USER MOD reduce.3.24.130724 H: found=0, std=0, add=760, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 761 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 76 SER OG : rot -110:sc= 0.35 USER MOD Set 1.2: A 80 CYS SG : rot -78:sc= 0.86 USER MOD Set 1.3: A 82 THR OG1 : rot 138:sc= 0.969 USER MOD Single : A 19 THR OG1 : rot -36:sc= 0.0489 USER MOD Single : A 20 LYS NZ :NH3+ -152:sc= 1.2 (180deg=0.663) USER MOD Single : A 22 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0267) USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 ASN :FLIP amide:sc= 0.637 F(o=0,f=0.64) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -177:sc= 0 (180deg=-0.0208) USER MOD Single : A 41 THR OG1 : rot -61:sc= 1.43 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HD1:sc= 0.893 K(o=0.89,f=-2.7!) USER MOD Single : A 59 TYR OH : rot 178:sc= 0.58 USER MOD Single : A 61 CYS SG : rot 180:sc= -0.339 USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 ASN : amide:sc= -0.131 K(o=-0.13,f=-2.3!) USER MOD Single : A 73 SER OG : rot -92:sc= 0.374 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 CYS SG : rot 90:sc= 0.838 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 99 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 102 GLN : amide:sc= 0.726 K(o=0.73,f=-0.15) USER MOD Single : A 105 MET CE :methyl 179:sc= 0 (180deg=-0.00046) USER MOD Single : A 140 HIS : no HD1:sc= 0.00032 X(o=0.00032,f=-0.037) USER MOD Single : A 143 CYS SG : rot 170:sc= -0.0291 USER MOD Single : A 145 ASN : amide:sc= 0.639 K(o=0.64,f=0) USER MOD Single : A 147 ASN : amide:sc= 0 K(o=0,f=-1.9) USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 233 N THR A 19 6.997 0.269 -12.182 1.00 0.00 N ATOM 234 CA THR A 19 6.366 1.580 -11.896 1.00 0.00 C ATOM 235 C THR A 19 4.915 1.486 -11.424 1.00 0.00 C ATOM 236 O THR A 19 4.296 2.509 -11.134 1.00 0.00 O ATOM 237 CB THR A 19 6.470 2.519 -13.109 1.00 0.00 C ATOM 238 OG1 THR A 19 5.800 1.958 -14.217 1.00 0.00 O ATOM 239 CG2 THR A 19 7.919 2.776 -13.521 1.00 0.00 C ATOM 0 HA THR A 19 6.931 1.995 -11.062 1.00 0.00 H new ATOM 0 HB THR A 19 6.014 3.463 -12.810 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.922 0.986 -14.215 1.00 0.00 H new ATOM 0 HG21 THR A 19 7.939 3.445 -14.382 1.00 0.00 H new ATOM 0 HG22 THR A 19 8.457 3.235 -12.692 1.00 0.00 H new ATOM 0 HG23 THR A 19 8.396 1.832 -13.784 1.00 0.00 H new ATOM 247 N LYS A 20 4.380 0.269 -11.329 1.00 0.00 N ATOM 248 CA LYS A 20 2.971 -0.044 -11.062 1.00 0.00 C ATOM 249 C LYS A 20 2.864 -1.141 -9.983 1.00 0.00 C ATOM 250 O LYS A 20 3.577 -2.146 -10.044 1.00 0.00 O ATOM 251 CB LYS A 20 2.347 -0.480 -12.401 1.00 0.00 C ATOM 252 CG LYS A 20 0.822 -0.623 -12.371 1.00 0.00 C ATOM 253 CD LYS A 20 0.286 -1.328 -13.630 1.00 0.00 C ATOM 254 CE LYS A 20 0.586 -0.619 -14.961 1.00 0.00 C ATOM 255 NZ LYS A 20 -0.160 0.657 -15.123 1.00 0.00 N ATOM 0 H LYS A 20 4.946 -0.572 -11.442 1.00 0.00 H new ATOM 0 HA LYS A 20 2.434 0.821 -10.673 1.00 0.00 H new ATOM 0 HB2 LYS A 20 2.617 0.247 -13.167 1.00 0.00 H new ATOM 0 HB3 LYS A 20 2.784 -1.434 -12.698 1.00 0.00 H new ATOM 0 HG2 LYS A 20 0.528 -1.187 -11.486 1.00 0.00 H new ATOM 0 HG3 LYS A 20 0.367 0.364 -12.286 1.00 0.00 H new ATOM 0 HD2 LYS A 20 0.707 -2.333 -13.670 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -0.794 -1.438 -13.532 1.00 0.00 H new ATOM 0 HE2 LYS A 20 1.655 -0.419 -15.026 1.00 0.00 H new ATOM 0 HE3 LYS A 20 0.336 -1.286 -15.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -0.312 0.844 -16.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -1.079 0.585 -14.642 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.389 1.435 -14.706 1.00 0.00 H new ATOM 269 N PHE A 21 1.973 -0.966 -9.001 1.00 0.00 N ATOM 270 CA PHE A 21 1.907 -1.792 -7.790 1.00 0.00 C ATOM 271 C PHE A 21 0.459 -2.076 -7.378 1.00 0.00 C ATOM 272 O PHE A 21 -0.346 -1.160 -7.219 1.00 0.00 O ATOM 273 CB PHE A 21 2.651 -1.072 -6.649 1.00 0.00 C ATOM 274 CG PHE A 21 4.107 -0.749 -6.933 1.00 0.00 C ATOM 275 CD1 PHE A 21 4.451 0.462 -7.568 1.00 0.00 C ATOM 276 CD2 PHE A 21 5.120 -1.659 -6.572 1.00 0.00 C ATOM 277 CE1 PHE A 21 5.796 0.749 -7.856 1.00 0.00 C ATOM 278 CE2 PHE A 21 6.467 -1.362 -6.848 1.00 0.00 C ATOM 279 CZ PHE A 21 6.806 -0.159 -7.493 1.00 0.00 C ATOM 0 H PHE A 21 1.264 -0.233 -9.026 1.00 0.00 H new ATOM 0 HA PHE A 21 2.381 -2.751 -7.999 1.00 0.00 H new ATOM 0 HB2 PHE A 21 2.126 -0.144 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 21 2.600 -1.693 -5.754 1.00 0.00 H new ATOM 0 HD1 PHE A 21 3.680 1.170 -7.833 1.00 0.00 H new ATOM 0 HD2 PHE A 21 4.862 -2.586 -6.082 1.00 0.00 H new ATOM 0 HE1 PHE A 21 6.055 1.670 -8.358 1.00 0.00 H new ATOM 0 HE2 PHE A 21 7.242 -2.059 -6.564 1.00 0.00 H new ATOM 0 HZ PHE A 21 7.840 0.067 -7.709 1.00 0.00 H new ATOM 289 N LYS A 22 0.130 -3.350 -7.150 1.00 0.00 N ATOM 290 CA LYS A 22 -1.147 -3.750 -6.545 1.00 0.00 C ATOM 291 C LYS A 22 -1.230 -3.243 -5.094 1.00 0.00 C ATOM 292 O LYS A 22 -0.292 -3.429 -4.317 1.00 0.00 O ATOM 293 CB LYS A 22 -1.291 -5.284 -6.578 1.00 0.00 C ATOM 294 CG LYS A 22 -1.221 -5.933 -7.969 1.00 0.00 C ATOM 295 CD LYS A 22 -2.338 -5.480 -8.922 1.00 0.00 C ATOM 296 CE LYS A 22 -2.293 -6.224 -10.268 1.00 0.00 C ATOM 297 NZ LYS A 22 -2.661 -7.662 -10.143 1.00 0.00 N ATOM 0 H LYS A 22 0.740 -4.135 -7.379 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.961 -3.306 -7.119 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -0.507 -5.717 -5.956 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -2.244 -5.550 -6.121 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -0.256 -5.701 -8.419 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -1.269 -7.016 -7.857 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -3.306 -5.647 -8.449 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -2.250 -4.408 -9.099 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -2.972 -5.739 -10.969 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -1.291 -6.145 -10.689 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -2.713 -8.090 -11.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -1.941 -8.157 -9.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -3.586 -7.744 -9.674 1.00 0.00 H new ATOM 311 N VAL A 23 -2.351 -2.624 -4.727 1.00 0.00 N ATOM 312 CA VAL A 23 -2.598 -2.045 -3.391 1.00 0.00 C ATOM 313 C VAL A 23 -4.045 -2.285 -2.949 1.00 0.00 C ATOM 314 O VAL A 23 -4.912 -2.529 -3.787 1.00 0.00 O ATOM 315 CB VAL A 23 -2.264 -0.534 -3.331 1.00 0.00 C ATOM 316 CG1 VAL A 23 -0.759 -0.257 -3.473 1.00 0.00 C ATOM 317 CG2 VAL A 23 -3.050 0.316 -4.342 1.00 0.00 C ATOM 0 H VAL A 23 -3.140 -2.504 -5.363 1.00 0.00 H new ATOM 0 HA VAL A 23 -1.926 -2.556 -2.701 1.00 0.00 H new ATOM 0 HB VAL A 23 -2.583 -0.228 -2.335 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -0.581 0.817 -3.424 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -0.220 -0.752 -2.665 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -0.407 -0.640 -4.431 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.762 1.362 -4.239 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -2.828 -0.024 -5.354 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -4.118 0.213 -4.151 1.00 0.00 H new ATOM 327 N THR A 24 -4.314 -2.200 -1.641 1.00 0.00 N ATOM 328 CA THR A 24 -5.661 -2.314 -1.060 1.00 0.00 C ATOM 329 C THR A 24 -5.790 -1.321 0.082 1.00 0.00 C ATOM 330 O THR A 24 -4.988 -1.349 1.010 1.00 0.00 O ATOM 331 CB THR A 24 -5.928 -3.751 -0.588 1.00 0.00 C ATOM 332 OG1 THR A 24 -5.856 -4.617 -1.700 1.00 0.00 O ATOM 333 CG2 THR A 24 -7.329 -3.933 -0.004 1.00 0.00 C ATOM 0 H THR A 24 -3.588 -2.047 -0.941 1.00 0.00 H new ATOM 0 HA THR A 24 -6.410 -2.081 -1.817 1.00 0.00 H new ATOM 0 HB THR A 24 -5.185 -3.969 0.179 1.00 0.00 H new ATOM 0 HG1 THR A 24 -6.023 -5.538 -1.409 1.00 0.00 H new ATOM 0 HG21 THR A 24 -7.460 -4.968 0.312 1.00 0.00 H new ATOM 0 HG22 THR A 24 -7.454 -3.273 0.854 1.00 0.00 H new ATOM 0 HG23 THR A 24 -8.074 -3.688 -0.762 1.00 0.00 H new ATOM 341 N ASN A 25 -6.778 -0.430 0.012 1.00 0.00 N ATOM 342 CA ASN A 25 -7.032 0.565 1.060 1.00 0.00 C ATOM 343 C ASN A 25 -7.591 -0.112 2.326 1.00 0.00 C ATOM 344 O ASN A 25 -8.412 -1.029 2.221 1.00 0.00 O ATOM 345 CB ASN A 25 -7.978 1.644 0.506 1.00 0.00 C ATOM 346 CG ASN A 25 -8.221 2.796 1.481 1.00 0.00 C ATOM 347 OD1 ASN A 25 -7.185 3.470 1.949 1.00 0.00 O flip ATOM 348 ND2 ASN A 25 -9.350 3.101 1.835 1.00 0.00 N flip ATOM 0 H ASN A 25 -7.427 -0.375 -0.773 1.00 0.00 H new ATOM 0 HA ASN A 25 -6.099 1.047 1.353 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -7.561 2.042 -0.419 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -8.933 1.184 0.253 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -10.154 2.585 1.477 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -9.489 3.872 2.488 1.00 0.00 H new ATOM 355 N VAL A 26 -7.150 0.326 3.511 1.00 0.00 N ATOM 356 CA VAL A 26 -7.497 -0.315 4.794 1.00 0.00 C ATOM 357 C VAL A 26 -7.776 0.691 5.913 1.00 0.00 C ATOM 358 O VAL A 26 -7.235 1.798 5.919 1.00 0.00 O ATOM 359 CB VAL A 26 -6.427 -1.332 5.270 1.00 0.00 C ATOM 360 CG1 VAL A 26 -6.255 -2.512 4.302 1.00 0.00 C ATOM 361 CG2 VAL A 26 -5.042 -0.711 5.528 1.00 0.00 C ATOM 0 H VAL A 26 -6.540 1.137 3.612 1.00 0.00 H new ATOM 0 HA VAL A 26 -8.419 -0.857 4.585 1.00 0.00 H new ATOM 0 HB VAL A 26 -6.824 -1.691 6.220 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -5.494 -3.190 4.687 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -7.201 -3.045 4.206 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.948 -2.139 3.325 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -4.351 -1.487 5.857 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.669 -0.259 4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -5.124 0.053 6.301 1.00 0.00 H new ATOM 371 N ASP A 27 -8.615 0.278 6.867 1.00 0.00 N ATOM 372 CA ASP A 27 -8.848 0.986 8.131 1.00 0.00 C ATOM 373 C ASP A 27 -7.683 0.801 9.127 1.00 0.00 C ATOM 374 O ASP A 27 -6.723 0.074 8.869 1.00 0.00 O ATOM 375 CB ASP A 27 -10.162 0.516 8.776 1.00 0.00 C ATOM 376 CG ASP A 27 -11.375 0.498 7.836 1.00 0.00 C ATOM 377 OD1 ASP A 27 -12.081 1.529 7.738 1.00 0.00 O ATOM 378 OD2 ASP A 27 -11.644 -0.577 7.255 1.00 0.00 O ATOM 0 H ASP A 27 -9.164 -0.577 6.781 1.00 0.00 H new ATOM 0 HA ASP A 27 -8.917 2.048 7.893 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -10.015 -0.488 9.175 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -10.387 1.165 9.622 1.00 0.00 H new ATOM 383 N ASP A 28 -7.799 1.406 10.315 1.00 0.00 N ATOM 384 CA ASP A 28 -6.843 1.248 11.422 1.00 0.00 C ATOM 385 C ASP A 28 -6.799 -0.192 11.993 1.00 0.00 C ATOM 386 O ASP A 28 -5.811 -0.596 12.605 1.00 0.00 O ATOM 387 CB ASP A 28 -7.196 2.284 12.502 1.00 0.00 C ATOM 388 CG ASP A 28 -6.188 2.320 13.665 1.00 0.00 C ATOM 389 OD1 ASP A 28 -4.964 2.362 13.403 1.00 0.00 O ATOM 390 OD2 ASP A 28 -6.633 2.369 14.837 1.00 0.00 O ATOM 0 H ASP A 28 -8.573 2.031 10.540 1.00 0.00 H new ATOM 0 HA ASP A 28 -5.835 1.423 11.045 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -7.248 3.272 12.045 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.188 2.063 12.897 1.00 0.00 H new ATOM 395 N GLU A 29 -7.842 -0.989 11.730 1.00 0.00 N ATOM 396 CA GLU A 29 -7.912 -2.428 12.028 1.00 0.00 C ATOM 397 C GLU A 29 -7.312 -3.308 10.904 1.00 0.00 C ATOM 398 O GLU A 29 -7.269 -4.534 11.034 1.00 0.00 O ATOM 399 CB GLU A 29 -9.379 -2.818 12.302 1.00 0.00 C ATOM 400 CG GLU A 29 -9.951 -2.240 13.605 1.00 0.00 C ATOM 401 CD GLU A 29 -9.325 -2.894 14.847 1.00 0.00 C ATOM 402 OE1 GLU A 29 -9.689 -4.046 15.177 1.00 0.00 O ATOM 403 OE2 GLU A 29 -8.475 -2.256 15.515 1.00 0.00 O ATOM 0 H GLU A 29 -8.692 -0.639 11.288 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.304 -2.613 12.913 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -9.995 -2.482 11.468 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.454 -3.905 12.336 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -9.774 -1.165 13.633 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -11.031 -2.386 13.623 1.00 0.00 H new ATOM 410 N GLY A 30 -6.861 -2.716 9.787 1.00 0.00 N ATOM 411 CA GLY A 30 -6.231 -3.417 8.653 1.00 0.00 C ATOM 412 C GLY A 30 -7.209 -4.163 7.737 1.00 0.00 C ATOM 413 O GLY A 30 -6.773 -4.955 6.900 1.00 0.00 O ATOM 0 H GLY A 30 -6.926 -1.708 9.642 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.678 -2.691 8.057 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -5.504 -4.130 9.043 1.00 0.00 H new ATOM 417 N VAL A 31 -8.514 -3.921 7.886 1.00 0.00 N ATOM 418 CA VAL A 31 -9.598 -4.566 7.118 1.00 0.00 C ATOM 419 C VAL A 31 -9.575 -4.081 5.666 1.00 0.00 C ATOM 420 O VAL A 31 -9.582 -2.879 5.412 1.00 0.00 O ATOM 421 CB VAL A 31 -10.989 -4.294 7.744 1.00 0.00 C ATOM 422 CG1 VAL A 31 -12.127 -4.954 6.944 1.00 0.00 C ATOM 423 CG2 VAL A 31 -11.053 -4.809 9.193 1.00 0.00 C ATOM 0 H VAL A 31 -8.864 -3.248 8.567 1.00 0.00 H new ATOM 0 HA VAL A 31 -9.426 -5.642 7.146 1.00 0.00 H new ATOM 0 HB VAL A 31 -11.124 -3.213 7.723 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -13.082 -4.735 7.422 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -12.132 -4.562 5.927 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -11.974 -6.033 6.916 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -12.040 -4.605 9.608 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -10.869 -5.883 9.206 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -10.296 -4.304 9.793 1.00 0.00 H new ATOM 433 N GLU A 32 -9.557 -5.026 4.724 1.00 0.00 N ATOM 434 CA GLU A 32 -9.539 -4.769 3.279 1.00 0.00 C ATOM 435 C GLU A 32 -10.876 -4.169 2.809 1.00 0.00 C ATOM 436 O GLU A 32 -11.905 -4.851 2.794 1.00 0.00 O ATOM 437 CB GLU A 32 -9.227 -6.072 2.524 1.00 0.00 C ATOM 438 CG GLU A 32 -7.808 -6.593 2.797 1.00 0.00 C ATOM 439 CD GLU A 32 -7.588 -7.963 2.138 1.00 0.00 C ATOM 440 OE1 GLU A 32 -7.274 -8.019 0.925 1.00 0.00 O ATOM 441 OE2 GLU A 32 -7.724 -8.999 2.832 1.00 0.00 O ATOM 0 H GLU A 32 -9.554 -6.021 4.950 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.758 -4.040 3.062 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -9.951 -6.835 2.811 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -9.348 -5.904 1.454 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.076 -5.881 2.417 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -7.647 -6.673 3.872 1.00 0.00 H new ATOM 448 N LEU A 33 -10.857 -2.890 2.416 1.00 0.00 N ATOM 449 CA LEU A 33 -12.038 -2.155 1.941 1.00 0.00 C ATOM 450 C LEU A 33 -12.279 -2.382 0.447 1.00 0.00 C ATOM 451 O LEU A 33 -13.373 -2.776 0.035 1.00 0.00 O ATOM 452 CB LEU A 33 -11.842 -0.653 2.221 1.00 0.00 C ATOM 453 CG LEU A 33 -11.874 -0.278 3.714 1.00 0.00 C ATOM 454 CD1 LEU A 33 -11.409 1.173 3.870 1.00 0.00 C ATOM 455 CD2 LEU A 33 -13.292 -0.460 4.274 1.00 0.00 C ATOM 0 H LEU A 33 -10.007 -2.326 2.419 1.00 0.00 H new ATOM 0 HA LEU A 33 -12.913 -2.525 2.475 1.00 0.00 H new ATOM 0 HB2 LEU A 33 -10.887 -0.338 1.800 1.00 0.00 H new ATOM 0 HB3 LEU A 33 -12.620 -0.094 1.701 1.00 0.00 H new ATOM 0 HG LEU A 33 -11.206 -0.931 4.275 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -11.428 1.450 4.924 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -10.394 1.273 3.487 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -12.074 1.830 3.310 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -13.303 -0.192 5.330 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -13.984 0.183 3.729 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -13.597 -1.500 4.160 1.00 0.00 H new ATOM 467 N GLY A 34 -11.243 -2.133 -0.355 1.00 0.00 N ATOM 468 CA GLY A 34 -11.240 -2.322 -1.806 1.00 0.00 C ATOM 469 C GLY A 34 -9.841 -2.236 -2.404 1.00 0.00 C ATOM 470 O GLY A 34 -9.002 -1.457 -1.947 1.00 0.00 O ATOM 0 H GLY A 34 -10.353 -1.782 -0.000 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -11.674 -3.293 -2.043 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -11.876 -1.567 -2.269 1.00 0.00 H new ATOM 474 N SER A 35 -9.590 -3.036 -3.434 1.00 0.00 N ATOM 475 CA SER A 35 -8.310 -3.080 -4.147 1.00 0.00 C ATOM 476 C SER A 35 -8.178 -1.965 -5.207 1.00 0.00 C ATOM 477 O SER A 35 -9.158 -1.346 -5.637 1.00 0.00 O ATOM 478 CB SER A 35 -8.100 -4.479 -4.745 1.00 0.00 C ATOM 479 OG SER A 35 -9.158 -4.844 -5.625 1.00 0.00 O ATOM 0 H SER A 35 -10.281 -3.686 -3.807 1.00 0.00 H new ATOM 0 HA SER A 35 -7.515 -2.886 -3.427 1.00 0.00 H new ATOM 0 HB2 SER A 35 -7.153 -4.505 -5.285 1.00 0.00 H new ATOM 0 HB3 SER A 35 -8.028 -5.211 -3.940 1.00 0.00 H new ATOM 0 HG SER A 35 -8.988 -5.739 -5.987 1.00 0.00 H new ATOM 485 N GLY A 36 -6.931 -1.687 -5.601 1.00 0.00 N ATOM 486 CA GLY A 36 -6.524 -0.622 -6.517 1.00 0.00 C ATOM 487 C GLY A 36 -5.112 -0.833 -7.057 1.00 0.00 C ATOM 488 O GLY A 36 -4.403 -1.755 -6.641 1.00 0.00 O ATOM 0 H GLY A 36 -6.135 -2.232 -5.269 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -7.226 -0.573 -7.350 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -6.574 0.337 -6.001 1.00 0.00 H new ATOM 492 N VAL A 37 -4.699 0.037 -7.977 1.00 0.00 N ATOM 493 CA VAL A 37 -3.376 -0.018 -8.620 1.00 0.00 C ATOM 494 C VAL A 37 -2.672 1.330 -8.475 1.00 0.00 C ATOM 495 O VAL A 37 -3.069 2.324 -9.081 1.00 0.00 O ATOM 496 CB VAL A 37 -3.489 -0.444 -10.101 1.00 0.00 C ATOM 497 CG1 VAL A 37 -2.111 -0.456 -10.775 1.00 0.00 C ATOM 498 CG2 VAL A 37 -4.120 -1.841 -10.238 1.00 0.00 C ATOM 0 H VAL A 37 -5.276 0.811 -8.305 1.00 0.00 H new ATOM 0 HA VAL A 37 -2.775 -0.776 -8.118 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.131 0.287 -10.593 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -2.218 -0.759 -11.817 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -1.675 0.542 -10.730 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -1.459 -1.160 -10.258 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.184 -2.109 -11.292 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -3.503 -2.572 -9.715 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.120 -1.833 -9.804 1.00 0.00 H new ATOM 508 N MET A 38 -1.609 1.350 -7.674 1.00 0.00 N ATOM 509 CA MET A 38 -0.782 2.525 -7.404 1.00 0.00 C ATOM 510 C MET A 38 0.325 2.654 -8.453 1.00 0.00 C ATOM 511 O MET A 38 0.898 1.662 -8.901 1.00 0.00 O ATOM 512 CB MET A 38 -0.229 2.427 -5.975 1.00 0.00 C ATOM 513 CG MET A 38 0.484 3.709 -5.535 1.00 0.00 C ATOM 514 SD MET A 38 0.948 3.737 -3.785 1.00 0.00 S ATOM 515 CE MET A 38 -0.659 4.090 -3.029 1.00 0.00 C ATOM 0 H MET A 38 -1.288 0.519 -7.177 1.00 0.00 H new ATOM 0 HA MET A 38 -1.382 3.432 -7.474 1.00 0.00 H new ATOM 0 HB2 MET A 38 -1.046 2.214 -5.286 1.00 0.00 H new ATOM 0 HB3 MET A 38 0.465 1.589 -5.914 1.00 0.00 H new ATOM 0 HG2 MET A 38 1.382 3.838 -6.139 1.00 0.00 H new ATOM 0 HG3 MET A 38 -0.164 4.561 -5.741 1.00 0.00 H new ATOM 0 HE1 MET A 38 -0.539 4.193 -1.951 1.00 0.00 H new ATOM 0 HE2 MET A 38 -1.059 5.017 -3.440 1.00 0.00 H new ATOM 0 HE3 MET A 38 -1.348 