USER MOD reduce.3.24.130724 H: found=0, std=0, add=600, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 599 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 344 LYS NZ :NH3+ -149:sc= 0.964 (180deg=-0.984!) USER MOD Set 1.2: A 414 SER OG : rot 120:sc= 0.0142 USER MOD Set 2.1: A 366 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 391 GLN : amide:sc= 1.63 X(o=2.9,f=2.9) USER MOD Set 2.3: A 393 SER OG : rot 93:sc= 1.29 USER MOD Set 3.1: A 353 ASN : amide:sc= 0.17 K(o=2,f=-0.97!) USER MOD Set 3.2: A 356 THR OG1 : rot 17:sc= 1.78 USER MOD Single : A 337 TYR OH : rot -136:sc= -1.01 USER MOD Single : A 338 SER OG : rot -160:sc= 1.14 USER MOD Single : A 339 SER OG : rot 180:sc= 0 USER MOD Single : A 350 LYS NZ :NH3+ 150:sc= 1.29 (180deg=0.452) USER MOD Single : A 359 HIS : no HE2:sc= 0.252 K(o=0.25,f=-0.91) USER MOD Single : A 367 GLN : amide:sc= 0.985 K(o=0.99,f=-0.031) USER MOD Single : A 370 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 373 SER OG : rot -69:sc= 1.25 USER MOD Single : A 375 THR OG1 : rot -32:sc= 0.288 USER MOD Single : A 376 HIS : no HE2:sc= 1.15 K(o=1.2,f=-3.9!) USER MOD Single : A 379 CYS SG : rot 30:sc= 0.586 USER MOD Single : A 387 SER OG : rot 180:sc= 0 USER MOD Single : A 395 THR OG1 : rot 155:sc= 1.22 USER MOD Single : A 407 GLN : amide:sc= 0.803 K(o=0.8,f=0) USER MOD ----------------------------------------------------------------- ATOM 24 N LEU A 336 3.497 2.630 -11.604 1.00 0.00 N ATOM 25 CA LEU A 336 3.274 1.990 -10.325 1.00 0.00 C ATOM 26 C LEU A 336 3.264 2.934 -9.138 1.00 0.00 C ATOM 27 O LEU A 336 3.688 4.088 -9.202 1.00 0.00 O ATOM 28 CB LEU A 336 4.299 0.871 -10.111 1.00 0.00 C ATOM 29 CG LEU A 336 4.287 -0.204 -11.200 1.00 0.00 C ATOM 30 CD1 LEU A 336 5.034 -1.408 -10.647 1.00 0.00 C ATOM 31 CD2 LEU A 336 2.889 -0.656 -11.628 1.00 0.00 C ATOM 0 HA LEU A 336 2.266 1.577 -10.373 1.00 0.00 H new ATOM 0 HB2 LEU A 336 5.295 1.310 -10.060 1.00 0.00 H new ATOM 0 HB3 LEU A 336 4.109 0.399 -9.147 1.00 0.00 H new ATOM 0 HG LEU A 336 4.750 0.225 -12.088 1.00 0.00 H new ATOM 0 HD11 LEU A 336 5.049 -2.201 -11.394 1.00 0.00 H new ATOM 0 HD12 LEU A 336 6.056 -1.121 -10.402 1.00 0.00 H new ATOM 0 HD13 LEU A 336 4.532 -1.766 -9.748 1.00 0.00 H new ATOM 0 HD21 LEU A 336 2.974 -1.418 -12.402 1.00 0.00 H new ATOM 0 HD22 LEU A 336 2.361 -1.069 -10.768 1.00 0.00 H new ATOM 0 HD23 LEU A 336 2.334 0.197 -12.018 1.00 0.00 H new ATOM 43 N TYR A 337 3.019 2.333 -7.982 1.00 0.00 N ATOM 44 CA TYR A 337 3.209 2.956 -6.695 1.00 0.00 C ATOM 45 C TYR A 337 4.698 3.162 -6.438 1.00 0.00 C ATOM 46 O TYR A 337 5.114 4.234 -5.992 1.00 0.00 O ATOM 47 CB TYR A 337 2.595 2.043 -5.642 1.00 0.00 C ATOM 48 CG TYR A 337 2.168 2.801 -4.420 1.00 0.00 C ATOM 49 CD1 TYR A 337 3.055 3.025 -3.355 1.00 0.00 C ATOM 50 CD2 TYR A 337 0.868 3.324 -4.386 1.00 0.00 C ATOM 51 CE1 TYR A 337 2.608 3.714 -2.215 1.00 0.00 C ATOM 52 CE2 TYR A 337 0.442 4.062 -3.279 1.00 0.00 C ATOM 53 CZ TYR A 337 1.288 4.206 -2.161 1.00 0.00 C ATOM 54 OH TYR A 337 0.812 4.801 -1.039 1.00 0.00 O ATOM 0 H TYR A 337 2.674 1.375 -7.920 1.00 0.00 H new ATOM 0 HA TYR A 337 2.728 3.933 -6.660 1.00 0.00 H new ATOM 0 HB2 TYR A 337 1.734 1.527 -6.067 1.00 0.00 H new ATOM 0 HB3 TYR A 337 3.318 1.278 -5.360 1.00 0.00 H new ATOM 0 HD1 TYR A 337 4.074 2.670 -3.412 1.00 0.00 H new ATOM 0 HD2 TYR A 337 0.196 3.157 -5.215 1.00 0.00 H new ATOM 0 HE1 TYR A 337 3.276 3.867 -1.380 1.00 0.00 H new ATOM 0 HE2 TYR A 337 -0.535 4.522 -3.280 1.00 0.00 H new ATOM 0 HH TYR A 337 -0.092 4.472 -0.853 1.00 0.00 H new ATOM 64 N SER A 338 5.492 2.142 -6.759 1.00 0.00 N ATOM 65 CA SER A 338 6.942 2.130 -6.795 1.00 0.00 C ATOM 66 C SER A 338 7.538 3.026 -7.894 1.00 0.00 C ATOM 67 O SER A 338 8.739 3.282 -7.869 1.00 0.00 O ATOM 68 CB SER A 338 7.349 0.653 -6.918 1.00 0.00 C ATOM 69 OG SER A 338 6.770 0.096 -8.085 1.00 0.00 O ATOM 0 H SER A 338 5.102 1.236 -7.020 1.00 0.00 H new ATOM 0 HA SER A 338 7.353 2.568 -5.885 1.00 0.00 H new ATOM 0 HB2 SER A 338 8.435 0.567 -6.962 1.00 0.00 H new ATOM 0 HB3 SER A 338 7.021 0.100 -6.038 1.00 0.00 H new ATOM 0 HG SER A 338 6.755 -0.881 -8.008 1.00 0.00 H new ATOM 75 N SER A 339 6.729 3.548 -8.829 1.00 0.00 N ATOM 76 CA SER A 339 7.215 4.475 -9.846 1.00 0.00 C ATOM 77 C SER A 339 7.702 5.766 -9.189 1.00 0.00 C ATOM 78 O SER A 339 8.658 6.352 -9.685 1.00 0.00 O ATOM 79 CB SER A 339 6.123 4.763 -10.887 1.00 0.00 C ATOM 80 OG SER A 339 6.623 5.396 -12.053 1.00 0.00 O ATOM 0 H SER A 339 5.733 3.339 -8.896 1.00 0.00 H new ATOM 0 HA SER A 339 8.055 4.015 -10.366 1.00 0.00 H new ATOM 0 HB2 SER A 339 5.640 3.827 -11.167 1.00 0.00 H new ATOM 0 HB3 SER A 339 5.357 5.395 -10.437 1.00 0.00 H new ATOM 0 HG SER A 339 5.887 5.554 -12.681 1.00 0.00 H new ATOM 86 N LEU A 340 7.009 6.262 -8.156 1.00 0.00 N ATOM 87 CA LEU A 340 7.502 7.246 -7.201 1.00 0.00 C ATOM 88 C LEU A 340 8.718 6.688 -6.442 1.00 0.00 C ATOM 89 O LEU A 340 8.508 5.869 -5.546 1.00 0.00 O ATOM 90 CB LEU A 340 6.351 7.649 -6.253 1.00 0.00 C ATOM 91 CG LEU A 340 6.056 9.150 -6.330 1.00 0.00 C ATOM 92 CD1 LEU A 340 4.714 9.460 -5.658 1.00 0.00 C ATOM 93 CD2 LEU A 340 7.170 9.974 -5.666 1.00 0.00 C ATOM 0 H LEU A 340 6.051 5.973 -7.960 1.00 0.00 H new ATOM 0 HA LEU A 340 7.840 8.142 -7.722 1.00 0.00 H new ATOM 0 HB2 LEU A 340 5.453 7.088 -6.511 1.00 0.00 H new ATOM 0 HB3 LEU A 340 6.611 7.381 -5.229 1.00 0.00 H new ATOM 0 HG LEU A 340 6.008 9.426 -7.383 1.00 0.00 H new ATOM 0 HD11 LEU A 340 4.515 10.530 -5.719 1.00 0.00 H new ATOM 0 HD12 LEU A 340 3.919 8.914 -6.165 1.00 0.00 H new ATOM 0 HD13 LEU A 340 4.753 9.157 -4.612 1.00 0.00 H new ATOM 0 HD21 LEU A 340 6.930 11.035 -5.738 1.00 0.00 H new ATOM 0 HD22 LEU A 340 7.255 9.692 -4.617 1.00 0.00 H new ATOM 0 HD23 LEU A 340 8.116 9.781 -6.172 1.00 0.00 H new ATOM 152 N LYS A 344 7.784 10.500 -0.752 1.00 0.00 N ATOM 153 CA LYS A 344 6.388 10.100 -0.614 1.00 0.00 C ATOM 154 C LYS A 344 6.267 8.666 -0.080 1.00 0.00 C ATOM 155 O LYS A 344 5.298 8.413 0.614 1.00 0.00 O ATOM 156 CB LYS A 344 5.512 10.425 -1.842 1.00 0.00 C ATOM 157 CG LYS A 344 4.010 10.624 -1.497 1.00 0.00 C ATOM 158 CD LYS A 344 3.669 11.961 -0.797 1.00 0.00 C ATOM 159 CE LYS A 344 2.223 11.987 -0.255 1.00 0.00 C ATOM 160 NZ LYS A 344 1.843 13.263 0.404 1.00 0.00 N ATOM 0 HA LYS A 344 5.948 10.736 0.154 1.00 0.00 H new ATOM 0 HB2 LYS A 344 5.890 11.329 -2.319 1.00 0.00 H new ATOM 0 HB3 LYS A 344 5.606 9.618 -2.569 1.00 0.00 H new ATOM 0 HG2 LYS A 344 3.430 10.555 -2.417 1.00 0.00 H new ATOM 0 HG3 LYS A 344 3.689 9.804 -0.855 1.00 0.00 H new ATOM 0 HD2 LYS A 344 4.366 12.126 0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 344 3.806 12.782 -1.501 1.00 0.00 H new ATOM 0 HE2 LYS A 344 1.535 11.797 -1.079 1.00 0.00 H new ATOM 0 HE3 LYS A 344 2.099 11.172 0.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 344 1.151 13.072 1.157 1.00 0.00 H new ATOM 0 HZ2 LYS A 344 2.689 13.707 0.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 344 1.423 13.905 -0.298 1.00 0.00 H new ATOM 174 N ARG A 345 7.099 7.668 -0.441 1.00 0.00 N ATOM 175 CA ARG A 345 6.995 6.366 0.242 1.00 0.00 C ATOM 176 C ARG A 345 7.213 6.460 1.762 1.00 0.00 C ATOM 177 O ARG A 345 6.501 5.778 2.489 1.00 0.00 O ATOM 178 CB ARG A 345 7.903 5.279 -0.361 1.00 0.00 C ATOM 179 CG ARG A 345 7.608 4.790 -1.793 1.00 0.00 C ATOM 180 CD ARG A 345 6.146 4.445 -2.093 1.00 0.00 C ATOM 181 NE ARG A 345 5.610 5.144 -3.274 1.00 0.00 N ATOM 182 CZ ARG A 345 4.666 6.091 -3.285 1.00 0.00 C ATOM 183 NH1 ARG A 345 4.396 6.819 -2.203 1.00 0.00 N ATOM 184 NH2 ARG A 345 3.983 6.294 -4.403 1.00 0.00 N ATOM 0 H ARG A 345 7.815 7.731 -1.164 1.00 0.00 H new ATOM 0 HA ARG A 345 5.963 6.059 0.071 1.00 0.00 H new ATOM 0 HB2 ARG A 345 8.927 5.653 -0.342 1.00 0.00 H new ATOM 0 HB3 ARG A 345 7.868 4.413 0.300 1.00 0.00 H new ATOM 0 HG2 ARG A 345 7.931 5.561 -2.493 1.00 0.00 H new ATOM 0 HG3 ARG A 345 8.217 3.907 -1.988 1.00 0.00 H new ATOM 0 HD2 ARG A 345 6.058 3.369 -2.246 1.00 0.00 H new ATOM 0 HD3 ARG A 345 5.536 4.694 -1.225 1.00 0.00 H new ATOM 0 HE ARG A 345 6.000 4.878 -4.178 1.00 0.00 H new ATOM 0 HH11 ARG A 345 4.915 6.660 -1.339 1.00 0.00 H new ATOM 0 HH12 ARG A 345 3.671 7.535 -2.238 1.00 0.00 H new ATOM 0 HH21 ARG A 345 4.182 5.733 -5.231 1.00 0.00 H new ATOM 0 HH22 ARG A 345 3.258 7.011 -4.435 1.00 0.00 H new ATOM 198 N GLU A 346 8.103 7.319 2.249 1.00 0.00 N ATOM 199 CA GLU A 346 8.295 7.558 3.686 1.00 0.00 C ATOM 200 C GLU A 346 7.030 8.181 4.258 1.00 0.00 C ATOM 201 O GLU A 346 6.484 7.744 5.268 1.00 0.00 O ATOM 202 CB GLU A 346 9.497 8.479 3.952 1.00 0.00 C ATOM 203 CG GLU A 346 10.737 8.123 3.129 