.00 H new ATOM 0 HD3 ARG A 445 -0.747 11.067 5.648 1.00 0.00 H new ATOM 0 HE ARG A 445 -0.261 12.017 7.714 1.00 0.00 H new ATOM 0 HH11 ARG A 445 -3.458 13.073 6.630 1.00 0.00 H new ATOM 0 HH12 ARG A 445 -3.842 13.859 8.165 1.00 0.00 H new ATOM 0 HH21 ARG A 445 -0.769 13.028 9.677 1.00 0.00 H new ATOM 0 HH22 ARG A 445 -2.328 13.834 9.880 1.00 0.00 H new ATOM 1314 N ALA A 446 1.069 15.476 7.028 1.00 0.00 N ATOM 1315 CA ALA A 446 1.061 15.964 8.401 1.00 0.00 C ATOM 1316 C ALA A 446 1.237 17.479 8.445 1.00 0.00 C ATOM 1317 O ALA A 446 0.858 18.130 9.418 1.00 0.00 O ATOM 1318 CB ALA A 446 2.156 15.283 9.208 1.00 0.00 C ATOM 0 H ALA A 446 1.940 15.025 6.746 1.00 0.00 H new ATOM 0 HA ALA A 446 0.094 15.722 8.842 1.00 0.00 H new ATOM 0 HB1 ALA A 446 2.139 15.657 10.232 1.00 0.00 H new ATOM 0 HB2 ALA A 446 1.989 14.206 9.212 1.00 0.00 H new ATOM 0 HB3 ALA A 446 3.126 15.498 8.759 1.00 0.00 H new