3.272 -3.240 1.00 0.00 H new ATOM 525 N GLU A 39 0.611 3.888 -8.850 1.00 0.00 N ATOM 526 CA GLU A 39 1.504 4.219 -9.957 1.00 0.00 C ATOM 527 C GLU A 39 2.275 5.513 -9.661 1.00 0.00 C ATOM 528 O GLU A 39 1.696 6.537 -9.292 1.00 0.00 O ATOM 529 CB GLU A 39 0.641 4.313 -11.222 1.00 0.00 C ATOM 530 CG GLU A 39 1.419 4.606 -12.505 1.00 0.00 C ATOM 531 CD GLU A 39 0.527 4.279 -13.707 1.00 0.00 C ATOM 532 OE1 GLU A 39 -0.326 5.120 -14.078 1.00 0.00 O ATOM 533 OE2 GLU A 39 0.635 3.152 -14.244 1.00 0.00 O ATOM 0 H GLU A 39 0.216 4.712 -8.397 1.00 0.00 H new ATOM 0 HA GLU A 39 2.265 3.452 -10.100 1.00 0.00 H new ATOM 0 HB2 GLU A 39 0.100 3.375 -11.347 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -0.105 5.094 -11.079 1.00 0.00 H new ATOM 0 HG2 GLU A 39 1.721 5.653 -12.533 1.00 0.00 H new ATOM 0 HG3 GLU A 39 2.331 4.010 -12.538 1.00 0.00 H new ATOM 540 N LEU A 40 3.601 5.460 -9.805 1.00 0.00 N ATOM 541 CA LEU A 40 4.518 6.554 -9.476 1.00 0.00 C ATOM 542 C LEU A 40 5.244 6.999 -10.754 1.00 0.00 C ATOM 543 O LEU A 40 5.830 6.173 -11.461 1.00 0.00 O ATOM 544 CB LEU A 40 5.511 6.101 -8.382 1.00 0.00 C ATOM 545 CG LEU A 40 5.013 6.199 -6.921 1.00 0.00 C ATOM 546 CD1 LEU A 40 3.903 5.207 -6.546 1.00 0.00 C ATOM 547 CD2 LEU A 40 6.192 5.981 -5.965 1.00 0.00 C ATOM 0 H LEU A 40 4.079 4.633 -10.163 1.00 0.00 H new ATOM 0 HA LEU A 40 3.963 7.405 -9.080 1.00 0.00 H new ATOM 0 HB2 LEU A 40 5.789 5.066 -8.580 1.00 0.00 H new ATOM 0 HB3 LEU A 40 6.418 6.698 -8.475 1.00 0.00 H new ATOM 0 HG LEU A 40 4.582 7.196 -6.831 1.00 0.00 H new ATOM 0 HD11 LEU A 40 3.621 5.353 -5.503 1.00 0.00 H new ATOM 0 HD12 LEU A 40 3.035 5.375 -7.183 1.00 0.00 H new ATOM 0 HD13 LEU A 40 4.264 4.188 -6.685 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.843 6.050 -4.935 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.622 4.994 -6.137 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.950 6.744 -6.143 1.00 0.00 H new ATOM 559 N THR A 41 5.186 8.303 -11.048 1.00 0.00 N ATOM 560 CA THR A 41 5.705 8.928 -12.283 1.00 0.00 C ATOM 561 C THR A 41 6.808 9.941 -11.967 1.00 0.00 C ATOM 562 O THR A 41 7.125 10.180 -10.808 1.00 0.00 O ATOM 563 CB THR A 41 4.556 9.580 -13.067 1.00 0.00 C ATOM 564 OG1 THR A 41 4.075 10.687 -12.341 1.00 0.00 O ATOM 565 CG2 THR A 41 3.396 8.615 -13.346 1.00 0.00 C ATOM 0 H THR A 41 4.763 8.981 -10.414 1.00 0.00 H new ATOM 0 HA THR A 41 6.148 8.151 -12.906 1.00 0.00 H new ATOM 0 HB THR A 41 4.956 9.886 -14.034 1.00 0.00 H new ATOM 0 HG1 THR A 41 3.735 10.386 -11.473 1.00 0.00 H new ATOM 0 HG21 THR A 41 2.616 9.135 -13.902 1.00 0.00 H new ATOM 0 HG22 THR A 41 3.758 7.770 -13.932 1.00 0.00 H new ATOM 0 HG23 THR A 41 2.988 8.253 -12.402 1.00 0.00 H new ATOM 573 N GLN A 42 7.383 10.596 -12.979 1.00 0.00 N ATOM 574 CA GLN A 42 8.296 11.729 -12.754 1.00 0.00 C ATOM 575 C GLN A 42 7.536 13.039 -12.426 1.00 0.00 C ATOM 576 O GLN A 42 8.150 14.097 -12.299 1.00 0.00 O ATOM 577 CB GLN A 42 9.250 11.873 -13.957 1.00 0.00 C ATOM 578 CG GLN A 42 10.606 12.489 -13.559 1.00 0.00 C ATOM 579 CD GLN A 42 11.543 12.694 -14.754 1.00 0.00 C ATOM 580 OE1 GLN A 42 11.775 11.806 -15.569 1.00 0.00 O ATOM 581 NE2 GLN A 42 12.126 13.867 -14.912 1.00 0.00 N ATOM 0 H GLN A 42 7.235 10.365 -13.961 1.00 0.00 H new ATOM 0 HA GLN A 42 8.899 11.522 -11.870 1.00 0.00 H new ATOM 0 HB2 GLN A 42 9.416 10.893 -14.405 1.00 0.00 H new ATOM 0 HB3 GLN A 42 8.780 12.496 -14.718 1.00 0.00 H new ATOM 0 HG2 GLN A 42 10.434 13.448 -13.070 1.00 0.00 H new ATOM 0 HG3 GLN A 42 11.093 11.842 -12.829 1.00 0.00 H new ATOM 0 HE21 GLN A 42 11.947 14.619 -14.247 1.00 0.00 H new ATOM 0 HE22 GLN A 42 12.755 14.022 -15.700 1.00 0.00 H new ATOM 590 N SER A 43 6.205 12.994 -12.282 1.00 0.00 N ATOM 591 CA SER A 43 5.354 14.181 -12.105 1.00 0.00 C ATOM 592 C SER A 43 4.546 14.160 -10.793 1.00 0.00 C ATOM 593 O SER A 43 4.556 15.157 -10.065 1.00 0.00 O ATOM 594 CB SER A 43 4.411 14.320 -13.314 1.00 0.00 C ATOM 595 OG SER A 43 5.115 14.477 -14.545 1.00 0.00 O ATOM 0 H SER A 43 5.680 12.119 -12.285 1.00 0.00 H new ATOM 0 HA SER A 43 6.015 15.045 -12.041 1.00 0.00 H new ATOM 0 HB2 SER A 43 3.772 13.439 -13.375 1.00 0.00 H new ATOM 0 HB3 SER A 43 3.756 15.178 -13.162 1.00 0.00 H new ATOM 0 HG SER A 43 4.473 14.559 -15.281 1.00 0.00 H new ATOM 601 N GLU A 44 3.876 13.050 -10.454 1.00 0.00 N ATOM 602 CA GLU A 44 3.066 12.899 -9.245 1.00 0.00 C ATOM 603 C GLU A 44 2.778 11.424 -8.905 1.00 0.00 C ATOM 604 O GLU A 44 2.991 10.517 -9.718 1.00 0.00 O ATOM 605 CB GLU A 44 1.749 13.688 -9.384 1.00 0.00 C ATOM 606 CG GLU A 44 0.849 13.235 -10.541 1.00 0.00 C ATOM 607 CD GLU A 44 1.131 13.921 -11.889 1.00 0.00 C ATOM 608 OE1 GLU A 44 1.214 15.169 -11.941 1.00 0.00 O ATOM 609 OE2 GLU A 44 1.196 13.213 -12.921 1.00 0.00 O ATOM 0 H GLU A 44 3.885 12.210 -11.033 1.00 0.00 H new ATOM 0 HA GLU A 44 3.646 13.306 -8.417 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.190 13.603 -8.452 1.00 0.00 H new ATOM 0 HB3 GLU A 44 1.986 14.743 -9.518 1.00 0.00 H new ATOM 0 HG2 GLU A 44 0.960 12.158 -10.668 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -0.190 13.418 -10.267 1.00 0.00 H new ATOM 616 N LEU A 45 2.229 11.194 -7.707 1.00 0.00 N ATOM 617 CA LEU A 45 1.702 9.901 -7.277 1.00 0.00 C ATOM 618 C LEU A 45 0.295 9.745 -7.871 1.00 0.00 C ATOM 619 O LEU A 45 -0.536 10.636 -7.703 1.00 0.00 O ATOM 620 CB LEU A 45 1.664 9.869 -5.729 1.00 0.00 C ATOM 621 CG LEU A 45 2.044 8.514 -5.101 1.00 0.00 C ATOM 622 CD1 LEU A 45 1.994 8.620 -3.572 1.00 0.00 C ATOM 623 CD2 LEU A 45 1.137 7.366 -5.554 1.00 0.00 C ATOM 0 H LEU A 45 2.138 11.920 -6.996 1.00 0.00 H new ATOM 0 HA LEU A 45 2.328 9.078 -7.620 1.00 0.00 H new ATOM 0 HB2 LEU A 45 2.341 10.633 -5.347 1.00 0.00 H new ATOM 0 HB3 LEU A 45 0.661 10.138 -5.399 1.00 0.00 H new ATOM 0 HG LEU A 45 3.054 8.284 -5.441 1.00 0.00 H new ATOM 0 HD11 LEU A 45 2.263 7.660 -3.132 1.00 0.00 H new ATOM 0 HD12 LEU A 45 2.697 9.383 -3.237 1.00 0.00 H new ATOM 0 HD13 LEU A 45 0.986 8.893 -3.259 1.00 0.00 H new ATOM 0 HD21 LEU A 45 1.457 6.440 -5.077 1.00 0.00 H new ATOM 0 HD22 LEU A 45 0.107 7.583 -5.272 1.00 0.00 H new ATOM 0 HD23 LEU A 45 1.201 7.257 -6.637 1.00 0.00 H new ATOM 635 N VAL A 46 0.025 8.633 -8.552 1.00 0.00 N ATOM 636 CA VAL A 46 -1.280 8.303 -9.152 1.00 0.00 C ATOM 637 C VAL A 46 -1.798 6.994 -8.544 1.00 0.00 C ATOM 638 O VAL A 46 -1.019 6.103 -8.210 1.00 0.00 O ATOM 639 CB VAL A 46 -1.174 8.213 -10.697 1.00 0.00 C ATOM 640 CG1 VAL A 46 -2.531 7.902 -11.357 1.00 0.00 C ATOM 641 CG2 VAL A 46 -0.633 9.525 -11.294 1.00 0.00 C ATOM 0 H VAL A 46 0.726 7.909 -8.710 1.00 0.00 H new ATOM 0 HA VAL A 46 -1.992 9.098 -8.930 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.484 7.395 -10.905 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -2.406 7.849 -12.438 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -2.905 6.947 -10.988 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -3.244 8.690 -11.112 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -0.570 9.432 -12.378 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -1.304 10.345 -11.038 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.358 9.728 -10.889 1.00 0.00 H new ATOM 651 N LEU A 47 -3.118 6.861 -8.391 1.00 0.00 N ATOM 652 CA LEU A 47 -3.755 5.661 -7.851 1.00 0.00 C ATOM 653 C LEU A 47 -5.094 5.410 -8.552 1.00 0.00 C ATOM 654 O LEU A 47 -6.058 6.163 -8.400 1.00 0.00 O ATOM 655 CB LEU A 47 -3.871 5.794 -6.317 1.00 0.00 C ATOM 656 CG LEU A 47 -3.782 4.467 -5.536 1.00 0.00 C ATOM 657 CD1 LEU A 47 -4.112 4.710 -4.062 1.00 0.00 C ATOM 658 CD2 LEU A 47 -4.701 3.367 -6.071 1.00 0.00 C ATOM 0 H LEU A 47 -3.781 7.594 -8.642 1.00 0.00 H new ATOM 0 HA LEU A 47 -3.146 4.779 -8.049 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -3.082 6.458 -5.965 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -4.821 6.274 -6.080 1.00 0.00 H new ATOM 0 HG LEU A 47 -2.758 4.115 -5.662 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -4.048 3.769 -3.515 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -3.402 5.423 -3.643 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -5.122 5.111 -3.977 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -4.580 2.467 -5.469 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -5.737 3.701 -6.019 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -4.442 3.148 -7.107 1.00 0.00 H new ATOM 670 N HIS A 48 -5.130 4.332 -9.330 1.00 0.00 N ATOM 671 CA HIS A 48 -6.283 3.837 -10.079 1.00 0.00 C ATOM 672 C HIS A 48 -7.180 2.946 -9.192 1.00 0.00 C ATOM 673 O HIS A 48 -6.680 2.051 -8.498 1.00 0.00 O ATOM 674 CB HIS A 48 -5.752 3.064 -11.297 1.00 0.00 C ATOM 675 CG HIS A 48 -4.837 3.861 -12.195 1.00 0.00 C ATOM 676 ND1 HIS A 48 -5.252 4.735 -13.201 1.00 0.00 N ATOM 677 CD2 HIS A 48 -3.470 3.825 -12.176 1.00 0.00 C ATOM 678 CE1 HIS A 48 -4.123 5.207 -13.759 1.00 0.00 C ATOM 679 NE2 HIS A 48 -3.038 4.679 -13.167 1.00 0.00 N ATOM 0 H HIS A 48 -4.306 3.745 -9.463 1.00 0.00 H new ATOM 0 HA HIS A 48 -6.905 4.669 -10.410 1.00 0.00 H new ATOM 0 HB2 HIS A 48 -5.217 2.181 -10.946 1.00 0.00 H new ATOM 0 HB3 HIS A 48 -6.599 2.711 -11.885 1.00 0.00 H new ATOM 0 HD2 HIS A 48 -2.850 3.241 -11.513 1.00 0.00 H new ATOM 0 HE1 HIS A 48 -4.092 5.915 -14.574 1.00 0.00 H new ATOM 0 HE2 HIS A 48 -2.067 4.876 -13.409 1.00 0.00 H new ATOM 687 N LEU A 49 -8.494 3.189 -9.218 1.00 0.00 N ATOM 688 CA LEU A 49 -9.506 2.591 -8.333 1.00 0.00 C ATOM 689 C LEU A 49 -10.758 2.179 -9.129 1.00 0.00 C ATOM 690 O LEU A 49 -10.982 2.653 -10.243 1.00 0.00 O ATOM 691 CB LEU A 49 -9.887 3.624 -7.245 1.00 0.00 C ATOM 692 CG LEU A 49 -8.768 4.021 -6.259 1.00 0.00 C ATOM 693 CD1 LEU A 49 -9.215 5.231 -5.431 1.00 0.00 C ATOM 694 CD2 LEU A 49 -8.407 2.863 -5.319 1.00 0.00 C ATOM 0 H LEU A 49 -8.904 3.839 -9.888 1.00 0.00 H new ATOM 0 HA LEU A 49 -9.093 1.694 -7.871 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -10.243 4.527 -7.740 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -10.723 3.224 -6.671 1.00 0.00 H new ATOM 0 HG LEU A 49 -7.882 4.273 -6.842 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -8.423 5.509 -4.736 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.425 6.069 -6.096 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.116 4.977 -4.872 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -7.616 3.179 -4.639 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -9.286 2.574 -4.743 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -8.062 2.012 -5.906 1.00 0.00 H new ATOM 786 N ALA A 54 -9.403 7.710 -11.068 1.00 0.00 N ATOM 787 CA ALA A 54 -8.015 7.660 -10.601 1.00 0.00 C ATOM 788 C ALA A 54 -7.582 8.955 -9.880 1.00 0.00 C ATOM 789 O ALA A 54 -7.728 10.057 -10.416 1.00 0.00 O ATOM 790 CB ALA A 54 -7.104 7.337 -11.792 1.00 0.00 C ATOM 0 HA ALA A 54 -7.928 6.872 -9.853 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -6.068 7.297 -11.457 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -7.386 6.373 -12.215 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -7.210 8.111 -12.552 1.00 0.00 H new ATOM 796 N VAL A 55 -7.038 8.812 -8.671 1.00 0.00 N ATOM 797 CA VAL A 55 -6.694 9.918 -7.761 1.00 0.00 C ATOM 798 C VAL A 55 -5.218 10.283 -7.928 1.00 0.00 C ATOM 799 O VAL A 55 -4.383 9.394 -8.078 1.00 0.00 O ATOM 800 CB VAL A 55 -6.997 9.549 -6.288 1.00 0.00 C ATOM 801 CG1 VAL A 55 -6.643 10.697 -5.329 1.00 0.00 C ATOM 802 CG2 VAL A 55 -8.488 9.222 -6.092 1.00 0.00 C ATOM 0 H VAL A 55 -6.815 7.896 -8.281 1.00 0.00 H new ATOM 0 HA VAL A 55 -7.309 10.780 -8.019 1.00 0.00 H new ATOM 0 HB VAL A 55 -6.384 8.676 -6.062 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.870 10.399 -4.305 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.581 10.927 -5.413 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -7.227 11.580 -5.588 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -8.670 8.967 -5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -9.090 10.089 -6.364 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -8.762 8.378 -6.725 1.00 0.00 H new ATOM 812 N ARG A 56 -4.902 11.585 -7.894 1.00 0.00 N ATOM 813 CA ARG A 56 -3.537 12.109 -7.998 1.00 0.00 C ATOM 814 C ARG A 56 -3.154 12.943 -6.768 1.00 0.00 C ATOM 815 O ARG A 56 -3.946 13.770 -6.308 1.00 0.00 O ATOM 816 CB ARG A 56 -3.368 12.958 -9.270 1.00 0.00 C ATOM 817 CG ARG A 56 -3.737 12.237 -10.579 1.00 0.00 C ATOM 818 CD ARG A 56 -5.190 12.487 -11.007 1.00 0.00 C ATOM 819 NE ARG A 56 -5.464 11.962 -12.357 1.00 0.00 N ATOM 820 CZ ARG A 56 -5.253 12.588 -13.511 1.00 0.00 C ATOM 821 NH1 ARG A 56 -4.723 13.793 -13.573 1.00 0.00 N ATOM 822 NH2 ARG A 56 -5.580 12.001 -14.642 1.00 0.00 N ATOM 0 H ARG A 56 -5.605 12.317 -7.791 1.00 0.00 H new ATOM 0 HA ARG A 56 -2.870 11.249 -8.051 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -3.984 13.852 -9.178 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -2.332 13.290 -9.334 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -3.067 12.569 -11.372 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -3.579 11.166 -10.455 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -5.865 12.018 -10.291 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -5.396 13.557 -10.985 1.00 0.00 H new ATOM 0 HE ARG A 56 -5.856 11.022 -12.411 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.459 14.279 -12.716 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.577 14.240 -14.478 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.994 11.069 -14.632 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.420 12.478 -15.529 1.00 0.00 H new ATOM 836 N TRP A 57 -1.916 12.782 -6.297 1.00 0.00 N ATOM 837 CA TRP A 57 -1.301 13.588 -5.237 1.00 0.00 C ATOM 838 C TRP A 57 0.093 14.078 -5.687 1.00 0.00 C ATOM 839 O TRP A 57 0.993 13.246 -5.858 1.00 0.00 O ATOM 840 CB TRP A 57 -1.209 12.765 -3.943 1.00 0.00 C ATOM 841 CG TRP A 57 -2.511 12.291 -3.370 1.00 0.00 C ATOM 842 CD1 TRP A 57 -3.410 13.055 -2.712 1.00 0.00 C ATOM 843 CD2 TRP A 57 -3.071 10.942 -3.374 1.00 0.00 C ATOM 844 NE1 TRP A 57 -4.463 12.274 -2.280 1.00 0.00 N ATOM 845 CE2 TRP A 57 -4.289 10.952 -2.631 1.00 0.00 C ATOM 846 CE3 TRP A 57 -2.661 9.708 -3.922 1.00 0.00 C ATOM 847 CZ2 TRP A 57 -5.041 9.789 -2.404 1.00 0.00 C ATOM 848 CZ3 TRP A 57 -3.420 8.542 -3.718 1.00 0.00 C ATOM 849 CH2 TRP A 57 -4.601 8.574 -2.955 1.00 0.00 C ATOM 0 H TRP A 57 -1.290 12.061 -6.655 1.00 0.00 H new ATOM 0 HA TRP A 57 -1.920 14.463 -5.041 1.00 0.00 H new ATOM 0 HB2 TRP A 57 -0.581 11.895 -4.134 1.00 0.00 H new ATOM 0 HB3 TRP A 57 -0.701 13.366 -3.189 1.00 0.00 H new ATOM 0 HD1 TRP A 57 -3.318 14.119 -2.548 1.00 0.00 H new ATOM 0 HE1 TRP A 57 -5.269 12.630 -1.766 1.00 0.00 H new ATOM 0 HE3 TRP A 57 -1.753 9.658 -4.505 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 -5.945 9.828 -1.814 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 -3.092 7.610 -4.153 1.00 0.00 H new ATOM 0 HH2 TRP A 57 -5.167 7.669 -2.793 1.00 0.00 H new ATOM 860 N PRO A 58 0.295 15.395 -5.907 1.00 0.00 N ATOM 861 CA PRO A 58 1.585 15.940 -6.317 1.00 0.00 C ATOM 862 C PRO A 58 2.600 15.823 -5.185 1.00 0.00 C ATOM 863 O PRO A 58 2.275 16.059 -4.022 1.00 0.00 O ATOM 864 CB PRO A 58 1.333 17.398 -6.698 1.00 0.00 C ATOM 865 CG PRO A 58 0.073 17.775 -5.927 1.00 0.00 C ATOM 866 CD PRO A 58 -0.695 16.461 -5.810 1.00 0.00 C ATOM 0 HA PRO A 58 2.003 15.391 -7.161 1.00 0.00 H new ATOM 0 HB2 PRO A 58 2.174 18.033 -6.421 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.190 17.510 -7.773 1.00 0.00 H new ATOM 0 HG2 PRO A 58 0.313 18.186 -4.946 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -0.507 18.531 -6.456 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -1.231 16.408 -4.863 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -1.438 16.374 -6.602 1.00 0.00 H new ATOM 874 N TYR A 59 3.845 15.482 -5.526 1.00 0.00 N ATOM 875 CA TYR A 59 4.887 15.228 -4.522 1.00 0.00 C ATOM 876 C TYR A 59 5.243 16.477 -3.700 1.00 0.00 C ATOM 877 O TYR A 59 5.564 16.375 -2.517 1.00 0.00 O ATOM 878 CB TYR A 59 6.145 14.649 -5.176 1.00 0.00 C ATOM 879 CG TYR A 59 5.976 13.403 -6.028 1.00 0.00 C ATOM 880 CD1 TYR A 59 5.193 12.329 -5.562 1.00 0.00 C ATOM 881 CD2 TYR A 59 6.664 13.283 -7.252 1.00 0.00 C ATOM 882 CE1 TYR A 59 5.096 11.146 -6.311 1.00 0.00 C ATOM 883 CE2 TYR A 59 6.563 12.101 -8.010 1.00 0.00 C ATOM 884 CZ TYR A 59 5.774 11.028 -7.540 1.00 0.00 C ATOM 885 OH TYR A 59 5.637 9.888 -8.267 1.00 0.00 O ATOM 0 H TYR A 59 4.159 15.375 -6.491 1.00 0.00 H new ATOM 0 HA TYR A 59 4.473 14.496 -3.828 1.00 0.00 H new ATOM 0 HB2 TYR A 59 6.590 15.426 -5.798 1.00 0.00 H new ATOM 0 HB3 TYR A 59 6.862 14.423 -4.387 1.00 0.00 H new ATOM 0 HD1 TYR A 59 4.665 12.416 -4.624 1.00 0.00 H new ATOM 0 HD2 TYR A 59 7.271 14.101 -7.610 1.00 0.00 H new ATOM 0 HE1 TYR A 59 4.500 10.324 -5.944 1.00 0.00 H new ATOM 0 HE2 TYR A 59 7.088 12.015 -8.950 1.00 0.00 H new ATOM 0 HH TYR A 59 6.139 9.972 -9.104 1.00 0.00 H new ATOM 895 N LEU A 60 5.085 17.667 -4.292 1.00 0.00 N ATOM 896 CA LEU A 60 5.229 18.955 -3.608 1.00 0.00 C ATOM 897 C LEU A 60 4.170 19.201 -2.516 1.00 0.00 C ATOM 898 O LEU A 60 4.419 19.999 -1.612 1.00 0.00 O ATOM 899 CB LEU A 60 5.319 20.120 -4.612 1.00 0.00 C ATOM 900 CG LEU A 60 4.181 20.173 -5.652 1.00 0.00 C ATOM 901 CD1 LEU A 60 3.772 21.626 -5.919 1.00 0.00 C ATOM 902 CD2 LEU A 60 4.629 19.515 -6.966 1.00 0.00 C ATOM 0 H LEU A 60 4.849 17.762 -5.280 1.00 0.00 H new ATOM 0 HA LEU A 60 6.178 18.907 -3.073 1.00 0.00 H new ATOM 0 HB2 LEU A 60 5.328 21.058 -4.057 1.00 0.00 H new ATOM 0 HB3 LEU A 60 6.270 20.053 -5.140 1.00 0.00 H new ATOM 0 HG LEU A 60 3.325 19.628 -5.253 1.00 0.00 H new ATOM 0 HD11 LEU A 60 2.968 21.648 -6.655 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.428 22.083 -4.991 1.00 0.00 H new ATOM 0 HD13 LEU A 60 4.629 22.181 -6.301 1.00 0.00 H new ATOM 0 HD21 LEU A 60 3.816 19.559 -7.691 1.00 0.00 H new ATOM 0 HD22 LEU A 60 5.496 20.044 -7.361 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.893 18.474 -6.780 1.00 0.00 H new ATOM 914 N CYS A 61 3.034 18.488 -2.547 1.00 0.00 N ATOM 915 CA CYS A 61 2.033 18.495 -1.467 1.00 0.00 C ATOM 916 C CYS A 61 2.171 17.323 -0.472 1.00 0.00 C ATOM 917 O CYS A 61 1.363 17.234 0.455 1.00 0.00 O ATOM 918 CB CYS A 61 0.628 18.568 -2.085 1.00 0.00 C ATOM 919 SG CYS A 61 0.438 20.145 -2.969 1.00 0.00 S ATOM 0 H CYS A 61 2.781 17.884 -3.329 1.00 0.00 H new ATOM 0 HA CYS A 61 2.213 19.382 -0.859 1.00 0.00 H new ATOM 0 HB2 CYS A 61 0.476 17.734 -2.770 1.00 0.00 H new ATOM 0 HB3 CYS A 61 -0.129 18.482 -1.306 1.00 0.00 H new ATOM 0 HG CYS A 61 -0.749 20.208 -3.495 1.00 0.00 H new ATOM 925 N LEU A 62 3.171 16.441 -0.614 1.00 0.00 N ATOM 926 CA LEU A 62 3.439 15.375 0.360 1.00 0.00 C ATOM 927 C LEU A 62 4.358 15.903 1.468 1.00 0.00 C ATOM 928 O LEU A 62 5.563 16.068 1.267 1.00 0.00 O ATOM 929 CB LEU A 62 4.031 14.126 -0.324 1.00 0.00 C ATOM 930 CG LEU A 62 3.128 13.443 -1.371 1.00 0.00 C ATOM 931 CD1 