1.00 0.00 C ATOM 204 CD GLU A 346 11.244 6.711 3.388 1.00 0.00 C ATOM 205 OE1 GLU A 346 11.620 6.412 4.540 1.00 0.00 O ATOM 206 OE2 GLU A 346 11.242 5.891 2.446 1.00 0.00 O ATOM 0 H GLU A 346 8.719 7.876 1.657 1.00 0.00 H new ATOM 0 HA GLU A 346 8.498 6.603 4.170 1.00 0.00 H new ATOM 0 HB2 GLU A 346 9.210 9.508 3.735 1.00 0.00 H new ATOM 0 HB3 GLU A 346 9.750 8.435 5.011 1.00 0.00 H new ATOM 0 HG2 GLU A 346 10.505 8.230 2.069 1.00 0.00 H new ATOM 0 HG3 GLU A 346 11.531 8.834 3.355 1.00 0.00 H new ATOM 213 N GLU A 347 6.533 9.197 3.563 1.00 0.00 N ATOM 214 CA GLU A 347 5.288 9.857 3.884 1.00 0.00 C ATOM 215 C GLU A 347 4.094 8.892 3.812 1.00 0.00 C ATOM 216 O GLU A 347 3.062 9.135 4.418 1.00 0.00 O ATOM 217 CB GLU A 347 5.114 11.047 2.935 1.00 0.00 C ATOM 218 CG GLU A 347 4.789 12.341 3.685 1.00 0.00 C ATOM 219 CD GLU A 347 3.773 13.123 2.876 1.00 0.00 C ATOM 220 OE1 GLU A 347 4.159 13.749 1.870 1.00 0.00 O ATOM 221 OE2 GLU A 347 2.570 12.971 3.169 1.00 0.00 O ATOM 0 H GLU A 347 6.999 9.588 2.745 1.00 0.00 H new ATOM 0 HA GLU A 347 5.322 10.214 4.913 1.00 0.00 H new ATOM 0 HB2 GLU A 347 6.027 11.184 2.356 1.00 0.00 H new ATOM 0 HB3 GLU A 347 4.316 10.830 2.225 1.00 0.00 H new ATOM 0 HG2 GLU A 347 4.393 12.116 4.675 1.00 0.00 H new ATOM 0 HG3 GLU A 347 5.693 12.932 3.831 1.00 0.00 H new ATOM 228 N VAL A 348 4.196 7.782 3.091 1.00 0.00 N ATOM 229 CA VAL A 348 3.178 6.749 3.060 1.00 0.00 C ATOM 230 C VAL A 348 3.295 5.832 4.269 1.00 0.00 C ATOM 231 O VAL A 348 2.262 5.360 4.720 1.00 0.00 O ATOM 232 CB VAL A 348 3.241 6.025 1.714 1.00 0.00 C ATOM 233 CG1 VAL A 348 2.597 4.642 1.709 1.00 0.00 C ATOM 234 CG2 VAL A 348 2.520 6.880 0.657 1.00 0.00 C ATOM 0 H VAL A 348 5.003 7.575 2.503 1.00 0.00 H new ATOM 0 HA VAL A 348 2.184 7.190 3.138 1.00 0.00 H new ATOM 0 HB VAL A 348 4.300 5.886 1.498 1.00 0.00 H new ATOM 0 HG11 VAL A 348 2.687 4.202 0.716 1.00 0.00 H new ATOM 0 HG12 VAL A 348 3.100 4.004 2.436 1.00 0.00 H new ATOM 0 HG13 VAL A 348 1.543 4.731 1.972 1.00 0.00 H new ATOM 0 HG21 VAL A 348 2.558 6.374 -0.308 1.00 0.00 H new ATOM 0 HG22 VAL A 348 1.480 7.022 0.951 1.00 0.00 H new ATOM 0 HG23 VAL A 348 3.010 7.850 0.578 1.00 0.00 H new ATOM 244 N GLU A 349 4.477 5.597 4.831 1.00 0.00 N ATOM 245 CA GLU A 349 4.545 4.971 6.159 1.00 0.00 C ATOM 246 C GLU A 349 3.846 5.846 7.213 1.00 0.00 C ATOM 247 O GLU A 349 3.195 5.323 8.118 1.00 0.00 O ATOM 248 CB GLU A 349 5.978 4.602 6.565 1.00 0.00 C ATOM 249 CG GLU A 349 6.621 3.663 5.532 1.00 0.00 C ATOM 250 CD GLU A 349 7.533 2.613 6.165 1.00 0.00 C ATOM 251 OE1 GLU A 349 8.476 3.000 6.894 1.00 0.00 O ATOM 252 OE2 GLU A 349 7.377 1.417 5.832 1.00 0.00 O ATOM 0 H GLU A 349 5.378 5.820 4.408 1.00 0.00 H new ATOM 0 HA GLU A 349 4.003 4.027 6.101 1.00 0.00 H new ATOM 0 HB2 GLU A 349 6.577 5.508 6.660 1.00 0.00 H new ATOM 0 HB3 GLU A 349 5.970 4.121 7.543 1.00 0.00 H new ATOM 0 HG2 GLU A 349 5.835 3.161 4.967 1.00 0.00 H new ATOM 0 HG3 GLU A 349 7.197 4.255 4.820 1.00 0.00 H new ATOM 259 N LYS A 350 3.869 7.176 7.041 1.00 0.00 N ATOM 260 CA LYS A 350 2.951 8.059 7.770 1.00 0.00 C ATOM 261 C LYS A 350 1.478 7.922 7.354 1.00 0.00 C ATOM 262 O LYS A 350 0.622 7.919 8.237 1.00 0.00 O ATOM 263 CB LYS A 350 3.485 9.498 7.552 1.00 0.00 C ATOM 264 CG LYS A 350 2.589 10.697 7.947 1.00 0.00 C ATOM 265 CD LYS A 350 2.523 11.739 6.793 1.00 0.00 C ATOM 266 CE LYS A 350 1.205 12.526 6.666 1.00 0.00 C ATOM 267 NZ LYS A 350 1.167 13.376 5.446 1.00 0.00 N ATOM 0 H LYS A 350 4.508 7.659 6.409 1.00 0.00 H new ATOM 0 HA LYS A 350 2.938 7.783 8.824 1.00 0.00 H new ATOM 0 HB2 LYS A 350 4.420 9.590 8.104 1.00 0.00 H new ATOM 0 HB3 LYS A 350 3.728 9.603 6.495 1.00 0.00 H new ATOM 0 HG2 LYS A 350 1.585 10.345 8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 350 2.981 11.169 8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 350 3.337 12.452 6.927 1.00 0.00 H new ATOM 0 HD3 LYS A 350 2.705 11.221 5.852 1.00 0.00 H new ATOM 0 HE2 LYS A 350 0.369 11.827 6.645 1.00 0.00 H new ATOM 0 HE3 LYS A 350 1.074 13.154 7.547 1.00 0.00 H new ATOM 0 HZ1 LYS A 350 0.184 13.472 5.121 1.00 0.00 H new ATOM 0 HZ2 LYS A 350 1.553 14.316 5.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 350 1.738 12.934 4.697 1.00 0.00 H new ATOM 281 N LEU A 351 1.147 7.811 6.066 1.00 0.00 N ATOM 282 CA LEU A 351 -0.251 7.802 5.624 1.00 0.00 C ATOM 283 C LEU A 351 -0.941 6.443 5.743 1.00 0.00 C ATOM 284 O LEU A 351 -1.940 6.326 6.454 1.00 0.00 O ATOM 285 CB LEU A 351 -0.394 8.354 4.209 1.00 0.00 C ATOM 286 CG LEU A 351 0.021 9.824 4.052 1.00 0.00 C ATOM 287 CD1 LEU A 351 0.516 10.047 2.620 1.00 0.00 C ATOM 288 CD2 LEU A 351 -1.149 10.740 4.428 1.00 0.00 C ATOM 0 H LEU A 351 1.827 7.726 5.310 1.00 0.00 H new ATOM 0 HA LEU A 351 -0.769 8.463 6.319 1.00 0.00 H new ATOM 0 HB2 LEU A 351 0.208 7.746 3.533 1.00 0.00 H new ATOM 0 HB3 LEU A 351 -1.432 8.248 3.895 1.00 0.00 H new ATOM 0 HG LEU A 351 0.839 10.071 4.729 1.00 0.00 H new ATOM 0 HD11 LEU A 351 0.814 11.088 2.496 1.00 0.00 H new ATOM 0 HD12 LEU A 351 1.371 9.399 2.426 1.00 0.00 H new ATOM 0 HD13 LEU A 351 -0.284 9.812 1.918 1.00 0.00 H new ATOM 0 HD21 LEU A 351 -0.847 11.781 4.314 1.00 0.00 H new ATOM 0 HD22 LEU A 351 -1.997 10.534 3.774 1.00 0.00 H new ATOM 0 HD23 LEU A 351 -1.436 10.557 5.463 1.00 0.00 H new ATOM 300 N LEU A 352 -0.435 5.425 5.029 1.00 0.00 N ATOM 301 CA LEU A 352 -0.816 4.004 5.058 1.00 0.00 C ATOM 302 C LEU A 352 -0.281 3.426 6.372 1.00 0.00 C ATOM 303 O LEU A 352 0.569 2.548 6.400 1.00 0.00 O ATOM 304 CB LEU A 352 -0.338 3.222 3.802 1.00 0.00 C ATOM 305 CG LEU A 352 -0.962 3.619 2.435 1.00 0.00 C ATOM 306 CD1 LEU A 352 -0.423 2.774 1.270 1.00 0.00 C ATOM 307 CD2 LEU A 352 -2.479 3.436 2.360 1.00 0.00 C ATOM 0 H LEU A 352 0.316 5.589 4.359 1.00 0.00 H new ATOM 0 HA LEU A 352 -1.901 3.903 5.022 1.00 0.00 H new ATOM 0 HB2 LEU A 352 0.743 3.336 3.725 1.00 0.00 H new ATOM 0 HB3 LEU A 352 -0.536 2.163 3.968 1.00 0.00 H new ATOM 0 HG LEU A 352 -0.690 4.671 2.353 1.00 0.00 H new ATOM 0 HD11 LEU A 352 -0.893 3.094 0.340 1.00 0.00 H new ATOM 0 HD12 LEU A 352 0.657 2.905 1.195 1.00 0.00 H new ATOM 0 HD13 LEU A 352 -0.650 1.723 1.448 1.00 0.00 H new ATOM 0 HD21 LEU A 352 -2.833 3.736 1.374 1.00 0.00 H new ATOM 0 HD22 LEU A 352 -2.728 2.389 2.532 1.00 0.00 H new ATOM 0 HD23 LEU A 352 -2.958 4.053 3.120 1.00 0.00 H new ATOM 319 N ASN A 353 -0.781 3.994 7.463 1.00 0.00 N ATOM 320 CA ASN A 353 -0.446 3.778 8.858 1.00 0.00 C ATOM 321 C ASN A 353 -0.584 2.313 9.286 1.00 0.00 C ATOM 322 O ASN A 353 -1.254 1.507 8.629 1.00 0.00 O ATOM 323 CB ASN A 353 -1.373 4.671 9.704 1.00 0.00 C ATOM 324 CG ASN A 353 -2.847 4.389 9.409 1.00 0.00 C ATOM 325 OD1 ASN A 353 -3.430 3.437 9.906 1.00 0.00 O ATOM 326 ND2 ASN A 353 -3.475 5.172 8.544 1.00 0.00 N ATOM 0 H ASN A 353 -1.515 4.697 7.376 1.00 0.00 H new ATOM 0 HA ASN A 353 0.602 4.036 9.009 1.00 0.00 H new ATOM 0 HB2 ASN A 353 -1.174 4.503 10.763 1.00 0.00 H new ATOM 0 HB3 ASN A 353 -1.154 5.719 9.501 1.00 0.00 H new ATOM 0 HD21 ASN A 353 -4.445 4.980 8.293 1.00 0.00 H new ATOM 0 HD22 ASN A 353 -2.989 5.967 8.129 1.00 0.00 H new ATOM 333 N GLY A 354 0.031 2.000 10.436 1.00 0.00 N ATOM 334 CA GLY A 354 0.113 0.684 11.064 1.00 0.00 C ATOM 335 C GLY A 354 -1.226 0.226 11.637 1.00 0.00 C ATOM 336 O GLY A 354 -1.372 0.093 12.846 1.00 0.00 O ATOM 0 H GLY A 354 0.515 2.711 10.984 1.00 0.00 H new ATOM 0 HA2 GLY A 354 0.459 -0.044 10.330 1.00 0.00 H new ATOM 0 HA3 GLY A 354 0.856 0.711 11.861 1.00 0.00 H new ATOM 340 N ASP A 355 -2.158 -0.052 10.735 1.00 0.00 N ATOM 341 CA ASP A 355 -3.555 -0.436 10.891 1.00 0.00 C ATOM 342 C ASP A 355 -4.196 -0.495 9.518 1.00 0.00 C ATOM 343 O ASP A 355 -4.489 -1.565 8.981 1.00 0.00 O ATOM 344 CB ASP A 355 -4.353 0.549 11.769 1.00 0.00 C ATOM 345 CG ASP A 355 -5.851 0.252 11.633 1.00 0.00 C ATOM 346 OD1 ASP A 355 -6.307 -0.766 12.189 1.00 0.00 O ATOM 347 OD2 ASP A 355 -6.491 0.994 10.841 1.00 0.00 O ATOM 0 H ASP A 355 -1.918 -0.007 9.745 1.00 0.00 H new ATOM 0 HA ASP A 355 -3.576 -1.406 11.389 1.00 0.00 H new ATOM 0 HB2 ASP A 355 -4.046 0.456 12.811 1.00 0.00 H new ATOM 0 HB3 ASP A 355 -4.145 1.575 11.465 1.00 0.00 H new ATOM 352 N THR A 356 -4.389 0.674 8.922 1.00 0.00 N ATOM 353 CA THR A 356 -5.201 0.787 7.736 1.00 0.00 C ATOM 354 C THR A 356 -4.486 0.126 6.563 1.00 0.00 C ATOM 355 O THR A 356 -5.162 -0.375 5.664 1.00 0.00 O ATOM 356 CB THR A 356 -5.534 2.265 7.548 1.00 0.00 C ATOM 357 OG1 THR A 356 -6.439 2.663 8.575 1.00 0.00 O ATOM 358 CG2 THR A 356 -6.154 2.564 6.181 1.00 0.00 C ATOM 0 H THR A 356 -3.990 1.554 9.248 1.00 0.00 H new ATOM 0 HA THR A 356 -6.149 0.256 7.818 1.00 0.00 H new ATOM 0 HB THR A 356 -4.601 2.825 7.604 1.00 0.00 H new ATOM 0 HG1 THR A 356 -6.426 2.001 9.297 1.00 0.00 H new ATOM 0 HG21 THR A 356 -6.370 3.630 6.105 1.00 0.00 H new ATOM 0 HG22 THR A 356 -5.456 2.278 5.394 1.00 0.00 H new ATOM 0 HG23 THR A 356 -7.079 1.998 6.069 1.00 0.00 H new ATOM 366 N TRP A 357 -3.146 0.098 6.558 1.00 0.00 N ATOM 367 CA TRP A 357 -2.418 -0.662 5.561 1.00 0.00 C ATOM 368 C TRP A 357 -2.957 -2.116 5.522 1.00 0.00 C ATOM 369 O TRP A 357 -3.280 -2.570 4.438 1.00 0.00 O ATOM 370 CB TRP A 357 -0.893 -0.564 5.747 1.00 0.00 C ATOM 371 CG TRP A 357 -0.322 -1.649 6.602 1.00 0.00 C ATOM 372 CD1 TRP A 357 -0.177 -1.632 7.942 1.00 0.00 C ATOM 373 CD2 TRP A 357 -0.030 -3.014 6.183 1.00 0.00 C ATOM 374 NE1 TRP A 357 0.148 -2.899 8.390 1.00 0.00 N ATOM 375 CE2 TRP A 357 0.243 -3.795 7.338 1.00 0.00 C ATOM 376 CE3 TRP A 357 -0.109 -3.698 4.951 1.00 0.00 C ATOM 377 CZ2 TRP A 357 0.467 -5.176 7.226 1.00 0.00 C ATOM 378 CZ3 TRP A 357 0.171 -5.071 4.840 1.00 0.00 C ATOM 379 CH2 TRP A 357 0.464 -5.807 5.989 1.00 0.00 C ATOM 0 H TRP A 357 -2.559 0.591 7.231 1.00 0.00 H new ATOM 0 HA TRP A 357 -2.595 -0.224 4.579 1.00 0.00 H new ATOM 0 HB2 TRP A 357 -0.414 -0.594 4.769 1.00 0.00 H new ATOM 0 HB3 TRP A 357 -0.651 0.402 6.191 1.00 0.00 H new ATOM 0 HD1 TRP A 357 -0.296 -0.761 8.570 1.00 0.00 H new ATOM 0 HE1 TRP A 357 0.298 -3.143 9.369 1.00 0.00 H new ATOM 0 HE3 TRP A 357 -0.394 -3.149 4.065 1.00 0.00 H new ATOM 0 HZ2 TRP A 357 0.645 -5.758 8.118 1.00 0.00 H new ATOM 0 HZ3 TRP A 357 0.159 -5.552 3.873 1.00 0.00 H new ATOM 0 HH2 TRP A 357 0.687 -6.861 5.917 1.00 0.00 H new ATOM 390 N ARG A 358 -3.012 -2.881 6.637 1.00 0.00 N ATOM 391 CA ARG A 358 -3.634 -4.222 6.708 1.00 0.00 C ATOM 392 C ARG A 358 -4.956 -4.313 5.964 1.00 0.00 C ATOM 393 O ARG A 358 -5.162 -5.241 5.186 1.00 0.00 O ATOM 394 CB ARG A 358 -3.764 -4.823 8.127 1.00 0.00 C ATOM 395 CG ARG A 358 -2.477 -5.513 8.614 1.00 0.00 C ATOM 396 CD ARG A 358 -2.695 -6.596 9.686 1.00 0.00 C ATOM 397 NE ARG A 358 -3.284 -7.828 9.117 1.00 0.00 N ATOM 398 CZ ARG A 358 -2.919 -9.103 9.349 1.00 0.00 C ATOM 399 NH1 ARG A 358 -1.960 -9.408 10.216 1.00 0.00 N ATOM 400 NH2 ARG A 358 -3.534 -10.080 8.695 1.00 0.00 N ATOM 0 H ARG A 358 -2.618 -2.577 7.528 1.00 0.00 H new ATOM 0 HA ARG A 358 -2.906 -4.846 6.190 1.00 0.00 H new ATOM 0 HB2 ARG A 358 -4.031 -4.031 8.827 1.00 0.00 H new ATOM 0 HB3 ARG A 358 -4.581 -5.545 8.135 1.00 0.00 H new ATOM 0 HG2 ARG A 358 -1.976 -5.964 7.757 1.00 0.00 H new ATOM 0 HG3 ARG A 358 -1.803 -4.755 9.014 1.00 0.00 H new ATOM 0 HD2 ARG A 358 -1.743 -6.835 10.159 1.00 0.00 H new ATOM 0 HD3 ARG A 358 -3.350 -6.208 10.466 1.00 0.00 H new ATOM 0 HE ARG A 358 -4.061 -7.695 8.470 1.00 0.00 H new ATOM 0 HH11 ARG A 358 -1.479 -8.667 10.726 1.00 0.00 H new ATOM 0 HH12 ARG A 358 -1.704 -10.383 10.372 1.00 0.00 H new ATOM 0 HH21 ARG A 358 -4.273 -9.860 8.027 1.00 0.00 H new ATOM 0 HH22 ARG A 358 -3.268 -11.051 8.860 1.00 0.00 H new ATOM 414 N HIS A 359 -5.873 -3.402 6.282 1.00 0.00 N ATOM 415 CA HIS A 359 -7.208 -3.382 5.702 1.00 0.00 C ATOM 416 C HIS A 359 -7.101 -3.238 4.183 1.00 0.00 C ATOM 417 O HIS A 359 -7.677 -4.024 3.433 1.00 0.00 O ATOM 418 CB HIS A 359 -8.024 -2.249 6.343 1.00 0.00 C ATOM 419 CG HIS A 359 -8.300 -2.469 7.814 1.00 0.00 C ATOM 420 ND1 HIS A 359 -7.515 -2.088 8.889 1.00 0.00 N ATOM 421 CD2 HIS A 359 -9.413 -3.087 8.318 1.00 0.00 C ATOM 422 CE1 HIS A 359 -8.165 -2.449 10.010 1.00 0.00 C ATOM 423 NE2 HIS A 359 -9.317 -3.074 9.709 1.00 0.00 N ATOM 0 H HIS A 359 -5.707 -2.653 6.954 1.00 0.00 H new ATOM 0 HA HIS A 359 -7.729 -4.317 5.905 1.00 0.00 H new ATOM 0 HB2 HIS A 359 -7.488 -1.308 6.218 1.00 0.00 H new ATOM 0 HB3 HIS A 359 -8.972 -2.149 5.814 1.00 0.00 H new ATOM 0 HD1 HIS A 359 -6.610 -1.620 8.840 1.00 0.00 H new ATOM 0 HD2 HIS A 359 -10.222 -3.510 7.741 1.00 0.00 H new ATOM 0 HE1 HIS A 359 -7.811 -2.263 11.013 1.00 0.00 H new ATOM 431 N LEU A 360 -6.308 -2.265 3.731 1.00 0.00 N ATOM 432 CA LEU A 360 -5.991 -2.059 2.330 1.00 0.00 C ATOM 433 C LEU A 360 -5.330 -3.290 1.701 1.00 0.00 C ATOM 434 O LEU A 360 -5.617 -3.592 0.552 1.00 0.00 O ATOM 435 CB LEU A 360 -5.091 -0.820 2.252 1.00 0.00 C ATOM 436 CG LEU A 360 -4.441 -0.621 0.882 1.00 0.00 C ATOM 437 CD1 LEU A 360 -5.485 -0.237 -0.162 1.00 0.00 C ATOM 438 CD2 LEU A 360 -3.390 0.470 0.996 1.00 0.00 C ATOM 0 H LEU A 360 -5.862 -1.587 4.348 1.00 0.00 H new ATOM 0 HA LEU A 360 -6.904 -1.902 1.755 1.00 0.00 H new ATOM 0 HB2 LEU A 360 -5.681 0.063 2.497 1.00 0.00 H new ATOM 0 HB3 LEU A 360 -4.309 -0.901 3.007 1.00 0.00 H new ATOM 0 HG LEU A 360 -3.977 -1.554 0.564 1.00 0.00 H new ATOM 0 HD11 LEU A 360 -5.000 -0.101 -1.129 1.00 0.00 H new ATOM 0 HD12 LEU A 360 -6.231 -1.028 -0.239 1.00 0.00 H new ATOM 0 HD13 LEU A 360 -5.971 0.692 0.134 1.00 0.00 H new ATOM 0 HD21 LEU A 360 -2.918 0.623 0.026 1.00 0.00 H new ATOM 0 HD22 LEU A 360 -3.862 1.398 1.320 1.00 0.00 H new ATOM 0 HD23 LEU A 360 -2.635 0.173 1.724 1.00 0.00 H new ATOM 450 N ALA A 361 -4.435 -3.971 2.413 1.00 0.00 N ATOM 451 CA ALA A 361 -3.626 -5.086 1.942 1.00 0.00 C ATOM 452 C ALA A 361 -4.511 -6.146 1.265 1.00 0.00 C ATOM 453 O ALA A 361 -4.194 -6.579 0.160 1.00 0.00 O ATOM 454 CB ALA A 361 -2.697 -5.585 3.069 1.00 0.00 C ATOM 0 H ALA A 361 -4.246 -3.744 3.389 1.00 0.00 H new ATOM 0 HA ALA A 361 -2.945 -4.769 1.152 1.00 0.00 H new ATOM 0 HB1 ALA A 361 -2.097 -6.419 2.704 1.00 0.00 H new ATOM 0 HB2 ALA A 361 -2.039 -4.775 3.383 1.00 0.00 H new ATOM 0 HB3 ALA A 361 -3.298 -5.914 3.917 1.00 0.00 H new ATOM 460 N GLY A 362 -5.617 -6.548 1.900 1.00 0.00 N ATOM 461 CA GLY A 362 -6.581 -7.473 1.309 1.00 0.00 C ATOM 462 C GLY A 362 -7.288 -6.878 0.095 1.00 0.00 C ATOM 463 O GLY A 362 -7.393 -7.527 -0.947 1.00 0.00 O ATOM 0 H GLY A 362 -5.866 -6.239 2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 362 -6.069 -8.389 1.015 1.00 0.00 H new ATOM 0 HA3 GLY A 362 -7.322 -7.749 2.059 1.00 0.00 H new ATOM 467 N GLU A 363 -7.733 -5.626 0.205 1.00 0.00 N ATOM 468 CA GLU A 363 -8.289 -4.859 -0.903 1.00 0.00 C ATOM 469 C GLU A 363 -7.339 -4.709 -2.103 1.00 0.00 C ATOM 470 O GLU A 363 -7.813 -4.431 -3.205 1.00 0.00 O ATOM 471 CB GLU A 363 -8.772 -3.491 -0.388 1.00 0.00 C ATOM 472 CG GLU A 363 -10.287 -3.397 -0.189 1.00 0.00 C ATOM 473 CD GLU A 363 -10.951 -4.377 0.787 1.00 0.00 C ATOM 474 OE1 GLU A 363 -11.185 -5.537 0.386 1.00 0.00 O ATOM 475 OE2 GLU A 363 -11.556 -3.912 1.780 1.00 0.00 O ATOM 0 H GLU A 363 -7.715 -5.110 1.084 1.00 0.00 H new ATOM 0 HA GLU A 363 -9.135 -5.427 -1.291 1.00 0.00 H new ATOM 0 HB2 GLU A 363 -8.278 -3.277 0.560 1.00 0.00 H new ATOM 0 HB3 GLU A 363 -8.460 -2.719 -1.092 1.00 0.00 H new ATOM 0 HG2 GLU A 363 -10.517 -2.386 0.146 1.00 0.00 H new ATOM 0 HG3 GLU A 363 -10.760 -3.525 -1.163 1.00 0.00 H new ATOM 482 N LEU A 364 -6.028 -4.931 -1.945 1.00 0.00 N ATOM 483 CA LEU A 364 -5.065 -4.913 -3.049 1.00 0.00 C ATOM 484 C LEU A 364 -4.933 -6.294 -3.707 1.00 0.00 C ATOM 485 O LEU A 364 -3.929 -6.569 -4.367 1.00 0.00 O ATOM 486 CB LEU A 364 -3.698 -4.446 -2.509 1.00 0.00 C ATOM 487 CG LEU A 364 -3.653 -2.969 -2.107 1.00 0.00 C ATOM 488 CD1 LEU A 364 -2.363 -2.659 -1.347 1.00 0.00 C ATOM 489 CD2 LEU A 364 -3.698 -2.028 -3.304 1.00 0.00 C ATOM 0 H LEU A 364 -5.604 -5.130 -1.039 1.00 0.00 H new ATOM 0 HA LEU A 364 -5.422 -4.223 -3.814 1.00 0.00 H new ATOM 0 HB2 LEU A 364 -3.435 -5.055 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 364 -2.938 -4.627 -3.269 1.00 0.00 H new ATOM 0 HG LEU A 364 -4.535 -2.807 -1.487 1.00 0.00 H new ATOM 0 HD11 LEU A 364 -2.349 -1.605 -1.069 1.00 0.00 H new ATOM 0 HD12 LEU A 364 -2.315 -3.272 -0.447 1.00 0.00 H new ATOM 0 HD13 LEU A 364 -1.505 -2.879 -1.982 1.00 0.00 H new ATOM 0 HD21 LEU A 364 -3.663 -0.995 -2.957 1.00 0.00 H new ATOM 0 HD22 LEU A 364 -2.843 -2.222 -3.952 1.00 0.00 H new ATOM 0 HD23 LEU A 364 -4.620 -2.192 -3.862 1.00 0.00 H new ATOM 501 N GLY A 365 -5.994 -7.104 -3.654 1.00 0.00 N ATOM 502 CA GLY A 365 -6.087 -8.435 -4.238 1.00 0.00 C ATOM 503 C GLY A 365 -4.942 -9.375 -3.872 1.00 0.00 C ATOM 504 O GLY A 365 -4.634 -10.270 -4.657 1.00 0.00 O ATOM 0 H GLY A 365 -6.853 -6.830 -3.177 1.00 0.00 H new ATOM 0 HA2 GLY A 365 -7.026 -8.890 -3.924 1.00 0.00 H new ATOM 0 HA3 GLY A 365 -6.127 -8.339 -5.323 1.00 0.00 H new ATOM 508 N TYR A 366 -4.321 -9.208 -2.702 1.00 0.00 N ATOM 509 CA TYR A 366 -3.223 -10.044 -2.234 1.00 0.00 C ATOM 510 C TYR A 366 -3.769 -10.874 -1.077 1.00 0.00 C ATOM 511 O TYR A 366 -4.289 -10.321 -0.108 1.00 0.00 O ATOM 512 CB TYR A 366 -2.006 -9.177 -1.864 1.00 0.00 C ATOM 513 CG TYR A 366 -1.002 -8.954 -3.002 1.00 