LEU A 62 3.855 12.204 -1.910 1.00 0.00 C ATOM 932 CD2 LEU A 62 1.763 13.025 -0.807 1.00 0.00 C ATOM 0 H LEU A 62 3.815 16.447 -1.405 1.00 0.00 H new ATOM 0 HA LEU A 62 2.496 15.068 0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 62 4.966 14.409 -0.807 1.00 0.00 H new ATOM 0 HB3 LEU A 62 4.278 13.396 0.447 1.00 0.00 H new ATOM 0 HG LEU A 62 2.934 14.168 -2.162 1.00 0.00 H new ATOM 0 HD11 LEU A 62 3.229 11.709 -2.652 1.00 0.00 H new ATOM 0 HD12 LEU A 62 4.795 12.506 -2.371 1.00 0.00 H new ATOM 0 HD13 LEU A 62 4.058 11.516 -1.090 1.00 0.00 H new ATOM 0 HD21 LEU A 62 1.175 12.550 -1.592 1.00 0.00 H new ATOM 0 HD22 LEU A 62 1.908 12.322 0.013 1.00 0.00 H new ATOM 0 HD23 LEU A 62 1.236 13.906 -0.441 1.00 0.00 H new ATOM 944 N ARG A 63 3.788 16.153 2.654 1.00 0.00 N ATOM 945 CA ARG A 63 4.538 16.627 3.829 1.00 0.00 C ATOM 946 C ARG A 63 5.489 15.546 4.367 1.00 0.00 C ATOM 947 O ARG A 63 6.630 15.839 4.737 1.00 0.00 O ATOM 948 CB ARG A 63 3.560 17.069 4.934 1.00 0.00 C ATOM 949 CG ARG A 63 2.786 18.344 4.556 1.00 0.00 C ATOM 950 CD ARG A 63 1.768 18.760 5.630 1.00 0.00 C ATOM 951 NE ARG A 63 2.390 19.012 6.946 1.00 0.00 N ATOM 952 CZ ARG A 63 3.062 20.095 7.327 1.00 0.00 C ATOM 953 NH1 ARG A 63 3.266 21.117 6.521 1.00 0.00 N ATOM 954 NH2 ARG A 63 3.546 20.163 8.548 1.00 0.00 N ATOM 0 H ARG A 63 2.790 16.032 2.828 1.00 0.00 H new ATOM 0 HA ARG A 63 5.144 17.478 3.518 1.00 0.00 H new ATOM 0 HB2 ARG A 63 2.853 16.264 5.133 1.00 0.00 H new ATOM 0 HB3 ARG A 63 4.113 17.243 5.857 1.00 0.00 H new ATOM 0 HG2 ARG A 63 3.492 19.159 4.396 1.00 0.00 H new ATOM 0 HG3 ARG A 63 2.266 18.182 3.612 1.00 0.00 H new ATOM 0 HD2 ARG A 63 1.248 19.660 5.301 1.00 0.00 H new ATOM 0 HD3 ARG A 63 1.016 17.977 5.733 1.00 0.00 H new ATOM 0 HE ARG A 63 2.293 18.272 7.641 1.00 0.00 H new ATOM 0 HH11 ARG A 63 2.903 21.095 5.568 1.00 0.00 H new ATOM 0 HH12 ARG A 63 3.786 21.930 6.850 1.00 0.00 H new ATOM 0 HH21 ARG A 63 3.405 19.388 9.196 1.00 0.00 H new ATOM 0 HH22 ARG A 63 4.062 20.990 8.847 1.00 0.00 H new ATOM 968 N ARG A 64 5.021 14.293 4.381 1.00 0.00 N ATOM 969 CA ARG A 64 5.718 13.121 4.924 1.00 0.00 C ATOM 970 C ARG A 64 5.072 11.817 4.449 1.00 0.00 C ATOM 971 O ARG A 64 3.883 11.766 4.118 1.00 0.00 O ATOM 972 CB ARG A 64 5.816 13.193 6.463 1.00 0.00 C ATOM 973 CG ARG A 64 4.457 13.315 7.175 1.00 0.00 C ATOM 974 CD ARG A 64 4.635 13.430 8.694 1.00 0.00 C ATOM 975 NE ARG A 64 3.347 13.725 9.337 1.00 0.00 N ATOM 976 CZ ARG A 64 3.114 14.015 10.608 1.00 0.00 C ATOM 977 NH1 ARG A 64 4.056 14.023 11.527 1.00 0.00 N ATOM 978 NH2 ARG A 64 1.881 14.308 10.943 1.00 0.00 N ATOM 0 H ARG A 64 4.106 14.057 3.997 1.00 0.00 H new ATOM 0 HA ARG A 64 6.737 13.129 4.537 1.00 0.00 H new ATOM 0 HB2 ARG A 64 6.325 12.300 6.826 1.00 0.00 H new ATOM 0 HB3 ARG A 64 6.436 14.047 6.737 1.00 0.00 H new ATOM 0 HG2 ARG A 64 3.925 14.190 6.801 1.00 0.00 H new ATOM 0 HG3 ARG A 64 3.843 12.445 6.943 1.00 0.00 H new ATOM 0 HD2 ARG A 64 5.043 12.500 9.091 1.00 0.00 H new ATOM 0 HD3 ARG A 64 5.353 14.217 8.924 1.00 0.00 H new ATOM 0 HE ARG A 64 2.529 13.704 8.728 1.00 0.00 H new ATOM 0 HH11 ARG A 64 5.018 13.799 11.273 1.00 0.00 H new ATOM 0 HH12 ARG A 64 3.824 14.253 12.493 1.00 0.00 H new ATOM 0 HH21 ARG A 64 1.146 14.306 10.236 1.00 0.00 H new ATOM 0 HH22 ARG A 64 1.656 14.538 11.911 1.00 0.00 H new ATOM 992 N TYR A 65 5.876 10.761 4.418 1.00 0.00 N ATOM 993 CA TYR A 65 5.555 9.457 3.839 1.00 0.00 C ATOM 994 C TYR A 65 6.376 8.356 4.520 1.00 0.00 C ATOM 995 O TYR A 65 7.502 8.586 4.963 1.00 0.00 O ATOM 996 CB TYR A 65 5.772 9.490 2.317 1.00 0.00 C ATOM 997 CG TYR A 65 7.151 9.940 1.862 1.00 0.00 C ATOM 998 CD1 TYR A 65 8.211 9.014 1.792 1.00 0.00 C ATOM 999 CD2 TYR A 65 7.368 11.279 1.480 1.00 0.00 C ATOM 1000 CE1 TYR A 65 9.482 9.419 1.344 1.00 0.00 C ATOM 1001 CE2 TYR A 65 8.639 11.693 1.036 1.00 0.00 C ATOM 1002 CZ TYR A 65 9.702 10.764 0.968 1.00 0.00 C ATOM 1003 OH TYR A 65 10.929 11.171 0.539 1.00 0.00 O ATOM 0 H TYR A 65 6.815 10.790 4.814 1.00 0.00 H new ATOM 0 HA TYR A 65 4.504 9.228 4.014 1.00 0.00 H new ATOM 0 HB2 TYR A 65 5.585 8.493 1.919 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.028 10.154 1.876 1.00 0.00 H new ATOM 0 HD1 TYR A 65 8.047 7.987 2.084 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.557 11.990 1.528 1.00 0.00 H new ATOM 0 HE1 TYR A 65 10.289 8.703 1.287 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.801 12.721 0.747 1.00 0.00 H new ATOM 0 HH TYR A 65 10.899 12.126 0.321 1.00 0.00 H new ATOM 1013 N GLY A 66 5.792 7.169 4.646 1.00 0.00 N ATOM 1014 CA GLY A 66 6.318 6.074 5.451 1.00 0.00 C ATOM 1015 C GLY A 66 5.872 4.699 4.981 1.00 0.00 C ATOM 1016 O GLY A 66 5.040 4.547 4.085 1.00 0.00 O ATOM 0 H GLY A 66 4.916 6.936 4.178 1.00 0.00 H new ATOM 0 HA2 GLY A 66 7.407 6.117 5.438 1.00 0.00 H new ATOM 0 HA3 GLY A 66 6.005 6.213 6.486 1.00 0.00 H new ATOM 1020 N TYR A 67 6.428 3.679 5.621 1.00 0.00 N ATOM 1021 CA TYR A 67 6.152 2.284 5.290 1.00 0.00 C ATOM 1022 C TYR A 67 6.452 1.341 6.461 1.00 0.00 C ATOM 1023 O TYR A 67 7.258 1.633 7.348 1.00 0.00 O ATOM 1024 CB TYR A 67 6.896 1.874 4.003 1.00 0.00 C ATOM 1025 CG TYR A 67 8.337 1.435 4.196 1.00 0.00 C ATOM 1026 CD1 TYR A 67 9.313 2.356 4.621 1.00 0.00 C ATOM 1027 CD2 TYR A 67 8.695 0.093 3.966 1.00 0.00 C ATOM 1028 CE1 TYR A 67 10.641 1.940 4.833 1.00 0.00 C ATOM 1029 CE2 TYR A 67 10.017 -0.335 4.191 1.00 0.00 C ATOM 1030 CZ TYR A 67 10.996 0.588 4.621 1.00 0.00 C ATOM 1031 OH TYR A 67 12.279 0.173 4.824 1.00 0.00 O ATOM 0 H TYR A 67 7.088 3.795 6.390 1.00 0.00 H new ATOM 0 HA TYR A 67 5.083 2.192 5.098 1.00 0.00 H new ATOM 0 HB2 TYR A 67 6.346 1.061 3.529 1.00 0.00 H new ATOM 0 HB3 TYR A 67 6.880 2.715 3.310 1.00 0.00 H new ATOM 0 HD1 TYR A 67 9.041 3.388 4.785 1.00 0.00 H new ATOM 0 HD2 TYR A 67 7.953 -0.610 3.616 1.00 0.00 H new ATOM 0 HE1 TYR A 67 11.386 2.651 5.157 1.00 0.00 H new ATOM 0 HE2 TYR A 67 10.283 -1.370 4.035 1.00 0.00 H new ATOM 0 HH TYR A 67 12.347 -0.786 4.633 1.00 0.00 H new ATOM 1041 N ASP A 68 5.779 0.202 6.449 1.00 0.00 N ATOM 1042 CA ASP A 68 5.948 -0.902 7.396 1.00 0.00 C ATOM 1043 C ASP A 68 6.133 -2.248 6.660 1.00 0.00 C ATOM 1044 O ASP A 68 6.291 -2.287 5.438 1.00 0.00 O ATOM 1045 CB ASP A 68 4.765 -0.898 8.382 1.00 0.00 C ATOM 1046 CG ASP A 68 5.214 -1.283 9.798 1.00 0.00 C ATOM 1047 OD1 ASP A 68 5.490 -2.486 10.022 1.00 0.00 O ATOM 1048 OD2 ASP A 68 5.309 -0.375 10.656 1.00 0.00 O ATOM 0 H ASP A 68 5.065 0.007 5.748 1.00 0.00 H new ATOM 0 HA ASP A 68 6.862 -0.765 7.974 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.308 0.091 8.400 1.00 0.00 H new ATOM 0 HB3 ASP A 68 4.001 -1.596 8.039 1.00 0.00 H new ATOM 1053 N SER A 69 6.137 -3.362 7.394 1.00 0.00 N ATOM 1054 CA SER A 69 6.508 -4.697 6.884 1.00 0.00 C ATOM 1055 C SER A 69 5.593 -5.236 5.755 1.00 0.00 C ATOM 1056 O SER A 69 5.997 -6.105 4.978 1.00 0.00 O ATOM 1057 CB SER A 69 6.545 -5.671 8.075 1.00 0.00 C ATOM 1058 OG SER A 69 7.208 -6.893 7.776 1.00 0.00 O ATOM 0 H SER A 69 5.878 -3.369 8.381 1.00 0.00 H new ATOM 0 HA SER A 69 7.488 -4.605 6.415 1.00 0.00 H new ATOM 0 HB2 SER A 69 7.045 -5.189 8.915 1.00 0.00 H new ATOM 0 HB3 SER A 69 5.525 -5.886 8.392 1.00 0.00 H new ATOM 0 HG SER A 69 7.202 -7.470 8.568 1.00 0.00 H new ATOM 1064 N ASN A 70 4.378 -4.687 5.620 1.00 0.00 N ATOM 1065 CA ASN A 70 3.374 -5.043 4.600 1.00 0.00 C ATOM 1066 C ASN A 70 2.365 -3.904 4.314 1.00 0.00 C ATOM 1067 O ASN A 70 1.254 -4.142 3.830 1.00 0.00 O ATOM 1068 CB ASN A 70 2.686 -6.362 5.003 1.00 0.00 C ATOM 1069 CG ASN A 70 1.975 -6.315 6.358 1.00 0.00 C ATOM 1070 OD1 ASN A 70 1.488 -5.286 6.814 1.00 0.00 O ATOM 1071 ND2 ASN A 70 1.904 -7.437 7.052 1.00 0.00 N ATOM 0 H ASN A 70 4.051 -3.950 6.245 1.00 0.00 H new ATOM 0 HA ASN A 70 3.889 -5.193 3.651 1.00 0.00 H new ATOM 0 HB2 ASN A 70 1.961 -6.629 4.235 1.00 0.00 H new ATOM 0 HB3 ASN A 70 3.433 -7.155 5.025 1.00 0.00 H new ATOM 0 HD21 ASN A 70 1.446 -7.445 7.963 1.00 0.00 H new ATOM 0 HD22 ASN A 70 2.308 -8.295 6.677 1.00 0.00 H new ATOM 1078 N LEU A 71 2.740 -2.659 4.629 1.00 0.00 N ATOM 1079 CA LEU A 71 1.861 -1.486 4.642 1.00 0.00 C ATOM 1080 C LEU A 71 2.626 -0.245 4.160 1.00 0.00 C ATOM 1081 O LEU A 71 3.778 -0.047 4.532 1.00 0.00 O ATOM 1082 CB LEU A 71 1.342 -1.308 6.088 1.00 0.00 C ATOM 1083 CG LEU A 71 0.160 -0.330 6.254 1.00 0.00 C ATOM 1084 CD1 LEU A 71 -1.153 -0.942 5.750 1.00 0.00 C ATOM 1085 CD2 LEU A 71 -0.016 0.030 7.735 1.00 0.00 C ATOM 0 H LEU A 71 3.699 -2.433 4.891 1.00 0.00 H new ATOM 0 HA LEU A 71 1.018 -1.622 3.965 1.00 0.00 H new ATOM 0 HB2 LEU A 71 1.040 -2.283 6.470 1.00 0.00 H new ATOM 0 HB3 LEU A 71 2.167 -0.963 6.712 1.00 0.00 H new ATOM 0 HG LEU A 71 0.388 0.558 5.665 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -1.963 -0.225 5.883 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -1.057 -1.189 4.693 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -1.373 -1.847 6.316 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -0.852 0.721 7.845 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -0.216 -0.875 8.308 1.00 0.00 H new ATOM 0 HD23 LEU A 71 0.895 0.501 8.106 1.00 0.00 H new ATOM 1097 N PHE A 72 1.985 0.596 3.352 1.00 0.00 N ATOM 1098 CA PHE A 72 2.527 1.859 2.850 1.00 0.00 C ATOM 1099 C PHE A 72 1.564 2.995 3.211 1.00 0.00 C ATOM 1100 O PHE A 72 0.363 2.885 2.971 1.00 0.00 O ATOM 1101 CB PHE A 72 2.724 1.741 1.331 1.00 0.00 C ATOM 1102 CG PHE A 72 3.144 3.036 0.666 1.00 