0.00 C ATOM 514 CD1 TYR A 366 -1.429 -8.761 -4.331 1.00 0.00 C ATOM 515 CD2 TYR A 366 0.377 -8.987 -2.715 1.00 0.00 C ATOM 516 CE1 TYR A 366 -0.497 -8.634 -5.371 1.00 0.00 C ATOM 517 CE2 TYR A 366 1.320 -8.834 -3.746 1.00 0.00 C ATOM 518 CZ TYR A 366 0.882 -8.665 -5.076 1.00 0.00 C ATOM 519 OH TYR A 366 1.797 -8.507 -6.068 1.00 0.00 O ATOM 0 H TYR A 366 -4.576 -8.472 -2.043 1.00 0.00 H new ATOM 0 HA TYR A 366 -2.857 -10.720 -3.007 1.00 0.00 H new ATOM 0 HB2 TYR A 366 -2.361 -8.207 -1.517 1.00 0.00 H new ATOM 0 HB3 TYR A 366 -1.487 -9.644 -1.027 1.00 0.00 H new ATOM 0 HD1 TYR A 366 -2.485 -8.710 -4.551 1.00 0.00 H new ATOM 0 HD2 TYR A 366 0.711 -9.131 -1.698 1.00 0.00 H new ATOM 0 HE1 TYR A 366 -0.833 -8.513 -6.390 1.00 0.00 H new ATOM 0 HE2 TYR A 366 2.376 -8.846 -3.521 1.00 0.00 H new ATOM 0 HH TYR A 366 2.700 -8.554 -5.690 1.00 0.00 H new ATOM 529 N GLN A 367 -3.756 -12.202 -1.243 1.00 0.00 N ATOM 530 CA GLN A 367 -4.291 -13.155 -0.270 1.00 0.00 C ATOM 531 C GLN A 367 -3.726 -12.905 1.144 1.00 0.00 C ATOM 532 O GLN A 367 -2.613 -12.378 1.272 1.00 0.00 O ATOM 533 CB GLN A 367 -4.003 -14.585 -0.774 1.00 0.00 C ATOM 534 CG GLN A 367 -4.832 -14.926 -2.027 1.00 0.00 C ATOM 535 CD GLN A 367 -4.627 -16.334 -2.603 1.00 0.00 C ATOM 536 OE1 GLN A 367 -5.088 -16.611 -3.705 1.00 0.00 O ATOM 537 NE2 GLN A 367 -3.981 -17.263 -1.920 1.00 0.00 N ATOM 0 H GLN A 367 -3.366 -12.650 -2.072 1.00 0.00 H new ATOM 0 HA GLN A 367 -5.369 -13.022 -0.182 1.00 0.00 H new ATOM 0 HB2 GLN A 367 -2.942 -14.683 -1.002 1.00 0.00 H new ATOM 0 HB3 GLN A 367 -4.227 -15.301 0.016 1.00 0.00 H new ATOM 0 HG2 GLN A 367 -5.888 -14.803 -1.785 1.00 0.00 H new ATOM 0 HG3 GLN A 367 -4.597 -14.199 -2.804 1.00 0.00 H new ATOM 0 HE21 GLN A 367 -3.593 -17.044 -1.002 1.00 0.00 H new ATOM 0 HE22 GLN A 367 -3.870 -18.199 -2.311 1.00 0.00 H new ATOM 546 N PRO A 368 -4.412 -13.364 2.211 1.00 0.00 N ATOM 547 CA PRO A 368 -4.041 -13.018 3.579 1.00 0.00 C ATOM 548 C PRO A 368 -2.694 -13.586 4.017 1.00 0.00 C ATOM 549 O PRO A 368 -2.086 -13.021 4.923 1.00 0.00 O ATOM 550 CB PRO A 368 -5.197 -13.469 4.478 1.00 0.00 C ATOM 551 CG PRO A 368 -5.939 -14.504 3.638 1.00 0.00 C ATOM 552 CD PRO A 368 -5.706 -14.031 2.204 1.00 0.00 C ATOM 0 HA PRO A 368 -3.891 -11.941 3.655 1.00 0.00 H new ATOM 0 HB2 PRO A 368 -4.832 -13.900 5.411 1.00 0.00 H new ATOM 0 HB3 PRO A 368 -5.844 -12.633 4.744 1.00 0.00 H new ATOM 0 HG2 PRO A 368 -5.546 -15.508 3.799 1.00 0.00 H new ATOM 0 HG3 PRO A 368 -7.001 -14.534 3.883 1.00 0.00 H new ATOM 0 HD2 PRO A 368 -5.709 -14.871 1.510 1.00 0.00 H new ATOM 0 HD3 PRO A 368 -6.495 -13.350 1.884 1.00 0.00 H new ATOM 560 N GLU A 369 -2.182 -14.615 3.342 1.00 0.00 N ATOM 561 CA GLU A 369 -0.864 -15.179 3.599 1.00 0.00 C ATOM 562 C GLU A 369 0.206 -14.096 3.418 1.00 0.00 C ATOM 563 O GLU A 369 1.120 -13.994 4.234 1.00 0.00 O ATOM 564 CB GLU A 369 -0.565 -16.362 2.656 1.00 0.00 C ATOM 565 CG GLU A 369 -1.618 -17.484 2.639 1.00 0.00 C ATOM 566 CD GLU A 369 -2.785 -17.162 1.698 1.00 0.00 C ATOM 567 OE1 GLU A 369 -2.674 -17.445 0.487 1.00 0.00 O ATOM 568 OE2 GLU A 369 -3.780 -16.572 2.173 1.00 0.00 O ATOM 0 H GLU A 369 -2.683 -15.086 2.589 1.00 0.00 H new ATOM 0 HA GLU A 369 -0.849 -15.549 4.624 1.00 0.00 H new ATOM 0 HB2 GLU A 369 -0.455 -15.976 1.642 1.00 0.00 H new ATOM 0 HB3 GLU A 369 0.395 -16.794 2.938 1.00 0.00 H new ATOM 0 HG2 GLU A 369 -1.148 -18.417 2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 369 -1.999 -17.639 3.649 1.00 0.00 H new ATOM 575 N HIS A 370 0.060 -13.242 2.397 1.00 0.00 N ATOM 576 CA HIS A 370 0.972 -12.128 2.178 1.00 0.00 C ATOM 577 C HIS A 370 0.790 -11.097 3.283 1.00 0.00 C ATOM 578 O HIS A 370 1.770 -10.596 3.817 1.00 0.00 O ATOM 579 CB HIS A 370 0.710 -11.458 0.824 1.00 0.00 C ATOM 580 CG HIS A 370 0.967 -12.348 -0.360 1.00 0.00 C ATOM 581 ND1 HIS A 370 2.204 -12.658 -0.880 1.00 0.00 N ATOM 582 CD2 HIS A 370 0.019 -12.975 -1.121 1.00 0.00 C ATOM 583 CE1 HIS A 370 1.999 -13.457 -1.942 1.00 0.00 C ATOM 584 NE2 HIS A 370 0.687 -13.672 -2.131 1.00 0.00 N ATOM 0 H HIS A 370 -0.689 -13.308 1.708 1.00 0.00 H new ATOM 0 HA HIS A 370 1.991 -12.516 2.186 1.00 0.00 H new ATOM 0 HB2 HIS A 370 -0.326 -11.119 0.793 1.00 0.00 H new ATOM 0 HB3 HIS A 370 1.338 -10.571 0.742 1.00 0.00 H new ATOM 0 HD2 HIS A 370 -1.050 -12.938 -0.969 1.00 0.00 H new ATOM 0 HE1 HIS A 370 2.783 -13.870 -2.559 1.00 0.00 H new ATOM 0 HE2 HIS A 370 0.261 -14.234 -2.868 1.00 0.00 H new ATOM 592 N ILE A 371 -0.457 -10.767 3.627 1.00 0.00 N ATOM 593 CA ILE A 371 -0.766 -9.720 4.594 1.00 0.00 C ATOM 594 C ILE A 371 -0.135 -10.072 5.939 1.00 0.00 C ATOM 595 O ILE A 371 0.467 -9.209 6.581 1.00 0.00 O ATOM 596 CB ILE A 371 -2.289 -9.494 4.718 1.00 0.00 C ATOM 597 CG1 ILE A 371 -2.945 -9.330 3.329 1.00 0.00 C ATOM 598 CG2 ILE A 371 -2.544 -8.261 5.609 1.00 0.00 C ATOM 599 CD1 ILE A 371 -4.468 -9.243 3.390 1.00 0.00 C ATOM 0 H ILE A 371 -1.283 -11.223 3.239 1.00 0.00 H new ATOM 0 HA ILE A 371 -0.343 -8.779 4.244 1.00 0.00 H new ATOM 0 HB ILE A 371 -2.745 -10.369 5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 371 -2.555 -8.430 2.854 1.00 0.00 H new ATOM 0 HG13 ILE A 371 -2.661 -10.172 2.698 1.00 0.00 H new ATOM 0 HG21 ILE A 371 -3.617 -8.095 5.702 1.00 0.00 H new ATOM 0 HG22 ILE A 371 -2.117 -8.432 6.597 1.00 0.00 H new ATOM 0 HG23 ILE A 371 -2.078 -7.384 5.159 1.00 0.00 H new ATOM 0 HD11 ILE A 371 -4.867 -9.129 2.382 1.00 0.00 H new ATOM 0 HD12 ILE A 371 -4.867 -10.154 3.837 1.00 0.00 H new ATOM 0 HD13 ILE A 371 -4.759 -8.384 3.995 1.00 0.00 H new ATOM 611 N ASP A 372 -0.283 -11.319 6.384 1.00 0.00 N ATOM 612 CA ASP A 372 0.327 -11.727 7.634 1.00 0.00 C ATOM 613 C ASP A 372 1.841 -11.818 7.473 1.00 0.00 C ATOM 614 O ASP A 372 2.549 -11.373 8.377 1.00 0.00 O ATOM 615 CB ASP A 372 -0.326 -12.983 8.228 1.00 0.00 C ATOM 616 CG ASP A 372 -1.321 -12.540 9.305 1.00 0.00 C ATOM 617 OD1 ASP A 372 -0.889 -11.949 10.321 1.00 0.00 O ATOM 618 OD2 ASP A 372 -2.546 -12.591 9.057 1.00 0.00 O ATOM 0 H ASP A 372 -0.811 -12.047 5.903 1.00 0.00 H new ATOM 0 HA ASP A 372 0.138 -10.958 8.383 1.00 0.00 H new ATOM 0 HB2 ASP A 372 -0.836 -13.551 7.450 1.00 0.00 H new ATOM 0 HB3 ASP A 372 0.432 -13.639 8.657 1.00 0.00 H new ATOM 623 N SER A 373 2.374 -12.286 6.332 1.00 0.00 N ATOM 624 CA SER A 373 3.829 -12.316 6.170 1.00 0.00 C ATOM 625 C SER A 373 4.434 -10.918 6.029 1.00 0.00 C ATOM 626 O SER A 373 5.567 -10.704 6.448 1.00 0.00 O ATOM 627 CB SER A 373 4.169 -13.168 4.935 1.00 0.00 C ATOM 628 OG SER A 373 5.550 -13.457 4.824 1.00 0.00 O ATOM 0 H SER A 373 1.839 -12.636 5.537 1.00 0.00 H new ATOM 0 HA SER A 373 4.262 -12.753 7.070 1.00 0.00 H new ATOM 0 HB2 SER A 373 3.611 -14.103 4.981 1.00 0.00 H new ATOM 0 HB3 SER A 373 3.840 -12.644 4.038 1.00 0.00 H new ATOM 0 HG SER A 373 6.039 -12.636 4.606 1.00 0.00 H new ATOM 634 N PHE A 374 3.617 -9.896 5.819 1.00 0.00 N ATOM 635 CA PHE A 374 4.115 -8.544 5.597 1.00 0.00 C ATOM 636 C PHE A 374 4.265 -7.875 6.955 1.00 0.00 C ATOM 637 O PHE A 374 5.171 -7.068 7.134 1.00 0.00 O ATOM 638 CB PHE A 374 3.130 -7.717 4.747 1.00 0.00 C ATOM 639 CG PHE A 374 3.192 -7.822 3.234 1.00 0.00 C ATOM 640 CD1 PHE A 374 4.422 -7.904 2.548 1.00 0.00 C ATOM 641 CD2 PHE A 374 2.001 -7.793 2.479 1.00 0.00 C ATOM 642 CE1 PHE A 374 4.454 -7.959 1.142 1.00 0.00 C ATOM 643 CE2 PHE A 374 2.031 -7.853 1.074 1.00 0.00 C ATOM 644 CZ PHE A 374 3.261 -7.925 0.398 1.00 0.00 C ATOM 0 H PHE A 374 2.600 -9.977 5.797 1.00 0.00 H new ATOM 0 HA PHE A 374 5.065 -8.597 5.065 1.00 0.00 H new ATOM 0 HB2 PHE A 374 2.121 -7.991 5.054 1.00 0.00 H new ATOM 0 HB3 PHE A 374 3.270 -6.668 5.010 1.00 0.00 H new ATOM 0 HD1 PHE A 374 5.346 -7.925 3.106 1.00 0.00 H new ATOM 0 HD2 PHE A 374 1.051 -7.724 2.988 1.00 0.00 H new ATOM 0 HE1 PHE A 374 5.403 -8.028 0.630 1.00 0.00 H new ATOM 0 HE2 PHE A 374 1.108 -7.844 0.514 1.00 0.00 H new ATOM 0 HZ PHE A 374 3.290 -7.954 -0.681 1.00 0.00 H new ATOM 654 N THR A 375 3.418 -8.210 7.932 1.00 0.00 N ATOM 655 CA THR A 375 3.606 -7.702 9.281 1.00 0.00 C ATOM 656 C THR A 375 4.691 -8.491 10.044 1.00 0.00 C ATOM 657 O THR A 375 5.052 -8.064 11.141 1.00 0.00 O ATOM 658 CB THR A 375 2.259 -7.616 10.019 1.00 0.00 C ATOM 659 OG1 THR A 375 2.392 -6.951 11.256 1.00 0.00 O ATOM 660 CG2 THR A 375 1.553 -8.951 10.231 1.00 0.00 C ATOM 0 H THR A 375 2.610 -8.821 7.812 1.00 0.00 H new ATOM 0 HA THR A 375 3.988 -6.683 9.223 1.00 0.00 H new ATOM 0 HB THR A 375 1.623 -7.039 9.347 1.00 0.00 H new ATOM 0 HG1 THR A 375 3.282 -7.127 11.628 1.00 0.00 H new ATOM 0 HG21 THR A 375 0.614 -8.786 10.759 1.00 0.00 H new ATOM 0 HG22 THR A 375 1.350 -9.413 9.265 1.00 0.00 H new ATOM 0 HG23 THR A 375 2.190 -9.610 10.821 1.00 0.00 H new ATOM 668 N HIS A 376 5.163 -9.632 9.522 1.00 0.00 N ATOM 669 CA HIS A 376 6.301 -10.385 10.053 1.00 0.00 C ATOM 670 C HIS A 376 7.618 -9.950 9.400 1.00 0.00 C ATOM 671 O HIS A 376 8.659 -9.954 10.059 1.00 0.00 O ATOM 672 CB HIS A 376 6.074 -11.895 9.900 1.00 0.00 C ATOM 673 CG HIS A 376 5.043 -12.436 10.862 1.00 0.00 C ATOM 674 ND1 HIS A 376 3.680 -12.420 10.684 1.00 0.00 N ATOM 675 CD2 HIS A 376 5.289 -13.006 12.082 1.00 0.00 C ATOM 676 CE1 HIS A 376 3.114 -12.969 11.770 1.00 0.00 C ATOM 677 NE2 HIS A 376 4.056 -13.347 12.652 1.00 0.00 N ATOM 0 H HIS A 376 4.750 -10.066 8.696 1.00 0.00 H new ATOM 0 HA HIS A 376 6.380 -10.162 11.117 1.00 0.00 H new ATOM 0 HB2 HIS A 376 5.757 -12.108 8.879 1.00 0.00 H new ATOM 0 HB3 HIS A 376 7.018 -12.417 10.056 1.00 0.00 H new ATOM 0 HD1 HIS A 376 3.186 -12.055 9.870 1.00 0.00 H new ATOM 0 HD2 HIS A 376 6.261 -13.165 12.526 1.00 0.00 H new ATOM 0 HE1 HIS A 376 2.051 -13.090 11.915 1.00 0.00 H new ATOM 685 N GLU A 377 7.598 -9.667 8.096 1.00 0.00 N ATOM 686 CA GLU A 377 8.729 -9.143 7.343 1.00 0.00 C ATOM 687 C GLU A 377 9.181 -7.792 7.919 1.00 0.00 C ATOM 688 O GLU A 377 8.492 -7.178 8.734 1.00 0.00 O ATOM 689 CB GLU A 377 8.332 -9.028 5.858 1.00 0.00 C ATOM 690 CG GLU A 377 8.360 -10.390 5.139 1.00 0.00 C ATOM 691 CD GLU A 377 7.480 -10.410 3.881 1.00 0.00 C ATOM 692 OE1 GLU A 377 7.591 -9.450 3.084 1.00 0.00 O ATOM 693 OE2 GLU A 377 6.724 -11.398 3.711 1.00 0.00 O ATOM 0 H GLU A 377 6.766 -9.802 7.521 1.00 0.00 H new ATOM 0 HA GLU A 377 9.577 -9.823 7.425 1.00 0.00 H new ATOM 0 HB2 GLU A 377 7.332 -8.601 5.783 1.00 0.00 H new ATOM 0 HB3 GLU A 377 9.011 -8.340 5.355 1.00 0.00 H new ATOM 0 HG2 GLU A 377 9.387 -10.631 4.864 1.00 0.00 H new ATOM 0 HG3 GLU A 377 8.024 -11.167 5.826 1.00 0.00 H new ATOM 700 N ALA A 378 10.351 -7.320 7.464 1.00 0.00 N ATOM 701 CA ALA A 378 11.137 -6.262 8.104 1.00 0.00 C ATOM 702 C ALA A 378 10.284 -5.064 8.526 1.00 0.00 C ATOM 703 O ALA A 378 10.434 -4.571 9.641 1.00 0.00 O ATOM 704 CB ALA A 378 12.284 -5.837 7.179 1.00 0.00 C ATOM 0 H ALA A 378 10.787 -7.677 6.614 1.00 0.00 H new ATOM 0 HA ALA A 378 11.554 -6.669 9.025 1.00 0.00 H new ATOM 0 HB1 ALA A 378 12.866 -5.050 7.659 1.00 0.00 H new ATOM 0 HB2 ALA A 378 12.927 -6.694 6.980 1.00 0.00 H new ATOM 0 HB3 ALA A 378 11.875 -5.464 6.240 1.00 0.00 H new ATOM 710 N CYS A 379 9.454 -4.563 7.611 1.00 0.00 N ATOM 711 CA CYS A 379 8.277 -3.759 7.892 1.00 0.00 C ATOM 712 C CYS A 379 7.251 -4.120 6.807 1.00 0.00 C ATOM 713 O CYS A 379 7.684 -4.340 5.669 1.00 0.00 O ATOM 714 CB CYS A 379 8.607 -2.258 7.839 1.00 0.00 C ATOM 715 SG CYS A 379 9.332 -1.689 9.401 1.00 0.00 S ATOM 0 H CYS A 379 9.595 -4.716 6.612 1.00 0.00 H new ATOM 0 HA CYS A 379 7.895 -3.960 8.893 1.00 0.00 H new ATOM 0 HB2 CYS A 379 9.301 -2.064 7.021 1.00 0.00 H new ATOM 0 HB3 CYS A 379 7.700 -1.691 7.628 1.00 0.00 H new ATOM 0 HG CYS A 379 9.982 -2.667 9.959 1.00 0.00 H new ATOM 721 N PRO A 380 5.934 -4.056 7.093 1.00 0.00 N ATOM 722 CA PRO A 380 4.870 -4.206 6.103 1.00 0.00 C ATOM 723 C PRO A 380 5.044 -3.175 5.016 1.00 0.00 C ATOM 724 O PRO A 380 5.544 -3.528 3.962 1.00 0.00 O ATOM 725 CB PRO A 380 3.551 -4.127 6.872 1.00 0.00 C ATOM 726 CG PRO A 380 3.905 -3.412 8.172 1.00 0.00 C ATOM 727 CD PRO A 380 5.361 -3.809 8.409 1.00 0.00 C ATOM 0 HA PRO A 380 4.892 -5.161 5.579 1.00 0.00 H new ATOM 0 HB2 PRO A 380 2.797 -3.577 6.310 1.00 0.00 H new ATOM 0 HB3 PRO A 380 3.144 -5.120 7.064 1.00 0.00 H new ATOM 0 HG2 PRO A 380 3.793 -2.332 8.080 1.00 0.00 H new ATOM 0 HG3 PRO A 380 3.263 -3.730 8.993 1.00 0.00 H new ATOM 0 HD2 PRO A 380 5.901 -3.016 8.926 1.00 0.00 H new ATOM 0 HD3 PRO A 380 5.425 -4.699 9.035 1.00 0.00 H new ATOM 735 N VAL A 381 4.630 -1.930 5.226 1.00 0.00 N ATOM 736 CA VAL A 381 4.683 -0.868 4.230 1.00 0.00 C ATOM 737 C VAL A 381 5.994 -0.845 3.403 1.00 0.00 C ATOM 738 O VAL A 381 5.929 -0.629 2.194 1.00 0.00 O ATOM 739 CB VAL A 381 4.176 0.456 4.838 1.00 0.00 C ATOM 740 CG1 VAL A 381 3.980 1.536 3.766 1.00 0.00 C ATOM 741 CG2 VAL A 381 2.820 0.259 5.537 1.00 0.00 C ATOM 0 H VAL A 381 4.238 -1.625 6.117 1.00 0.00 H new ATOM 0 HA VAL A 381 3.975 -1.080 3.429 1.00 0.00 H new ATOM 0 HB VAL A 381 4.937 0.772 5.552 1.00 0.00 H new ATOM 0 HG11 VAL A 381 3.622 2.453 4.234 1.00 0.00 H new ATOM 0 HG12 VAL A 381 4.929 1.730 3.267 1.00 0.00 H new ATOM 0 HG13 VAL A 381 3.249 1.193 3.034 1.00 0.00 H new ATOM 0 HG21 VAL A 381 2.486 1.208 5.957 1.00 0.00 H new ATOM 0 HG22 VAL A 381 2.086 -0.096 4.814 1.00 0.00 H new ATOM 0 HG23 VAL A 381 2.926 -0.474 6.337 1.00 0.00 H new ATOM 751 N ARG A 382 7.167 -1.190 3.958 1.00 0.00 N ATOM 752 CA ARG A 382 8.367 -1.369 3.134 1.00 0.00 C ATOM 753 C ARG A 382 8.252 -2.534 2.149 1.00 0.00 C ATOM 754 O ARG A 382 8.339 -2.297 0.941 1.00 0.00 O ATOM 755 CB ARG A 382 9.621 -1.589 4.005 1.00 0.00 C ATOM 756 CG ARG A 382 9.982 -0.425 4.933 1.00 0.00 C ATOM 757 CD ARG A 382 10.326 0.854 4.167 1.00 0.00 C ATOM 758 NE ARG A 382 10.361 1.999 5.075 1.00 0.00 N ATOM 759 CZ ARG A 382 10.832 3.218 4.816 1.00 0.00 C ATOM 760 NH1 ARG A 382 11.517 3.468 3.705 1.00 0.00 N ATOM 761 NH2 ARG A 382 10.588 4.188 5.675 1.00 0.00 N ATOM 0 H ARG A 382 7.307 -1.348 4.956 1.00 0.00 H new ATOM 0 HA ARG A 382 8.462 -0.445 2.564 1.00 0.00 H new ATOM 0 HB2 ARG A 382 9.471 -2.483 4.611 1.00 0.00 H new ATOM 0 HB3 ARG A 382 10.469 -1.787 3.350 1.00 0.00 H new ATOM 0 HG2 ARG A 382 9.146 -0.228 5.605 1.00 0.00 H new ATOM 0 HG3 ARG A 382 10.830 -0.711 5.555 1.00 0.00 H new ATOM 0 HD2 ARG A 382 11.292 0.742 3.675 1.00 0.00 H new ATOM 0 HD3 ARG A 382 9.588 1.026 3.384 1.00 0.00 H new ATOM 0 HE ARG A 382 9.983 1.848 6.010 1.00 0.00 H new ATOM 0 HH11 ARG A 382 11.690 2.720 3.033 1.00 0.00 H new ATOM 0 HH12 ARG A 382 11.870 4.408 3.524 1.00 0.00 H new ATOM 0 HH21 ARG A 382 10.048 3.998 6.519 1.00 0.00 H new ATOM 0 HH22 ARG A 382 10.940 5.129 5.496 1.00 0.00 H new ATOM 775 N ALA A 383 8.081 -3.775 2.619 1.00 0.00 N ATOM 776 CA ALA A 383 8.093 -4.914 1.699 1.00 0.00 C ATOM 777 C ALA A 383 6.776 -5.023 0.924 1.00 0.00 C ATOM 778 O ALA A 383 6.735 -5.612 -0.153 1.00 0.00 O ATOM 779 CB ALA A 383 8.318 -6.198 2.505 1.00 0.00 C ATOM 0 H ALA A 383 7.937 -4.011 3.601 1.00 0.00 H new ATOM 0 HA ALA A 383 8.896 -4.768 0.977 1.00 0.00 H new ATOM 0 HB1 ALA A 383 8.329 -7.054 1.830 1.00 0.00 H new ATOM 0 HB2 ALA A 383 9.272 -6.136 3.029 1.00 0.00 H new ATOM 0 HB3 ALA A 383 7.513 -6.318 3.230 1.00 0.00 H new ATOM 785 N LEU A 384 5.759 -4.278 1.344 1.00 0.00 N ATOM 786 CA LEU A 384 4.453 -4.177 0.732 1.00 0.00 C ATOM 787 C LEU A 384 4.590 -3.405 -0.560 1.00 0.00 C ATOM 788 O LEU A 384 4.142 -3.868 -1.599 1.00 0.00 O ATOM 789 CB LEU A 384 3.550 -3.418 1.709 1.00 0.00 C ATOM 790 CG LEU A 384 2.087 -3.229 1.309 1.00 0.00 C ATOM 791 CD1 LEU A 384 1.387 -4.584 1.344 1.00 0.00 C ATOM 792 CD2 LEU A 384 1.455 -2.300 2.346 1.00 0.00 C ATOM 0 H LEU A 384 5.838 -3.693 2.176 1.00 0.00 H new ATOM 0 HA LEU A 384 4.029 -5.158 0.516 1.00 0.00 H new ATOM 0 HB2 LEU A 384 3.573 -3.941 2.665 1.00 0.00 H new ATOM 0 HB3 LEU A 384 3.985 -2.432 1.874 1.00 0.00 H new ATOM 0 HG LEU A 384 1.999 -2.808 0.307 1.00 0.00 H new ATOM 0 HD11 LEU A 384 0.342 -4.461 1.060 1.00 0.00 H new ATOM 0 HD12 LEU A 384 1.875 -5.264 0.646 1.00 0.00 H new ATOM 0 HD13 LEU A 384 1.443 -4.997 2.351 1.00 0.00 H new ATOM 0 HD21 LEU A 384 0.406 -2.138 2.098 1.00 0.00 H new ATOM 0 HD22 LEU A 384 1.528 -2.755 3.334 1.00 0.00 H new ATOM 0 HD23 LEU A 384 1.980 -1.345 2.347 1.00 0.00 H new ATOM 804 N LEU A 385 5.223 -2.231 -0.520 1.00 0.00 N ATOM 805 CA LEU A 385 5.285 -1.372 -1.695 1.00 0.00 C ATOM 806 C LEU A 385 6.377 -1.853 -2.645 1.00 0.00 C ATOM 807 O LEU A 385 6.304 -1.536 -3.831 1.00 0.00 O ATOM 808 CB LEU A 385 5.476 0.108 -1.281 1.00 0.00 C ATOM 809 CG LEU A 385 4.375 0.562 -0.297 1.00 0.00 C ATOM 810 CD1 LEU A 385 4.719 1.953 0.227 1.00 0.00 C ATOM 811 CD2 LEU A 385 2.966 0.504 -0.903 1.00 0.00 C ATOM 0 H LEU A 385 5.694 -1.860 0.305 1.00 0.00 H new ATOM 0 HA LEU A 385 4.338 -1.432 -2.231 1.00 0.00 H new ATOM 0 HB2 LEU A 385 6.455 0.235 -0.819 1.00 0.00 H new ATOM 0 HB3 LEU A 385 5.458 0.741 -2.168 1.00 0.00 H new ATOM 0 HG LEU A 385 4.351 -0.140 0.536 1.00 0.00 H new ATOM 0 HD11 LEU A 385 3.947 2.281 0.923 1.00 0.00 H new ATOM 0 HD12 LEU A 385 5.680 1.921 0.741 1.00 0.00 H new ATOM 0 HD13 LEU A 385 4.777 2.652 -0.607 1.00 0.00 H new ATOM 0 HD21 LEU A 385 2.238 0.835 -0.163 1.00 0.00 H new ATOM 0 HD22 LEU A 385 2.918 1.155 -1.776 1.00 0.00 H new ATOM 0 HD23 LEU A 385 2.740 -0.520 -1.202 1.00 0.00 H new ATOM 