0.00 C ATOM 1103 CD1 PHE A 72 4.433 3.559 0.885 1.00 0.00 C ATOM 1104 CD2 PHE A 72 2.231 3.737 -0.147 1.00 0.00 C ATOM 1105 CE1 PHE A 72 4.802 4.787 0.308 1.00 0.00 C ATOM 1106 CE2 PHE A 72 2.606 4.958 -0.732 1.00 0.00 C ATOM 1107 CZ PHE A 72 3.885 5.487 -0.497 1.00 0.00 C ATOM 0 H PHE A 72 1.040 0.411 3.016 1.00 0.00 H new ATOM 0 HA PHE A 72 3.493 2.079 3.305 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.477 0.979 1.130 1.00 0.00 H new ATOM 0 HB3 PHE A 72 1.794 1.397 0.879 1.00 0.00 H new ATOM 0 HD1 PHE A 72 5.139 3.016 1.497 1.00 0.00 H new ATOM 0 HD2 PHE A 72 1.243 3.336 -0.320 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.788 5.192 0.483 1.00 0.00 H new ATOM 0 HE2 PHE A 72 1.910 5.490 -1.363 1.00 0.00 H new ATOM 0 HZ PHE A 72 4.166 6.433 -0.935 1.00 0.00 H new ATOM 1117 N SER A 73 2.074 4.082 3.788 1.00 0.00 N ATOM 1118 CA SER A 73 1.237 5.204 4.255 1.00 0.00 C ATOM 1119 C SER A 73 1.865 6.586 4.016 1.00 0.00 C ATOM 1120 O SER A 73 3.086 6.740 4.026 1.00 0.00 O ATOM 1121 CB SER A 73 0.900 5.000 5.739 1.00 0.00 C ATOM 1122 OG SER A 73 -0.051 5.944 6.206 1.00 0.00 O ATOM 0 H SER A 73 3.072 4.217 3.948 1.00 0.00 H new ATOM 0 HA SER A 73 0.325 5.197 3.659 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.512 3.992 5.887 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.811 5.081 6.332 1.00 0.00 H new ATOM 0 HG SER A 73 0.415 6.724 6.573 1.00 0.00 H new ATOM 1128 N PHE A 74 1.036 7.616 3.821 1.00 0.00 N ATOM 1129 CA PHE A 74 1.487 8.996 3.579 1.00 0.00 C ATOM 1130 C PHE A 74 0.434 10.055 3.938 1.00 0.00 C ATOM 1131 O PHE A 74 -0.754 9.753 4.082 1.00 0.00 O ATOM 1132 CB PHE A 74 1.953 9.149 2.117 1.00 0.00 C ATOM 1133 CG PHE A 74 0.868 8.913 1.081 1.00 0.00 C ATOM 1134 CD1 PHE A 74 0.051 9.977 0.646 1.00 0.00 C ATOM 1135 CD2 PHE A 74 0.668 7.621 0.561 1.00 0.00 C ATOM 1136 CE1 PHE A 74 -0.966 9.744 -0.299 1.00 0.00 C ATOM 1137 CE2 PHE A 74 -0.344 7.390 -0.385 1.00 0.00 C ATOM 1138 CZ PHE A 74 -1.165 8.449 -0.808 1.00 0.00 C ATOM 0 H PHE A 74 0.021 7.517 3.826 1.00 0.00 H new ATOM 0 HA PHE A 74 2.327 9.177 4.249 1.00 0.00 H new ATOM 0 HB2 PHE A 74 2.355 10.153 1.981 1.00 0.00 H new ATOM 0 HB3 PHE A 74 2.770 8.451 1.935 1.00 0.00 H new ATOM 0 HD1 PHE A 74 0.206 10.971 1.038 1.00 0.00 H new ATOM 0 HD2 PHE A 74 1.294 6.805 0.890 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -1.592 10.559 -0.632 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -0.491 6.399 -0.787 1.00 0.00 H new ATOM 0 HZ PHE A 74 -1.951 8.267 -1.526 1.00 0.00 H new ATOM 1148 N GLU A 75 0.882 11.311 4.050 1.00 0.00 N ATOM 1149 CA GLU A 75 0.020 12.489 4.172 1.00 0.00 C ATOM 1150 C GLU A 75 0.181 13.416 2.969 1.00 0.00 C ATOM 1151 O GLU A 75 1.288 13.842 2.631 1.00 0.00 O ATOM 1152 CB GLU A 75 0.334 13.298 5.440 1.00 0.00 C ATOM 1153 CG GLU A 75 -0.335 12.707 6.678 1.00 0.00 C ATOM 1154 CD GLU A 75 -0.351 13.727 7.821 1.00 0.00 C ATOM 1155 OE1 GLU A 75 0.716 13.951 8.433 1.00 0.00 O ATOM 1156 OE2 GLU A 75 -1.419 14.317 8.105 1.00 0.00 O ATOM 0 H GLU A 75 1.876 11.540 4.058 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.002 12.114 4.224 1.00 0.00 H new ATOM 0 HB2 GLU A 75 1.413 13.329 5.592 1.00 0.00 H new ATOM 0 HB3 GLU A 75 0.001 14.327 5.305 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -1.355 12.406 6.438 1.00 0.00 H new ATOM 0 HG3 GLU A 75 0.197 11.809 6.992 1.00 0.00 H new ATOM 1163 N SER A 76 -0.949 13.782 2.369 1.00 0.00 N ATOM 1164 CA SER A 76 -1.033 14.845 1.364 1.00 0.00 C ATOM 1165 C SER A 76 -1.766 16.061 1.957 1.00 0.00 C ATOM 1166 O SER A 76 -2.724 15.918 2.727 1.00 0.00 O ATOM 1167 CB SER A 76 -1.705 14.336 0.084 1.00 0.00 C ATOM 1168 OG SER A 76 -1.504 15.265 -0.972 1.00 0.00 O ATOM 0 H SER A 76 -1.848 13.343 2.569 1.00 0.00 H new ATOM 0 HA SER A 76 -0.027 15.159 1.087 1.00 0.00 H new ATOM 0 HB2 SER A 76 -1.293 13.365 -0.191 1.00 0.00 H new ATOM 0 HB3 SER A 76 -2.772 14.193 0.256 1.00 0.00 H new ATOM 0 HG SER A 76 -2.354 15.702 -1.190 1.00 0.00 H new ATOM 1174 N GLY A 77 -1.280 17.265 1.639 1.00 0.00 N ATOM 1175 CA GLY A 77 -1.703 18.519 2.267 1.00 0.00 C ATOM 1176 C GLY A 77 -3.123 18.962 1.913 1.00 0.00 C ATOM 1177 O GLY A 77 -3.729 18.505 0.942 1.00 0.00 O ATOM 0 H GLY A 77 -0.566 17.397 0.922 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -1.630 18.411 3.349 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -1.008 19.307 1.978 1.00 0.00 H new ATOM 1181 N ARG A 78 -3.632 19.925 2.689 1.00 0.00 N ATOM 1182 CA ARG A 78 -4.995 20.488 2.604 1.00 0.00 C ATOM 1183 C ARG A 78 -5.406 21.084 1.240 1.00 0.00 C ATOM 1184 O ARG A 78 -6.590 21.354 1.030 1.00 0.00 O ATOM 1185 CB ARG A 78 -5.187 21.509 3.742 1.00 0.00 C ATOM 1186 CG ARG A 78 -4.240 22.719 3.641 1.00 0.00 C ATOM 1187 CD ARG A 78 -4.400 23.680 4.823 1.00 0.00 C ATOM 1188 NE ARG A 78 -5.671 24.425 4.768 1.00 0.00 N ATOM 1189 CZ ARG A 78 -6.036 25.409 5.584 1.00 0.00 C ATOM 1190 NH1 ARG A 78 -5.273 25.814 6.578 1.00 0.00 N ATOM 1191 NH2 ARG A 78 -7.194 26.007 5.404 1.00 0.00 N ATOM 0 H ARG A 78 -3.082 20.358 3.431 1.00 0.00 H new ATOM 0 HA ARG A 78 -5.671 19.640 2.715 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -6.218 21.862 3.734 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -5.028 21.011 4.698 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -3.209 22.368 3.597 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -4.435 23.254 2.711 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -4.351 23.118 5.755 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -3.568 24.384 4.831 1.00 0.00 H new ATOM 0 HE ARG A 78 -6.331 24.161 4.037 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -4.370 25.369 6.741 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -5.585 26.572 7.184 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -7.806 25.715 4.642 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -7.480 26.763 6.027 1.00 0.00 H new ATOM 1205 N ARG A 79 -4.454 21.273 0.317 1.00 0.00 N ATOM 1206 CA ARG A 79 -4.642 21.868 -1.017 1.00 0.00 C ATOM 1207 C ARG A 79 -4.795 20.860 -2.175 1.00 0.00 C ATOM 1208 O ARG A 79 -4.968 21.277 -3.322 1.00 0.00 O ATOM 1209 CB ARG A 79 -3.512 22.886 -1.276 1.00 0.00 C ATOM 1210 CG ARG A 79 -2.112 22.246 -1.339 1.00 0.00 C ATOM 1211 CD ARG A 79 -1.008 23.287 -1.569 1.00 0.00 C ATOM 1212 NE ARG A 79 -1.074 23.868 -2.923 1.00 0.00 N ATOM 1213 CZ ARG A 79 -0.546 25.021 -3.317 1.00 0.00 C ATOM 1214 NH1 ARG A 79 0.127 25.802 -2.496 1.00 0.00 N ATOM 1215 NH2 ARG A 79 -0.689 25.408 -4.566 1.00 0.00 N ATOM 0 H ARG A 79 -3.485 21.003 0.486 1.00 0.00 H new ATOM 0 HA ARG A 79 -5.608 22.373 -1.001 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -3.709 23.404 -2.214 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -3.524 23.639 -0.488 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -1.917 21.711 -0.409 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -2.087 21.509 -2.142 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -1.098 24.081 -0.828 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -0.034 22.822 -1.421 1.00 0.00 H new ATOM 0 HE ARG A 79 -1.576 23.329 -3.629 1.00 0.00 H new ATOM 0 HH11 ARG A 79 0.256 25.527 -1.522 1.00 0.00 H new ATOM 0 HH12 ARG A 79 0.519 26.681 -2.834 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -1.203 24.824 -5.225 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -0.286 26.293 -4.875 1.00 0.00 H new ATOM 1229 N CYS A 80 -4.732 19.551 -1.904 1.00 0.00 N ATOM 1230 CA CYS A 80 -4.893 18.488 -2.914 1.00 0.00 C ATOM 1231 C CYS A 80 -6.371 18.110 -3.165 1.00 0.00 C ATOM 1232 O CYS A 80 -7.277 18.583 -2.475 1.00 0.00 O ATOM 1233 CB CYS A 80 -4.010 17.288 -2.527 1.00 0.00 C ATOM 1234 SG CYS A 80 -4.759 16.347 -1.165 1.00 0.00 S ATOM 0 H CYS A 80 -4.565 19.191 -0.964 1.00 0.00 H new ATOM 0 HA CYS A 80 -4.553 18.866 -3.878 1.00 0.00 H new ATOM 0 HB2 CYS A 80 -3.873 16.638 -3.391 1.00 0.00 H new ATOM 0 HB3 CYS A 80 -3.021 17.639 -2.232 1.00 0.00 H new ATOM 0 HG CYS A 80 -4.553 16.970 -0.043 1.00 0.00 H new ATOM 1240 N GLN A 81 -6.618 17.241 -4.155 1.00 0.00 N ATOM 1241 CA GLN A 81 -7.960 16.873 -4.633 1.00 0.00 C ATOM 1242 C GLN A 81 -8.827 16.169 -3.570 1.00 0.00 C ATOM 1243 O GLN A 81 -10.051 16.325 -3.582 1.00 0.00 O ATOM 1244 CB GLN A 81 -7.794 15.989 -5.888 1.00 0.00 C ATOM 1245 CG GLN A 81 -9.117 15.693 -6.615 1.00 0.00 C ATOM 1246 CD GLN A 81 -8.892 14.889 -7.898 1.00 0.00 C ATOM 1247 OE1 GLN A 81 -8.626 15.429 -8.966 1.00 0.00 O ATOM 1248 NE2 GLN A 81 -8.978 13.574 -7.850 1.00 0.00 N ATOM 0 H GLN A 81 -5.872 16.762 -4.659 1.00 0.00 H new ATOM 0 HA GLN A 81 -8.499 17.790 -4.870 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -7.111 16.481 -6.581 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -7.330 15.046 -5.599 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -9.781 15.140 -5.951 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -9.617 16.631 -6.857 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -9.198 13.109 -6.969 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -8.824 13.022 -8.694 1.00 0.00 H new ATOM 1257 N THR A 82 -8.211 15.421 -2.644 1.00 0.00 N ATOM 1258 CA THR A 82 -8.897 14.652 -1.590 1.00 0.00 C ATOM 1259 C THR A 82 -9.008 15.397 -0.259 1.00 0.00 C ATOM 1260 O THR A 82 -9.621 14.874 0.673 1.00 0.00 O ATOM 1261 CB THR A 82 -8.189 13.310 -1.371 1.00 0.00 C ATOM 1262 OG1 THR A 82 -6.827 13.535 -1.086 1.00 0.00 O ATOM 1263 CG2 THR A 82 -8.271 12.418 -2.606 1.00 0.00 