823 N ALA A 386 7.345 -2.638 -2.157 1.00 0.00 N ATOM 824 CA ALA A 386 8.311 -3.316 -3.008 1.00 0.00 C ATOM 825 C ALA A 386 7.693 -4.538 -3.697 1.00 0.00 C ATOM 826 O ALA A 386 7.927 -4.730 -4.886 1.00 0.00 O ATOM 827 CB ALA A 386 9.512 -3.747 -2.159 1.00 0.00 C ATOM 0 H ALA A 386 7.475 -2.816 -1.161 1.00 0.00 H new ATOM 0 HA ALA A 386 8.631 -2.624 -3.787 1.00 0.00 H new ATOM 0 HB1 ALA A 386 10.240 -4.256 -2.791 1.00 0.00 H new ATOM 0 HB2 ALA A 386 9.974 -2.868 -1.709 1.00 0.00 H new ATOM 0 HB3 ALA A 386 9.178 -4.424 -1.373 1.00 0.00 H new ATOM 833 N SER A 387 6.881 -5.335 -2.993 1.00 0.00 N ATOM 834 CA SER A 387 6.386 -6.603 -3.516 1.00 0.00 C ATOM 835 C SER A 387 5.087 -6.376 -4.278 1.00 0.00 C ATOM 836 O SER A 387 4.965 -6.859 -5.403 1.00 0.00 O ATOM 837 CB SER A 387 6.211 -7.631 -2.391 1.00 0.00 C ATOM 838 OG SER A 387 6.046 -8.933 -2.923 1.00 0.00 O ATOM 0 H SER A 387 6.553 -5.117 -2.052 1.00 0.00 H new ATOM 0 HA SER A 387 7.121 -7.011 -4.209 1.00 0.00 H new ATOM 0 HB2 SER A 387 7.080 -7.609 -1.733 1.00 0.00 H new ATOM 0 HB3 SER A 387 5.345 -7.369 -1.784 1.00 0.00 H new ATOM 0 HG SER A 387 5.938 -9.575 -2.190 1.00 0.00 H new ATOM 844 N TRP A 388 4.114 -5.652 -3.705 1.00 0.00 N ATOM 845 CA TRP A 388 2.902 -5.323 -4.444 1.00 0.00 C ATOM 846 C TRP A 388 3.308 -4.534 -5.687 1.00 0.00 C ATOM 847 O TRP A 388 2.855 -4.846 -6.785 1.00 0.00 O ATOM 848 CB TRP A 388 1.916 -4.492 -3.599 1.00 0.00 C ATOM 849 CG TRP A 388 0.591 -4.252 -4.270 1.00 0.00 C ATOM 850 CD1 TRP A 388 -0.391 -5.169 -4.445 1.00 0.00 C ATOM 851 CD2 TRP A 388 0.099 -3.031 -4.905 1.00 0.00 C ATOM 852 NE1 TRP A 388 -1.405 -4.630 -5.218 1.00 0.00 N ATOM 853 CE2 TRP A 388 -1.149 -3.325 -5.531 1.00 0.00 C ATOM 854 CE3 TRP A 388 0.581 -1.710 -5.040 1.00 0.00 C ATOM 855 CZ2 TRP A 388 -1.878 -2.389 -6.265 1.00 0.00 C ATOM 856 CZ3 TRP A 388 -0.146 -0.769 -5.795 1.00 0.00 C ATOM 857 CH2 TRP A 388 -1.355 -1.100 -6.392 1.00 0.00 C ATOM 0 H TRP A 388 4.147 -5.293 -2.751 1.00 0.00 H new ATOM 0 HA TRP A 388 2.392 -6.248 -4.713 1.00 0.00 H new ATOM 0 HB2 TRP A 388 1.745 -5.002 -2.651 1.00 0.00 H new ATOM 0 HB3 TRP A 388 2.373 -3.531 -3.365 1.00 0.00 H new ATOM 0 HD1 TRP A 388 -0.384 -6.171 -4.042 1.00 0.00 H new ATOM 0 HE1 TRP A 388 -2.236 -5.141 -5.515 1.00 0.00 H new ATOM 0 HE3 TRP A 388 1.507 -1.422 -4.564 1.00 0.00 H new ATOM 0 HZ2 TRP A 388 -2.820 -2.654 -6.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 388 0.245 0.231 -5.912 1.00 0.00 H new ATOM 0 HH2 TRP A 388 -1.895 -0.356 -6.959 1.00 0.00 H new ATOM 868 N GLY A 389 4.262 -3.608 -5.534 1.00 0.00 N ATOM 869 CA GLY A 389 4.779 -2.735 -6.575 1.00 0.00 C ATOM 870 C GLY A 389 5.773 -3.404 -7.520 1.00 0.00 C ATOM 871 O GLY A 389 6.541 -2.676 -8.152 1.00 0.00 O ATOM 0 H GLY A 389 4.712 -3.445 -4.633 1.00 0.00 H new ATOM 0 HA2 GLY A 389 3.943 -2.351 -7.159 1.00 0.00 H new ATOM 0 HA3 GLY A 389 5.262 -1.877 -6.107 1.00 0.00 H new ATOM 875 N ALA A 390 5.775 -4.739 -7.616 1.00 0.00 N ATOM 876 CA ALA A 390 6.510 -5.488 -8.629 1.00 0.00 C ATOM 877 C ALA A 390 5.589 -6.010 -9.745 1.00 0.00 C ATOM 878 O ALA A 390 6.083 -6.372 -10.812 1.00 0.00 O ATOM 879 CB ALA A 390 7.249 -6.653 -7.960 1.00 0.00 C ATOM 0 H ALA A 390 5.253 -5.337 -6.975 1.00 0.00 H new ATOM 0 HA ALA A 390 7.226 -4.812 -9.097 1.00 0.00 H new ATOM 0 HB1 ALA A 390 7.800 -7.215 -8.714 1.00 0.00 H new ATOM 0 HB2 ALA A 390 7.945 -6.264 -7.217 1.00 0.00 H new ATOM 0 HB3 ALA A 390 6.528 -7.309 -7.473 1.00 0.00 H new ATOM 885 N GLN A 391 4.270 -6.076 -9.527 1.00 0.00 N ATOM 886 CA GLN A 391 3.317 -6.474 -10.565 1.00 0.00 C ATOM 887 C GLN A 391 3.064 -5.234 -11.457 1.00 0.00 C ATOM 888 O GLN A 391 3.075 -4.109 -10.952 1.00 0.00 O ATOM 889 CB GLN A 391 2.033 -7.012 -9.878 1.00 0.00 C ATOM 890 CG GLN A 391 1.137 -5.857 -9.448 1.00 0.00 C ATOM 891 CD GLN A 391 0.028 -6.250 -8.502 1.00 0.00 C ATOM 892 OE1 GLN A 391 -1.079 -6.572 -8.916 1.00 0.00 O ATOM 893 NE2 GLN A 391 0.317 -6.198 -7.220 1.00 0.00 N ATOM 0 H GLN A 391 3.837 -5.856 -8.630 1.00 0.00 H new ATOM 0 HA GLN A 391 3.692 -7.276 -11.201 1.00 0.00 H new ATOM 0 HB2 GLN A 391 1.492 -7.664 -10.564 1.00 0.00 H new ATOM 0 HB3 GLN A 391 2.302 -7.614 -9.010 1.00 0.00 H new ATOM 0 HG2 GLN A 391 1.752 -5.094 -8.971 1.00 0.00 H new ATOM 0 HG3 GLN A 391 0.697 -5.403 -10.336 1.00 0.00 H new ATOM 0 HE21 GLN A 391 1.252 -5.925 -6.919 1.00 0.00 H new ATOM 0 HE22 GLN A 391 -0.394 -6.431 -6.527 1.00 0.00 H new ATOM 902 N ASP A 392 2.747 -5.392 -12.748 1.00 0.00 N ATOM 903 CA ASP A 392 2.471 -4.219 -13.602 1.00 0.00 C ATOM 904 C ASP A 392 1.129 -3.548 -13.257 1.00 0.00 C ATOM 905 O ASP A 392 0.958 -2.336 -13.411 1.00 0.00 O ATOM 906 CB ASP A 392 2.502 -4.572 -15.094 1.00 0.00 C ATOM 907 CG ASP A 392 2.429 -3.275 -15.906 1.00 0.00 C ATOM 908 OD1 ASP A 392 3.421 -2.513 -15.896 1.00 0.00 O ATOM 909 OD2 ASP A 392 1.343 -2.918 -16.414 1.00 0.00 O ATOM 0 H ASP A 392 2.675 -6.294 -13.219 1.00 0.00 H new ATOM 0 HA ASP A 392 3.272 -3.509 -13.396 1.00 0.00 H new ATOM 0 HB2 ASP A 392 3.414 -5.118 -15.334 1.00 0.00 H new ATOM 0 HB3 ASP A 392 1.665 -5.223 -15.346 1.00 0.00 H new ATOM 914 N SER A 393 0.181 -4.323 -12.731 1.00 0.00 N ATOM 915 CA SER A 393 -1.119 -3.867 -12.259 1.00 0.00 C ATOM 916 C SER A 393 -1.067 -3.012 -10.983 1.00 0.00 C ATOM 917 O SER A 393 -2.105 -2.490 -10.582 1.00 0.00 O ATOM 918 CB SER A 393 -2.034 -5.099 -12.119 1.00 0.00 C ATOM 919 OG SER A 393 -1.345 -6.236 -11.614 1.00 0.00 O ATOM 0 H SER A 393 0.307 -5.329 -12.619 1.00 0.00 H new ATOM 0 HA SER A 393 -1.531 -3.179 -12.997 1.00 0.00 H new ATOM 0 HB2 SER A 393 -2.864 -4.857 -11.455 1.00 0.00 H new ATOM 0 HB3 SER A 393 -2.463 -5.341 -13.091 1.00 0.00 H new ATOM 0 HG SER A 393 -1.433 -6.265 -10.638 1.00 0.00 H new ATOM 925 N ALA A 394 0.095 -2.833 -10.339 1.00 0.00 N ATOM 926 CA ALA A 394 0.204 -2.080 -9.092 1.00 0.00 C ATOM 927 C ALA A 394 0.346 -0.580 -9.345 1.00 0.00 C ATOM 928 O ALA A 394 1.282 0.067 -8.854 1.00 0.00 O ATOM 929 CB ALA A 394 1.338 -2.633 -8.230 1.00 0.00 C ATOM 0 H ALA A 394 0.983 -3.208 -10.672 1.00 0.00 H new ATOM 0 HA ALA A 394 -0.725 -2.208 -8.536 1.00 0.00 H new ATOM 0 HB1 ALA A 394 1.405 -2.060 -7.305 1.00 0.00 H new ATOM 0 HB2 ALA A 394 1.140 -3.679 -7.995 1.00 0.00 H new ATOM 0 HB3 ALA A 394 2.280 -2.555 -8.774 1.00 0.00 H new ATOM 935 N THR A 395 -0.566 -0.015 -10.127 1.00 0.00 N ATOM 936 CA THR A 395 -0.513 1.380 -10.509 1.00 0.00 C ATOM 937 C THR A 395 -0.776 2.241 -9.267 1.00 0.00 C ATOM 938 O THR A 395 -1.297 1.761 -8.252 1.00 0.00 O ATOM 939 CB THR A 395 -1.508 1.620 -11.651 1.00 0.00 C ATOM 940 OG1 THR A 395 -2.775 1.086 -11.345 1.00 0.00 O ATOM 941 CG2 THR A 395 -1.018 0.966 -12.947 1.00 0.00 C ATOM 0 H THR A 395 -1.365 -0.519 -10.513 1.00 0.00 H new ATOM 0 HA THR A 395 0.470 1.662 -10.886 1.00 0.00 H new ATOM 0 HB THR A 395 -1.586 2.699 -11.781 1.00 0.00 H new ATOM 0 HG1 THR A 395 -3.464 1.570 -11.847 1.00 0.00 H new ATOM 0 HG21 THR A 395 -1.740 1.150 -13.743 1.00 0.00 H new ATOM 0 HG22 THR A 395 -0.054 1.390 -13.227 1.00 0.00 H new ATOM 0 HG23 THR A 395 -0.911 -0.108 -12.795 1.00 0.00 H new ATOM 949 N LEU A 396 -0.398 3.522 -9.305 1.00 0.00 N ATOM 950 CA LEU A 396 -0.748 4.413 -8.200 1.00 0.00 C ATOM 951 C LEU A 396 -2.276 4.425 -8.066 1.00 0.00 C ATOM 952 O LEU A 396 -2.805 4.294 -6.964 1.00 0.00 O ATOM 953 CB LEU A 396 -0.171 5.821 -8.438 1.00 0.00 C ATOM 954 CG LEU A 396 0.054 6.678 -7.173 1.00 0.00 C ATOM 955 CD1 LEU A 396 -1.133 6.727 -6.206 1.00 0.00 C ATOM 956 CD2 LEU A 396 1.300 6.232 -6.395 1.00 0.00 C ATOM 0 H LEU A 396 0.132 3.953 -10.062 1.00 0.00 H new ATOM 0 HA LEU A 396 -0.314 4.058 -7.265 1.00 0.00 H new ATOM 0 HB2 LEU A 396 0.781 5.720 -8.959 1.00 0.00 H new ATOM 0 HB3 LEU A 396 -0.844 6.361 -9.105 1.00 0.00 H new ATOM 0 HG LEU A 396 0.189 7.685 -7.568 1.00 0.00 H new ATOM 0 HD11 LEU A 396 -0.879 7.352 -5.350 1.00 0.00 H new ATOM 0 HD12 LEU A 396 -2.001 7.145 -6.716 1.00 0.00 H new ATOM 0 HD13 LEU A 396 -1.365 5.719 -5.863 1.00 0.00 H new ATOM 0 HD21 LEU A 396 1.422 6.860 -5.513 1.00 0.00 H new ATOM 0 HD22 LEU A 396 1.184 5.193 -6.087 1.00 0.00 H new ATOM 0 HD23 LEU A 396 2.180 6.326 -7.032 1.00 0.00 H new ATOM 968 N ASP A 397 -2.974 4.450 -9.202 1.00 0.00 N ATOM 969 CA ASP A 397 -4.427 4.451 -9.318 1.00 0.00 C ATOM 970 C ASP A 397 -5.066 3.130 -8.879 1.00 0.00 C ATOM 971 O ASP A 397 -6.226 3.147 -8.462 1.00 0.00 O ATOM 972 CB ASP A 397 -4.853 4.816 -10.750 1.00 0.00 C ATOM 973 CG ASP A 397 -4.048 4.047 -11.793 1.00 0.00 C ATOM 974 OD1 ASP A 397 -2.946 4.541 -12.118 1.00 0.00 O ATOM 975 OD2 ASP A 397 -4.441 2.918 -12.157 1.00 0.00 O ATOM 0 H ASP A 397 -2.514 4.471 -10.112 