C ATOM 0 H THR A 82 -7.196 15.330 -2.604 1.00 0.00 H new ATOM 0 HA THR A 82 -9.915 14.493 -1.945 1.00 0.00 H new ATOM 0 HB THR A 82 -8.688 12.811 -0.540 1.00 0.00 H new ATOM 0 HG1 THR A 82 -6.541 12.938 -0.363 1.00 0.00 H new ATOM 0 HG21 THR A 82 -7.757 11.477 -2.410 1.00 0.00 H new ATOM 0 HG22 THR A 82 -9.316 12.219 -2.842 1.00 0.00 H new ATOM 0 HG23 THR A 82 -7.798 12.920 -3.450 1.00 0.00 H new ATOM 1271 N GLY A 83 -8.411 16.587 -0.150 1.00 0.00 N ATOM 1272 CA GLY A 83 -8.245 17.308 1.117 1.00 0.00 C ATOM 1273 C GLY A 83 -7.167 16.676 2.007 1.00 0.00 C ATOM 1274 O GLY A 83 -6.506 15.708 1.627 1.00 0.00 O ATOM 0 H GLY A 83 -8.023 17.085 -0.951 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -7.981 18.345 0.911 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.194 17.321 1.653 1.00 0.00 H new ATOM 1278 N GLN A 84 -6.991 17.229 3.208 1.00 0.00 N ATOM 1279 CA GLN A 84 -6.017 16.726 4.181 1.00 0.00 C ATOM 1280 C GLN A 84 -6.453 15.358 4.729 1.00 0.00 C ATOM 1281 O GLN A 84 -7.596 15.186 5.160 1.00 0.00 O ATOM 1282 CB GLN A 84 -5.849 17.756 5.312 1.00 0.00 C ATOM 1283 CG GLN A 84 -4.694 17.401 6.266 1.00 0.00 C ATOM 1284 CD GLN A 84 -4.449 18.453 7.355 1.00 0.00 C ATOM 1285 OE1 GLN A 84 -5.051 19.520 7.405 1.00 0.00 O ATOM 1286 NE2 GLN A 84 -3.541 18.195 8.275 1.00 0.00 N ATOM 0 H GLN A 84 -7.519 18.038 3.535 1.00 0.00 H new ATOM 0 HA GLN A 84 -5.054 16.586 3.690 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -5.669 18.740 4.879 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -6.777 17.822 5.879 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.907 16.443 6.740 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -3.781 17.273 5.685 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -3.028 17.313 8.252 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -3.351 18.877 9.009 1.00 0.00 H new ATOM 1295 N GLY A 85 -5.533 14.388 4.732 1.00 0.00 N ATOM 1296 CA GLY A 85 -5.767 13.052 5.284 1.00 0.00 C ATOM 1297 C GLY A 85 -4.542 12.143 5.243 1.00 0.00 C ATOM 1298 O GLY A 85 -3.626 12.341 4.441 1.00 0.00 O ATOM 0 H GLY A 85 -4.596 14.511 4.347 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -6.100 13.150 6.317 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -6.578 12.578 4.731 1.00 0.00 H new ATOM 1302 N ILE A 86 -4.555 11.122 6.101 1.00 0.00 N ATOM 1303 CA ILE A 86 -3.593 10.010 6.083 1.00 0.00 C ATOM 1304 C ILE A 86 -4.208 8.882 5.250 1.00 0.00 C ATOM 1305 O ILE A 86 -5.258 8.348 5.620 1.00 0.00 O ATOM 1306 CB ILE A 86 -3.280 9.525 7.521 1.00 0.00 C ATOM 1307 CG1 ILE A 86 -2.675 10.644 8.397 1.00 0.00 C ATOM 1308 CG2 ILE A 86 -2.338 8.302 7.476 1.00 0.00 C ATOM 1309 CD1 ILE A 86 -2.619 10.308 9.890 1.00 0.00 C ATOM 0 H ILE A 86 -5.248 11.040 6.845 1.00 0.00 H new ATOM 0 HA ILE A 86 -2.649 10.334 5.645 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.224 9.235 7.982 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -1.666 10.860 8.046 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -3.261 11.553 8.262 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -2.125 7.970 8.492 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -2.817 7.494 6.923 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -1.407 8.578 6.981 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -2.182 11.144 10.435 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -3.628 10.122 10.259 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -2.008 9.418 10.040 1.00 0.00 H new ATOM 1321 N PHE A 87 -3.551 8.512 4.151 1.00 0.00 N ATOM 1322 CA PHE A 87 -3.977 7.429 3.265 1.00 0.00 C ATOM 1323 C PHE A 87 -2.993 6.261 3.377 1.00 0.00 C ATOM 1324 O PHE A 87 -1.784 6.440 3.210 1.00 0.00 O ATOM 1325 CB PHE A 87 -4.100 7.952 1.827 1.00 0.00 C ATOM 1326 CG PHE A 87 -5.157 9.026 1.654 1.00 0.00 C ATOM 1327 CD1 PHE A 87 -6.522 8.675 1.665 1.00 0.00 C ATOM 1328 CD2 PHE A 87 -4.783 10.375 1.502 1.00 0.00 C ATOM 1329 CE1 PHE A 87 -7.507 9.669 1.530 1.00 0.00 C ATOM 1330 CE2 PHE A 87 -5.769 11.369 1.372 1.00 0.00 C ATOM 1331 CZ PHE A 87 -7.129 11.016 1.387 1.00 0.00 C ATOM 0 H PHE A 87 -2.690 8.966 3.846 1.00 0.00 H new ATOM 0 HA PHE A 87 -4.960 7.062 3.562 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -3.136 8.350 1.512 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -4.332 7.117 1.165 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -6.812 7.641 1.777 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -3.738 10.646 1.485 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -8.553 9.399 1.536 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -5.481 12.404 1.261 1.00 0.00 H new ATOM 0 HZ PHE A 87 -7.885 11.781 1.289 1.00 0.00 H new ATOM 1341 N ALA A 88 -3.522 5.068 3.667 1.00 0.00 N ATOM 1342 CA ALA A 88 -2.740 3.869 3.963 1.00 0.00 C ATOM 1343 C ALA A 88 -3.270 2.641 3.214 1.00 0.00 C ATOM 1344 O ALA A 88 -4.484 2.418 3.106 1.00 0.00 O ATOM 1345 CB ALA A 88 -2.726 3.642 5.477 1.00 0.00 C ATOM 0 H ALA A 88 -4.529 4.908 3.703 1.00 0.00 H new ATOM 0 HA ALA A 88 -1.719 4.020 3.614 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -2.144 2.749 5.706 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -2.276 4.504 5.970 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -3.747 3.511 5.835 1.00 0.00 H new ATOM 1351 N PHE A 89 -2.328 1.847 2.705 1.00 0.00 N ATOM 1352 CA PHE A 89 -2.587 0.748 1.780 1.00 0.00 C ATOM 1353 C PHE A 89 -1.740 -0.481 2.109 1.00 0.00 C ATOM 1354 O PHE A 89 -0.525 -0.389 2.289 1.00 0.00 O ATOM 1355 CB PHE A 89 -2.320 1.211 0.340 1.00 0.00 C ATOM 1356 CG PHE A 89 -3.062 2.467 -0.074 1.00 0.00 C ATOM 1357 CD1 PHE A 89 -2.490 3.734 0.157 1.00 0.00 C ATOM 1358 CD2 PHE A 89 -4.337 2.373 -0.661 1.00 0.00 C ATOM 1359 CE1 PHE A 89 -3.200 4.899 -0.177 1.00 0.00 C ATOM 1360 CE2 PHE A 89 -5.045 3.541 -0.994 1.00 0.00 C ATOM 1361 CZ PHE A 89 -4.482 4.804 -0.745 1.00 0.00 C ATOM 0 H PHE A 89 -1.339 1.955 2.931 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.633 0.459 1.882 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.250 1.383 0.221 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.591 0.405 -0.342 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.504 3.809 0.592 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -4.772 1.404 -0.856 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.760 5.869 0.003 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -6.025 3.467 -1.443 1.00 0.00 H new ATOM 0 HZ PHE A 89 -5.033 5.700 -0.990 1.00 0.00 H new ATOM 1371 N LYS A 90 -2.380 -1.650 2.159 1.00 0.00 N ATOM 1372 CA LYS A 90 -1.726 -2.933 2.401 1.00 0.00 C ATOM 1373 C LYS A 90 -1.107 -3.452 1.095 1.00 0.00 C ATOM 1374 O LYS A 90 -1.769 -3.471 0.052 1.00 0.00 O ATOM 1375 CB LYS A 90 -2.756 -3.890 3.025 1.00 0.00 C ATOM 1376 CG LYS A 90 -2.077 -5.012 3.821 1.00 0.00 C ATOM 1377 CD LYS A 90 -3.123 -5.904 4.500 1.00 0.00 C ATOM 1378 CE LYS A 90 -2.428 -6.850 5.488 1.00 0.00 C ATOM 1379 NZ LYS A 90 -3.401 -7.733 6.184 1.00 0.00 N ATOM 0 H LYS A 90 -3.388 -1.731 2.029 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.900 -2.839 3.107 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -3.423 -3.330 3.681 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -3.373 -4.324 2.238 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.456 -5.612 3.156 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.415 -4.582 4.573 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -3.856 -5.289 5.023 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.667 -6.479 3.751 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -1.699 -7.461 4.955 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.876 -6.265 6.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -2.894 -8.357 6.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -4.081 -7.151 6.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.910 -8.309 5.483 1.00 0.00 H new ATOM 1393 N CYS A 91 0.174 -3.823 1.141 1.00 0.00 N ATOM 1394 CA CYS A 91 0.997 -4.141 -0.028 1.00 0.00 C ATOM 1395 C CYS A 91 2.282 -4.873 0.392 1.00 0.00 C ATOM 1396 O CYS A 91 3.056 -4.360 1.199 1.00 0.00 O ATOM 1397 CB CYS A 91 1.325 -2.823 -0.757 1.00 0.00 C ATOM 1398 SG CYS A 91 2.224 -3.166 -2.297 1.00 0.00 S ATOM 0 H CYS A 91 0.683 -3.913 2.020 1.00 0.00 H new ATOM 0 HA CYS A 91 0.453 -4.807 -0.697 1.00 0.00 H new ATOM 0 HB2 CYS A 91 0.405 -2.282 -0.977 1.00 0.00 H new ATOM 0 HB3 CYS A 91 1.925 -2.182 -0.112 1.00 0.00 H new ATOM 0 HG CYS A 91 1.376 -3.314 -3.271 1.00 0.00 H new ATOM 1404 N SER A 92 2.554 -6.046 -0.180 1.00 0.00 N ATOM 1405 CA SER A 92 3.808 -6.786 0.060 1.00 0.00 C ATOM 1406 C SER A 92 5.050 -6.046 -0.477 1.00 0.00 C ATOM 1407 O SER A 92 6.154 -6.232 0.039 1.00 0.00 O ATOM 1408 CB SER A 92 3.724 -8.178 -0.588 1.00 0.00 C ATOM 1409 OG SER A 92 2.539 -8.871 -0.207 1.00 0.00 O ATOM 0 H SER A 92 1.917 -6.515 -0.823 1.00 0.00 H new ATOM 0 HA SER A 92 3.923 -6.874 1.140 1.00 0.00 H new ATOM 0 HB2 SER A 92 3.752 -8.076 -1.673 1.00 0.00 H new ATOM 0 HB3 SER A 92 4.596 -8.765 -0.301 1.00 0.00 H new ATOM 0 HG SER A 92 2.521 -9.750 -0.640 1.00 0.00 H new ATOM 1415 N ARG A 93 4.859 -5.170 -1.477 1.00 0.00 N ATOM 1416 CA ARG A 93 5.887 -4.351 -2.132 1.00 0.00 C ATOM 1417 C ARG A 93 5.939 -2.901 -1.605 1.00 0.00 C ATOM 1418 O ARG A 93 6.402 -1.987 -2.290 1.00 0.00 O ATOM 1419 CB ARG A 93 5.693 -4.443 -3.657 1.00 0.00 C ATOM 1420 CG ARG A 93 5.988 -5.873 -4.143 1.00 0.00 C ATOM 1421 CD ARG A 93 5.790 -6.042 -5.653 1.00 