1.00 0.00 H new ATOM 0 HA ASP A 397 -4.795 5.213 -8.631 1.00 0.00 H new ATOM 0 HB2 ASP A 397 -5.914 4.602 -10.879 1.00 0.00 H new ATOM 0 HB3 ASP A 397 -4.722 5.887 -10.907 1.00 0.00 H new ATOM 980 N ALA A 398 -4.301 2.038 -8.777 1.00 0.00 N ATOM 981 CA ALA A 398 -4.806 0.777 -8.241 1.00 0.00 C ATOM 982 C ALA A 398 -4.837 0.902 -6.725 1.00 0.00 C ATOM 983 O ALA A 398 -5.873 0.630 -6.119 1.00 0.00 O ATOM 984 CB ALA A 398 -3.909 -0.421 -8.615 1.00 0.00 C ATOM 0 H ALA A 398 -3.322 2.006 -9.062 1.00 0.00 H new ATOM 0 HA ALA A 398 -5.794 0.593 -8.663 1.00 0.00 H new ATOM 0 HB1 ALA A 398 -4.328 -1.335 -8.193 1.00 0.00 H new ATOM 0 HB2 ALA A 398 -3.858 -0.513 -9.700 1.00 0.00 H new ATOM 0 HB3 ALA A 398 -2.907 -0.263 -8.217 1.00 0.00 H new ATOM 990 N LEU A 399 -3.737 1.336 -6.097 1.00 0.00 N ATOM 991 CA LEU A 399 -3.708 1.440 -4.641 1.00 0.00 C ATOM 992 C LEU A 399 -4.682 2.505 -4.160 1.00 0.00 C ATOM 993 O LEU A 399 -5.368 2.325 -3.155 1.00 0.00 O ATOM 994 CB LEU A 399 -2.290 1.700 -4.117 1.00 0.00 C ATOM 995 CG LEU A 399 -2.216 1.505 -2.588 1.00 0.00 C ATOM 996 CD1 LEU A 399 -0.884 0.862 -2.176 1.00 0.00 C ATOM 997 CD2 LEU A 399 -2.430 2.812 -1.818 1.00 0.00 C ATOM 0 H LEU A 399 -2.875 1.614 -6.566 1.00 0.00 H new ATOM 0 HA LEU A 399 -4.026 0.480 -4.233 1.00 0.00 H new ATOM 0 HB2 LEU A 399 -1.589 1.024 -4.607 1.00 0.00 H new ATOM 0 HB3 LEU A 399 -1.986 2.715 -4.372 1.00 0.00 H new ATOM 0 HG LEU A 399 -3.032 0.832 -2.324 1.00 0.00 H new ATOM 0 HD11 LEU A 399 -0.860 0.737 -1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 399 -0.786 -0.112 -2.656 1.00 0.00 H new ATOM 0 HD13 LEU A 399 -0.059 1.504 -2.485 1.00 0.00 H new ATOM 0 HD21 LEU A 399 -2.368 2.618 -0.747 1.00 0.00 H new ATOM 0 HD22 LEU A 399 -1.662 3.531 -2.102 1.00 0.00 H new ATOM 0 HD23 LEU A 399 -3.413 3.218 -2.057 1.00 0.00 H new ATOM 1009 N LEU A 400 -4.760 3.609 -4.895 1.00 0.00 N ATOM 1010 CA LEU A 400 -5.654 4.715 -4.633 1.00 0.00 C ATOM 1011 C LEU A 400 -7.107 4.222 -4.649 1.00 0.00 C ATOM 1012 O LEU A 400 -7.884 4.584 -3.768 1.00 0.00 O ATOM 1013 CB LEU A 400 -5.369 5.762 -5.740 1.00 0.00 C ATOM 1014 CG LEU A 400 -6.485 6.748 -6.149 1.00 0.00 C ATOM 1015 CD1 LEU A 400 -5.899 8.141 -6.428 1.00 0.00 C ATOM 1016 CD2 LEU A 400 -7.261 6.342 -7.413 1.00 0.00 C ATOM 0 H LEU A 400 -4.177 3.757 -5.719 1.00 0.00 H new ATOM 0 HA LEU A 400 -5.497 5.160 -3.651 1.00 0.00 H new ATOM 0 HB2 LEU A 400 -4.510 6.352 -5.420 1.00 0.00 H new ATOM 0 HB3 LEU A 400 -5.067 5.219 -6.635 1.00 0.00 H new ATOM 0 HG LEU A 400 -7.172 6.743 -5.303 1.00 0.00 H new ATOM 0 HD11 LEU A 400 -6.700 8.822 -6.715 1.00 0.00 H new ATOM 0 HD12 LEU A 400 -5.408 8.516 -5.530 1.00 0.00 H new ATOM 0 HD13 LEU A 400 -5.172 8.075 -7.238 1.00 0.00 H new ATOM 0 HD21 LEU A 400 -8.025 7.090 -7.627 1.00 0.00 H new ATOM 0 HD22 LEU A 400 -6.573 6.274 -8.256 1.00 0.00 H new ATOM 0 HD23 LEU A 400 -7.736 5.374 -7.253 1.00 0.00 H new ATOM 1028 N ALA A 401 -7.503 3.416 -5.638 1.00 0.00 N ATOM 1029 CA ALA A 401 -8.849 2.861 -5.710 1.00 0.00 C ATOM 1030 C ALA A 401 -9.079 1.791 -4.640 1.00 0.00 C ATOM 1031 O ALA A 401 -10.171 1.737 -4.080 1.00 0.00 O ATOM 1032 CB ALA A 401 -9.080 2.261 -7.096 1.00 0.00 C ATOM 0 H ALA A 401 -6.897 3.133 -6.408 1.00 0.00 H new ATOM 0 HA ALA A 401 -9.557 3.670 -5.529 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -10.086 1.846 -7.150 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -8.967 3.038 -7.852 1.00 0.00 H new ATOM 0 HB3 ALA A 401 -8.352 1.470 -7.276 1.00 0.00 H new ATOM 1038 N ALA A 402 -8.090 0.941 -4.351 1.00 0.00 N ATOM 1039 CA ALA A 402 -8.171 -0.045 -3.278 1.00 0.00 C ATOM 1040 C ALA A 402 -8.459 0.671 -1.952 1.00 0.00 C ATOM 1041 O ALA A 402 -9.386 0.307 -1.235 1.00 0.00 O ATOM 1042 CB ALA A 402 -6.880 -0.870 -3.238 1.00 0.00 C ATOM 0 H ALA A 402 -7.206 0.920 -4.860 1.00 0.00 H new ATOM 0 HA ALA A 402 -8.990 -0.742 -3.457 1.00 0.00 H new ATOM 0 HB1 ALA A 402 -6.943 -1.605 -2.436 1.00 0.00 H new ATOM 0 HB2 ALA A 402 -6.746 -1.382 -4.191 1.00 0.00 H new ATOM 0 HB3 ALA A 402 -6.032 -0.210 -3.059 1.00 0.00 H new ATOM 1048 N LEU A 403 -7.751 1.767 -1.669 1.00 0.00 N ATOM 1049 CA LEU A 403 -8.049 2.643 -0.536 1.00 0.00 C ATOM 1050 C LEU A 403 -9.455 3.217 -0.617 1.00 0.00 C ATOM 1051 O LEU A 403 -10.164 3.312 0.385 1.00 0.00 O ATOM 1052 CB LEU A 403 -7.091 3.829 -0.524 1.00 0.00 C ATOM 1053 CG LEU A 403 -5.744 3.615 0.155 1.00 0.00 C ATOM 1054 CD1 LEU A 403 -4.864 4.806 -0.241 1.00 0.00 C ATOM 1055 CD2 LEU A 403 -5.956 3.537 1.672 1.00 0.00 C ATOM 0 H LEU A 403 -6.951 2.072 -2.223 1.00 0.00 H new ATOM 0 HA LEU A 403 -7.948 2.034 0.362 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -6.908 4.129 -1.556 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -7.590 4.664 -0.033 1.00 0.00 H new ATOM 0 HG LEU A 403 -5.263 2.686 -0.151 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -3.882 4.702 0.221 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -4.754 4.833 -1.325 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -5.329 5.731 0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.997 3.384 2.166 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -6.402 4.467 2.025 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -6.621 2.705 1.904 1.00 0.00 H new ATOM 1067 N ARG A 404 -9.861 3.662 -1.802 1.00 0.00 N ATOM 1068 CA ARG A 404 -11.158 4.290 -2.001 1.00 0.00 C ATOM 1069 C ARG A 404 -12.263 3.263 -1.710 1.00 0.00 C ATOM 1070 O ARG A 404 -13.323 3.641 -1.220 1.00 0.00 O ATOM 1071 CB ARG A 404 -11.184 4.817 -3.452 1.00 0.00 C ATOM 1072 CG ARG A 404 -12.388 5.661 -3.859 1.00 0.00 C ATOM 1073 CD ARG A 404 -12.192 7.091 -3.358 1.00 0.00 C ATOM 1074 NE ARG A 404 -11.195 7.871 -4.121 1.00 0.00 N ATOM 1075 CZ ARG A 404 -10.672 9.052 -3.742 1.00 0.00 C ATOM 1076 NH1 ARG A 404 -11.032 9.614 -2.596 1.00 0.00 N ATOM 1077 NH2 ARG A 404 -9.788 9.673 -4.508 1.00 0.00 N ATOM 0 H ARG A 404 -9.298 3.596 -2.650 1.00 0.00 H new ATOM 0 HA ARG A 404 -11.330 5.127 -1.324 1.00 0.00 H new ATOM 0 HB2 ARG A 404 -10.284 5.410 -3.614 1.00 0.00 H new ATOM 0 HB3 ARG A 404 -11.127 3.961 -4.125 1.00 0.00 H new ATOM 0 HG2 ARG A 404 -12.501 5.655 -4.943 1.00 0.00 H new ATOM 0 HG3 ARG A 404 -13.302 5.238 -3.441 1.00 0.00 H new ATOM 0 HD2 ARG A 404 -13.149 7.611 -3.396 1.00 0.00 H new ATOM 0 HD3 ARG A 404 -11.888 7.059 -2.312 1.00 0.00 H new ATOM 0 HE ARG A 404 -10.877 7.482 -5.009 1.00 0.00 H new ATOM 0 HH11 ARG A 404 -11.711 9.151 -1.992 1.00 0.00 H new ATOM 0 HH12 ARG A 404 -10.629 10.509 -2.318 1.00 0.00 H new ATOM 0 HH21 ARG A 404 -9.498 9.257 -5.393 1.00 0.00 H new ATOM 0 HH22 ARG A 404 -9.397 10.568 -4.213 1.00 0.00 H new ATOM 1091 N ARG A 405 -12.007 1.972 -1.934 1.00 0.00 N ATOM 1092 CA ARG A 405 -12.836 0.829 -1.565 1.00 0.00 C ATOM 1093 C ARG A 405 -12.903 0.544 -0.052 1.00 0.00 C ATOM 1094 O ARG A 405 -13.855 -0.128 0.341 1.00 0.00 O ATOM 1095 CB ARG A 405 -12.401 -0.348 -2.468 1.00 0.00 C ATOM 1096 CG ARG A 405 -12.894 -1.756 -2.138 1.00 0.00 C ATOM 1097 CD ARG A 405 -14.403 -2.049 -2.034 1.00 0.00 C ATOM 1098 NE ARG A 405 -14.610 -3.408 -1.486 1.00 0.00 N ATOM 1099 CZ ARG A 405 -14.107 -3.836 -0.314 1.00 0.00 C ATOM 1100 NH1 ARG A 405 -13.834 -2.985 0.670 1.00 0.00 N ATOM 1101 NH2 ARG A 405 -13.823 -5.123 -0.159 1.00 0.00 N ATOM 0 H ARG A 405 -11.154 1.681 -2.412 1.00 0.00 H new ATOM 0 HA ARG A 405 -13.888 1.042 -1.754 1.00 0.00 H new ATOM 0 HB2 ARG A 405 -12.719 -0.118 -3.485 1.00 0.00 H new ATOM 0 HB3 ARG A 405 -11.311 -0.374 -2.473 1.00 0.00 H new ATOM 0 HG2 ARG A 405 -12.487 -2.426 -2.896 1.00 0.00 H new ATOM 0 HG3 ARG A 405 -12.444 -2.040 -1.187 1.00 0.00 H new ATOM 0 HD2 ARG A 405 -14.883 -1.310 -1.392 1.00 0.00 H new ATOM 0 HD3 ARG A 405 -14.868 -1.968 -3.017 1.00 0.00 H new ATOM 0 HE ARG A 405 -15.170 -4.062 -2.032 1.00 0.00 H new ATOM 0 HH11 ARG A 405 -14.006 -1.987 0.544 1.00 0.00 H new ATOM 0 HH12 ARG A 405 -13.453 -3.330 1.551 1.00 0.00 H new ATOM 0 HH21 ARG A 405 -13.986 -5.777 -0.924 1.00 0.00 H new ATOM 0 HH22 ARG A 405 -13.441 -5.458 0.726 1.00 0.00 H new ATOM 1115 N ILE A 406 -12.039 1.082 0.822 1.00 0.00 N ATOM 1116 CA ILE A 406 -12.351 1.196 2.257 1.00 0.00 C ATOM 1117 C ILE A 406 -12.704 2.639 2.635 1.00 0.00 C ATOM 1118 O ILE A 406 -12.792 2.971 3.814 1.00 0.00 O ATOM 1119 CB ILE A 406 -11.248 0.593 3.153 1.00 0.00 C ATOM 1120 CG1 ILE A 406 -9.821 1.132 2.913 1.00 0.00 C ATOM 1121 CG2 ILE A 406 -11.332 -0.927 3.072 1.00 0.00 C ATOM 1122 CD1 ILE A 406 -8.842 0.218 2.168 1.00 0.00 C ATOM 0 H ILE A 406 -11.121 1.444 0.563 1.00 0.00 H new ATOM 0 HA ILE A 406 -13.239 0.592 2.445 1.00 0.00 H new ATOM 0 HB ILE A 406 -11.448 0.925 4.172 1.00 0.00 H new ATOM 0 HG12 ILE A 406 -9.902 2.065 2.356 1.00 0.00 H new ATOM 0 HG13 ILE A 406 -9.385 1.376 3.882 1.00 0.00 H new ATOM 0 HG21 ILE A 406 -10.558 -1.368 3.700 1.00 0.00 H new ATOM 0 HG22 ILE A 406 -12.312 -1.256 3.418 1.00 0.00 H new ATOM 0 HG23 ILE A 406 -11.186 -1.245 2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 406 -7.880 0.720 2.069 1.00 0.00 H new ATOM 0 HD12 ILE A 406 -8.712 -0.709 2.727 1.00 0.00 H new ATOM 0 HD13 ILE A 406 -9.237 -0.008 1.178 1.00 0.00 H new ATOM 1134 N GLN A 407 -12.906 3.511 1.644 1.00 0.00 N ATOM 1135 CA GLN A 407 -13.135 4.940 1.791 1.00 0.00 C ATOM 1136 C GLN A 407 -12.083 5.618 2.689 1.00 0.00 C ATOM 1137 O GLN A 407 -12.357 6.678 3.259 1.00 0.00 O ATOM 1138 CB GLN A 407 -14.596 5.187 2.220 1.00 0.00 C ATOM 1139 CG GLN A 407 -15.103 6.596 1.853 1.00 0.00 C ATOM 1140 CD GLN A 407 -15.726 7.323 3.043 1.00 0.00 C ATOM 1141 OE1 GLN A 407 -16.924 7.572 3.080 1.00 0.00 O ATOM 1142 NE2 GLN A 407 -14.925 7.692 4.028 1.00 0.00 N ATOM 0 H GLN A 407 -12.913 3.217 0.667 1.00 0.00 H new ATOM 0 HA GLN A 407 -12.999 5.426 0.825 1.00 0.00 H new ATOM 0 HB2 GLN A 407 -15.238 4.442 1.749 1.00 0.00 H new ATOM 0 HB3 GLN A 407 -14.681 5.046 3.297 1.00 0.00 H new ATOM 0 HG2 GLN A 407 -14.274 7.187 1.464 1.00 0.00 H new ATOM 0 HG3 GLN A 407 -15.840 6.516 1.054 1.00 0.00 H new ATOM 0 HE21 GLN A 407 -13.929 7.477 3.983 1.00 0.00 H new ATOM 0 HE22 GLN A 407 -15.303 8.191 4.833 1.00 0.00 H new ATOM 1151 N ARG A 408 -10.865 5.064 2.797 1.00 0.00 N ATOM 1152 CA ARG A 408 -9.755 5.714 3.524 1.00 0.00 C ATOM 1153 C ARG A 408 -9.123 6.776 2.614 1.00 0.00 C ATOM 1154 O ARG A 408 -7.957 6.698 2.229 1.00 0.00 O ATOM 1155 CB ARG A 408 -8.785 4.667 4.092 1.00 0.00 C ATOM 1156 CG ARG A 408 -9.471 3.868 5.220 1.00 0.00 C ATOM 1157 CD ARG A 408 -9.685 4.646 6.530 1.00 0.00 C ATOM 1158 NE ARG A 408 -8.483 4.638 7.376 1.00 0.00 N ATOM 1159 CZ ARG A 408 -7.712 5.663 7.762 1.00 0.00 C ATOM 1160 NH1 ARG A 408 -7.897 6.878 7.281 1.00 0.00 N ATOM 1161 NH2 ARG A 408 -6.736 5.455 8.639 1.00 0.00 N ATOM 0 H ARG A 408 -10.620 4.162 2.389 1.00 0.00 H new ATOM 0 HA ARG A 408 -10.115 6.244 4.406 1.00 0.00 H new ATOM 0 HB2 ARG A 408 -8.463 3.991 3.300 1.00 0.00 H new ATOM 0 HB3 ARG A 408 -7.891 5.158 4.475 1.00 0.00 H new ATOM 0 HG2 ARG A 408 -10.439 3.518 4.860 1.00 0.00 H new ATOM 0 HG3 ARG A 408 -8.872 2.983 5.434 1.00 0.00 H new ATOM 0 HD2 ARG A 408 -9.960 5.675 6.300 1.00 0.00 H new ATOM 0 HD3 ARG A 408 -10.519 4.209 7.080 1.00 0.00 H new ATOM 0 HE ARG A 408 -8.195 3.721 7.718 1.00 0.00 H new ATOM 0 HH11 ARG A 408 -8.638 7.050 6.602 1.00 0.00 H new ATOM 0 HH12 ARG A 408 -7.299 7.645 7.588 1.00 0.00 H new ATOM 0 HH21 ARG A 408 -6.578 4.520 9.014 1.00 0.00 H new ATOM 0 HH22 ARG A 408 -6.145 6.231 8.938 1.00 0.00 H new ATOM 1175 N ALA A 409 -9.968 7.719 2.191 1.00 0.00 N ATOM 1176 CA ALA A 409 -9.738 8.699 1.143 1.00 0.00 C ATOM 1177 C ALA A 409 -8.739 9.779 1.556 1.00 0.00 C ATOM 1178 O ALA A 409 -8.107 10.384 0.701 1.00 0.00 O ATOM 1179 CB ALA A 409 -11.088 9.339 0.807 1.00 0.00 C ATOM 0 H ALA A 409 -10.895 7.819 2.605 1.00 0.00 H new ATOM 0 HA ALA A 409 -9.306 8.195 0.279 1.00 0.00 H new ATOM 0 HB1 ALA A 409 -10.953 10.082 0.021 1.00 0.00 H new ATOM 0 HB2 ALA A 409 -11.780 8.570 0.464 1.00 0.00 H new ATOM 0 HB3 ALA A 409 -11.494 9.821 1.697 1.00 0.00 H new ATOM 1185 N ASP A 410 -8.542 9.972 2.854 1.00 0.00 N ATOM 1186 CA ASP A 410 -7.527 10.837 3.439 1.00 0.00 C ATOM 1187 C ASP A 410 -6.136 10.461 2.928 1.00 0.00 C ATOM 1188 O ASP A 410 -5.381 11.334 2.499 1.00 0.00 O ATOM 1189 CB ASP A 410 -7.615 10.763 4.975 1.00 0.00 C ATOM 1190 CG ASP A 410 -7.525 9.336 5.533 1.00 0.00 C ATOM 1191 OD1 ASP A 410 -8.387 8.492 5.167 1.00 0.00 O ATOM 1192 OD2 ASP A 410 -6.636 9.061 6.368 1.00 0.00 O ATOM 0 H ASP A 410 -9.113 9.507 3.560 1.00 0.00 H new ATOM 0 HA ASP A 410 -7.708 11.868 3.136 1.00 0.00 H new ATOM 0 HB2 ASP A 410 -6.812 11.362 5.405 1.00 0.00 H new ATOM 0 HB3 ASP A 410 -8.555 11.211 5.298 1.00 0.00 H new ATOM 1197 N ILE A 411 -5.807 9.166 2.892 1.00 0.00 N ATOM 1198 CA ILE A 411 -4.522 8.724 2.361 1.00 0.00 C ATOM 1199 C ILE A 411 -4.496 8.964 0.855 1.00 0.00 C ATOM 1200 O ILE A 411 -3.455 9.321 0.313 1.00 0.00 O ATOM 1201 CB ILE A 411 -4.234 7.232 2.674 1.00 0.00 C ATOM 1202 CG1 ILE A 411 -4.612 6.890 4.150 1.00 0.00 C ATOM 1203 CG2 ILE A 411 -2.777 6.899 2.291 1.00 0.00 C ATOM 1204 CD1 ILE A 411 -4.404 5.447 4.636 1.00 0.00 C ATOM 0 H ILE A 411 -6.411 8.413 3.223 1.00 0.00 H new ATOM 0 HA ILE A 411 -3.738 9.304 2.848 1.00 0.00 H new ATOM 0 HB ILE A 411 -4.868 6.586 2.067 1.00 0.00 H new ATOM 0 HG12 ILE A 411 -4.037 7.547 4.802 1.00 0.00 H new ATOM 0 HG13 ILE A 411 -5.663 7.141 4.291 1.00 0.00 H new ATOM 0 HG21 ILE A 411 -2.574 5.851 2.511 1.00 0.00 H new ATOM 0 HG22 ILE A 411 -2.630 7.082 1.227 1.00 0.00 H new ATOM 0 HG23 ILE A 411 -2.097 7.529 2.865 1.00 0.00 H new ATOM 0 HD11 ILE A 411 -4.711 5.366 5.679 1.00 0.00 H new ATOM 0 HD12 ILE A 411 -5.002 4.768 4.028 1.00 0.00 H new ATOM 0 HD13 ILE A 411 -3.351 5.181 4.547 1.00 0.00 H new ATOM 1216 N VAL A 412 -5.612 8.712 0.173 1.00 0.00 N ATOM 1217 CA VAL A 412 -5.692 8.806 -1.272 1.00 0.00 C ATOM 1218 C VAL A 412 -5.395 10.240 -1.743 1.00 0.00 C ATOM 1219 O VAL A 412 -4.622 10.453 -2.675 1.00 0.00 O ATOM 1220 CB VAL A 412 -7.091 8.386 -1.766 1.00 0.00 C ATOM 1221 CG1 VAL A 412 -7.104 8.359 -3.284 1.00 0.00 C ATOM 1222 CG2 VAL A 412 -7.485 6.983 -1.314 1.00 0.00 C ATOM 0 H VAL A 412 -6.488 8.436 0.616 1.00 0.00 H new ATOM 0 HA VAL A 412 -4.945 8.132 -1.691 1.00 0.00 H new ATOM 0 HB VAL A 412 -7.789 9.111 -1.348 1.00 0.00 H new ATOM 0 HG11 VAL A 412 -8.093 8.062 -3.634 1.00 0.00 H new ATOM 0 HG12 VAL A 412 -6.866 9.351 -3.668 1.00 0.00 H new ATOM 0 HG13 VAL A 412 -6.363 7.644 -3.642 1.00 0.00 H new ATOM 0 HG21 VAL A 412 -8.479 6.745 -1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 412 -6.766 6.261 -1.701 1.00 0.00 H new ATOM 0 HG23 VAL A 412 -7.492 6.940 -0.225 1.00 0.00 H new ATOM 1232 N GLU A 413 -6.079 11.222 -1.162 1.00 0.00 N ATOM 1233 CA GLU A 413 -5.906 12.622 -1.514 1.00 0.00 C ATOM 1234 C GLU A 413 -4.466 13.079 -1.230 1.00 0.00 C ATOM 1235 O GLU A 413 -3.883 13.795 -2.044 1.00 0.00 O ATOM 1236 CB GLU A 413 -7.001 13.461 -0.835 1.00 0.00 C ATOM 1237 CG GLU A 413 -8.275 13.597 -1.701 1.00 0.00 C ATOM 1238 CD GLU A 413 -8.960 12.283 -2.124 1.00 0.00 C ATOM 1239 OE1 GLU A 413 -8.556 11.665 -3.137 1.00 0.00 O ATOM 1240 OE2 GLU A 413 -9.993 11.899 -1.531 1.00 0.00 O ATOM 0 H GLU A 413 -6.772 11.064 -0.430 1.00 0.00 H new ATOM 0 HA GLU A 413 -6.036 12.770 -2.586 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.263 13.004 0.119 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -6.608 14.454 -0.616 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -8.999 14.198 -1.151 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -8.018 14.154 -2.602 1.00 0.00 H new ATOM 1247 N SER A 414 -3.839 12.591 -0.153 1.00 0.00 N ATOM 1248 CA SER A 414 -2.431 12.878 0.116 1.00 0.00 C ATOM 1249 C SER A 414 -1.529 12.191 -0.909 1.00 0.00 C ATOM 1250 O SER A 414 -0.508 12.726 -1.331 1.00 0.00 O ATOM 1251 CB SER A 414 -2.091 12.344 1.498 1.00 0.00 C ATOM 1252 OG SER A 414 -0.794 12.752 1.870 1.00 0.00 O ATOM 0 H SER A 414 -4.287 11.996 0.544 1.00 0.00 H new ATOM 0 HA SER A 414 -2.270 13.954 0.057 1.00 0.00 H new ATOM 0 HB2 SER A 414 -2.817 12.707 2.225 1.00 0.00 H new ATOM 0 HB3 SER A 414 -2.153 11.256 1.501 1.00 0.00 H new ATOM 0 HG SER A 414 -0.842 13.289 2.689 1.00 0.00 H new ATOM 1258 N LEU A 415 -1.907 10.987 -1.324 1.00 0.00 N ATOM 1259 CA LEU A 415 -1.259 10.250 -2.404 1.00 0.00 C ATOM 1260 C LEU A 415 -1.188 11.086 -3.678 1.00 0.00 C ATOM 1261 O LEU A 415 -0.195 10.972 -4.398 1.00 0.00 O ATOM 1262 CB LEU A 415 -1.940 8.895 -2.671 1.00 0.00 C ATOM 1263 CG LEU A 415 -1.186 7.720 -2.053 1.00 0.00 C ATOM 1264 CD1 LEU A 415 -2.106 6.489 -2.044 1.00 0.00 C ATOM 1265 CD2 LEU A 415 0.105 7.447 -2.838 1.00 0.00 C ATOM 0 H LEU A 415 -2.691 10.484 -0.909 1.00 0.00 H new ATOM 0 HA LEU A 415 -0.240 10.040 -2.078 1.00 0.00 H new ATOM 0 HB2 LEU A 415 -2.954 8.919 -2.273 1.00 0.00 H new ATOM 0 HB3 LEU A 415 -2.023 8.741 -3.747 1.00 0.00 H new ATOM 0 HG LEU A 415 -0.902 7.956 -1.027 1.00 0.00 H new ATOM 0 HD11 LEU A 415 -1.578 5.643 -1.604 1.00 0.00 H new ATOM 0 HD12 LEU A 415 -2.998 6.705 -1.455 1.00 0.00 H new ATOM 0 HD13 LEU A 415 -2.396 6.244 -3.066 1.00 0.00 H new ATOM 0 HD21 LEU A 415 0.634 6.607 -2.388 1.00 0.00 H new ATOM 0 HD22 LEU A 415 -0.142 7.208 -3.872 1.00 0.00 H new ATOM 0 HD23 LEU A 415 0.741 8.332 -2.812 1.00 0.00 H new