0.00 C ATOM 1422 NE ARG A 93 4.366 -6.147 -6.026 1.00 0.00 N ATOM 1423 CZ ARG A 93 3.601 -7.232 -5.925 1.00 0.00 C ATOM 1424 NH1 ARG A 93 4.034 -8.353 -5.386 1.00 0.00 N ATOM 1425 NH2 ARG A 93 2.362 -7.204 -6.370 1.00 0.00 N ATOM 0 H ARG A 93 3.932 -5.007 -1.870 1.00 0.00 H new ATOM 0 HA ARG A 93 6.870 -4.750 -1.880 1.00 0.00 H new ATOM 0 HB2 ARG A 93 4.672 -4.165 -3.919 1.00 0.00 H new ATOM 0 HB3 ARG A 93 6.354 -3.737 -4.159 1.00 0.00 H new ATOM 0 HG2 ARG A 93 7.014 -6.135 -3.885 1.00 0.00 H new ATOM 0 HG3 ARG A 93 5.338 -6.572 -3.616 1.00 0.00 H new ATOM 0 HD2 ARG A 93 6.237 -5.194 -6.172 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.317 -6.935 -5.988 1.00 0.00 H new ATOM 0 HE ARG A 93 3.925 -5.306 -6.398 1.00 0.00 H new ATOM 0 HH11 ARG A 93 4.987 -8.412 -5.027 1.00 0.00 H new ATOM 0 HH12 ARG A 93 3.416 -9.163 -5.327 1.00 0.00 H new ATOM 0 HH21 ARG A 93 1.990 -6.352 -6.791 1.00 0.00 H new ATOM 0 HH22 ARG A 93 1.774 -8.034 -6.294 1.00 0.00 H new ATOM 1439 N ALA A 94 5.470 -2.664 -0.372 1.00 0.00 N ATOM 1440 CA ALA A 94 5.484 -1.349 0.283 1.00 0.00 C ATOM 1441 C ALA A 94 6.886 -0.712 0.384 1.00 0.00 C ATOM 1442 O ALA A 94 7.002 0.513 0.316 1.00 0.00 O ATOM 1443 CB ALA A 94 4.859 -1.509 1.674 1.00 0.00 C ATOM 0 H ALA A 94 5.062 -3.396 0.209 1.00 0.00 H new ATOM 0 HA ALA A 94 4.908 -0.661 -0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 94 4.856 -0.546 2.185 1.00 0.00 H new ATOM 0 HB2 ALA A 94 3.835 -1.870 1.574 1.00 0.00 H new ATOM 0 HB3 ALA A 94 5.441 -2.225 2.254 1.00 0.00 H new ATOM 1449 N GLU A 95 7.942 -1.526 0.495 1.00 0.00 N ATOM 1450 CA GLU A 95 9.331 -1.056 0.541 1.00 0.00 C ATOM 1451 C GLU A 95 9.776 -0.508 -0.824 1.00 0.00 C ATOM 1452 O GLU A 95 10.417 0.537 -0.890 1.00 0.00 O ATOM 1453 CB GLU A 95 10.237 -2.204 1.018 1.00 0.00 C ATOM 1454 CG GLU A 95 11.691 -1.764 1.237 1.00 0.00 C ATOM 1455 CD GLU A 95 12.569 -2.912 1.765 1.00 0.00 C ATOM 1456 OE1 GLU A 95 12.242 -3.506 2.820 1.00 0.00 O ATOM 1457 OE2 GLU A 95 13.613 -3.213 1.138 1.00 0.00 O ATOM 0 H GLU A 95 7.855 -2.540 0.556 1.00 0.00 H new ATOM 0 HA GLU A 95 9.410 -0.231 1.249 1.00 0.00 H new ATOM 0 HB2 GLU A 95 9.841 -2.610 1.949 1.00 0.00 H new ATOM 0 HB3 GLU A 95 10.213 -3.009 0.283 1.00 0.00 H new ATOM 0 HG2 GLU A 95 12.103 -1.395 0.298 1.00 0.00 H new ATOM 0 HG3 GLU A 95 11.716 -0.934 1.944 1.00 0.00 H new ATOM 1464 N GLU A 96 9.393 -1.171 -1.917 1.00 0.00 N ATOM 1465 CA GLU A 96 9.678 -0.753 -3.286 1.00 0.00 C ATOM 1466 C GLU A 96 8.934 0.541 -3.651 1.00 0.00 C ATOM 1467 O GLU A 96 9.515 1.403 -4.310 1.00 0.00 O ATOM 1468 CB GLU A 96 9.297 -1.876 -4.264 1.00 0.00 C ATOM 1469 CG GLU A 96 10.201 -3.119 -4.209 1.00 0.00 C ATOM 1470 CD GLU A 96 10.205 -3.897 -2.880 1.00 0.00 C ATOM 1471 OE1 GLU A 96 9.172 -3.926 -2.175 1.00 0.00 O ATOM 1472 OE2 GLU A 96 11.254 -4.500 -2.551 1.00 0.00 O ATOM 0 H GLU A 96 8.860 -2.039 -1.870 1.00 0.00 H new ATOM 0 HA GLU A 96 10.747 -0.551 -3.360 1.00 0.00 H new ATOM 0 HB2 GLU A 96 8.271 -2.182 -4.061 1.00 0.00 H new ATOM 0 HB3 GLU A 96 9.315 -1.476 -5.278 1.00 0.00 H new ATOM 0 HG2 GLU A 96 9.896 -3.800 -5.004 1.00 0.00 H new ATOM 0 HG3 GLU A 96 11.223 -2.810 -4.428 1.00 0.00 H new ATOM 1479 N ILE A 97 7.689 0.725 -3.187 1.00 0.00 N ATOM 1480 CA ILE A 97 6.950 1.990 -3.368 1.00 0.00 C ATOM 1481 C ILE A 97 7.656 3.134 -2.624 1.00 0.00 C ATOM 1482 O ILE A 97 7.900 4.182 -3.221 1.00 0.00 O ATOM 1483 CB ILE A 97 5.465 1.869 -2.938 1.00 0.00 C ATOM 1484 CG1 ILE A 97 4.722 0.767 -3.729 1.00 0.00 C ATOM 1485 CG2 ILE A 97 4.750 3.221 -3.155 1.00 0.00 C ATOM 1486 CD1 ILE A 97 3.347 0.408 -3.147 1.00 0.00 C ATOM 0 H ILE A 97 7.167 0.010 -2.680 1.00 0.00 H new ATOM 0 HA ILE A 97 6.947 2.219 -4.434 1.00 0.00 H new ATOM 0 HB ILE A 97 5.449 1.596 -1.883 1.00 0.00 H new ATOM 0 HG12 ILE A 97 4.595 1.096 -4.760 1.00 0.00 H new ATOM 0 HG13 ILE A 97 5.341 -0.130 -3.754 1.00 0.00 H new ATOM 0 HG21 ILE A 97 3.707 3.134 -2.852 1.00 0.00 H new ATOM 0 HG22 ILE A 97 5.238 3.991 -2.557 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.800 3.494 -4.209 1.00 0.00 H new ATOM 0 HD11 ILE A 97 2.887 -0.371 -3.755 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.467 0.048 -2.125 1.00 0.00 H new ATOM 0 HD13 ILE A 97 2.710 1.292 -3.147 1.00 0.00 H new ATOM 1498 N PHE A 98 8.031 2.931 -1.355 1.00 0.00 N ATOM 1499 CA PHE A 98 8.766 3.919 -0.563 1.00 0.00 C ATOM 1500 C PHE A 98 10.131 4.268 -1.187 1.00 0.00 C ATOM 1501 O PHE A 98 10.471 5.447 -1.313 1.00 0.00 O ATOM 1502 CB PHE A 98 8.898 3.362 0.861 1.00 0.00 C ATOM 1503 CG PHE A 98 9.693 4.226 1.815 1.00 0.00 C ATOM 1504 CD1 PHE A 98 9.051 5.219 2.581 1.00 0.00 C ATOM 1505 CD2 PHE A 98 11.077 4.012 1.964 1.00 0.00 C ATOM 1506 CE1 PHE A 98 9.791 5.983 3.502 1.00 0.00 C ATOM 1507 CE2 PHE A 98 11.816 4.780 2.879 1.00 0.00 C ATOM 1508 CZ PHE A 98 11.172 5.759 3.654 1.00 0.00 C ATOM 0 H PHE A 98 7.830 2.069 -0.847 1.00 0.00 H new ATOM 0 HA PHE A 98 8.220 4.862 -0.542 1.00 0.00 H new ATOM 0 HB2 PHE A 98 7.899 3.217 1.272 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.366 2.379 0.808 1.00 0.00 H new ATOM 0 HD1 PHE A 98 7.992 5.394 2.461 1.00 0.00 H new ATOM 0 HD2 PHE A 98 11.572 3.255 1.373 1.00 0.00 H new ATOM 0 HE1 PHE A 98 9.299 6.742 4.093 1.00 0.00 H new ATOM 0 HE2 PHE A 98 12.878 4.618 2.987 1.00 0.00 H new ATOM 0 HZ PHE A 98 11.737 6.340 4.367 1.00 0.00 H new ATOM 1518 N ASN A 99 10.887 3.260 -1.639 1.00 0.00 N ATOM 1519 CA ASN A 99 12.184 3.441 -2.297 1.00 0.00 C ATOM 1520 C ASN A 99 12.068 4.154 -3.655 1.00 0.00 C ATOM 1521 O ASN A 99 12.946 4.949 -3.996 1.00 0.00 O ATOM 1522 CB ASN A 99 12.893 2.086 -2.462 1.00 0.00 C ATOM 1523 CG ASN A 99 13.445 1.500 -1.162 1.00 0.00 C ATOM 1524 OD1 ASN A 99 13.587 2.165 -0.141 1.00 0.00 O ATOM 1525 ND2 ASN A 99 13.824 0.234 -1.179 1.00 0.00 N ATOM 0 H ASN A 99 10.610 2.282 -1.556 1.00 0.00 H new ATOM 0 HA ASN A 99 12.780 4.086 -1.651 1.00 0.00 H new ATOM 0 HB2 ASN A 99 12.193 1.374 -2.899 1.00 0.00 H new ATOM 0 HB3 ASN A 99 13.713 2.202 -3.171 1.00 0.00 H new ATOM 0 HD21 ASN A 99 14.233 -0.187 -0.345 1.00 0.00 H new ATOM 0 HD22 ASN A 99 13.707 -0.322 -2.026 1.00 0.00 H new ATOM 1532 N LEU A 100 10.984 3.938 -4.409 1.00 0.00 N ATOM 1533 CA LEU A 100 10.712 4.660 -5.651 1.00 0.00 C ATOM 1534 C LEU A 100 10.284 6.109 -5.370 1.00 0.00 C ATOM 1535 O LEU A 100 10.819 7.023 -5.992 1.00 0.00 O ATOM 1536 CB LEU A 100 9.672 3.861 -6.458 1.00 0.00 C ATOM 1537 CG LEU A 100 9.294 4.473 -7.820 1.00 0.00 C ATOM 1538 CD1 LEU A 100 10.511 4.678 -8.735 1.00 0.00 C ATOM 1539 CD2 LEU A 100 8.280 3.559 -8.519 1.00 0.00 C ATOM 0 H LEU A 100 10.268 3.252 -4.170 1.00 0.00 H new ATOM 0 HA LEU A 100 11.618 4.742 -6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 100 10.058 2.855 -6.623 1.00 0.00 H new ATOM 0 HB3 LEU A 100 8.767 3.761 -5.858 1.00 0.00 H new ATOM 0 HG LEU A 100 8.864 5.456 -7.629 1.00 0.00 H new ATOM 0 HD11 LEU A 100 10.186 5.112 -9.681 1.00 0.00 H new ATOM 0 HD12 LEU A 100 11.220 5.350 -8.252 1.00 0.00 H new ATOM 0 HD13 LEU A 100 10.991 3.718 -8.922 1.00 0.00 H new ATOM 0 HD21 LEU A 100 8.009 3.987 -9.484 1.00 0.00 H new ATOM 0 HD22 LEU A 100 8.722 2.574 -8.671 1.00 0.00 H new ATOM 0 HD23 LEU A 100 7.388 3.465 -7.900 1.00 0.00 H new ATOM 1551 N LEU A 101 9.398 6.342 -4.397 1.00 0.00 N ATOM 1552 CA LEU A 101 8.943 7.685 -4.022 1.00 0.00 C ATOM 1553 C LEU A 101 10.102 8.599 -3.609 1.00 0.00 C ATOM 1554 O LEU A 101 10.188 9.724 -4.098 1.00 0.00 O ATOM 1555 CB LEU A 101 7.889 7.566 -2.904 1.00 0.00 C ATOM 1556 CG LEU A 101 7.188 8.897 -2.566 1.00 0.00 C ATOM 1557 CD1 LEU A 101 6.281 9.382 -3.709 1.00 0.00 C ATOM 1558 CD2 LEU A 101 6.341 8.716 -1.304 1.00 0.00 C ATOM 0 H LEU A 101 8.973 5.598 -3.843 1.00 0.00 H new ATOM 0 HA LEU A 101 8.491 8.154 -4.896 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.137 6.836 -3.203 1.00 0.00 H new ATOM 0 HB3 LEU A 101 8.369 7.180 -2.005 1.00 0.00 H new ATOM 0 HG LEU A 101 7.963 9.647 -2.411 1.00 0.00 H new ATOM 0 HD11 LEU A 101 5.809 10.322 -3.425 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.878 9.533 -4.608 1.00 0.00 H new ATOM 0 HD13 LEU A 101 5.512 8.635 -3.905 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.844 9.655 -1.062 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.592 7.943 -1.476 1.00 0.00 H new ATOM 0 HD23 LEU A 101 6.983 8.421 -0.474 1.00 0.00 H new ATOM 1570 N GLN A 102 11.019 8.126 -2.760 1.00 0.00 N ATOM 1571 CA GLN A 102 12.176 8.926 -2.350 1.00 0.00 C ATOM 1572 C GLN A 102 13.181 9.174 -3.482 1.00 0.00 C ATOM 1573 O GLN A 102 13.830 10.218 -3.505 1.00 0.00 O ATOM 1574 CB GLN A 102 12.832 8.342 -1.101 1.00 0.00 C ATOM 1575 CG GLN A 102 13.473 6.962 -1.257 1.00 0.00 C ATOM 1576 CD GLN A 102 14.918 6.987 -1.769 1.00 0.00 C ATOM 1577 OE1 GLN A 102 15.801 7.616 -1.197 1.00 0.00 O ATOM 1578 NE2 GLN A 102 15.233 6.288 -2.841 1.00 0.00 N ATOM 0 H GLN A 102 10.983 7.195 -2.344 1.00 0.00 H new ATOM 0 HA GLN A 102 11.796 9.914 -2.092 1.00 0.00 H new ATOM 0 HB2 GLN A 102 13.597 9.038 -0.759 1.00 0.00 H new ATOM 0 HB3 GLN A 102 12.080 8.283 -0.315 1.00 0.00 H new ATOM 0 HG2 GLN A 102 13.451 6.454 -0.293 1.00 0.00 H new ATOM 0 HG3 GLN A 102 12.868 6.370 -1.943 1.00 0.00 H new ATOM 0 HE21 GLN A 102 14.514 5.757 -3.333 1.00 0.00 H new ATOM 0 HE22 GLN A 102 16.195 6.278 -3.179 1.00 0.00 H new ATOM 1587 N ASP A 103 13.268 8.267 -4.460 1.00 0.00 N ATOM 1588 CA ASP A 103 14.118 8.457 -5.642 1.00 0.00 C ATOM 1589 C ASP A 103 13.621 9.618 -6.516 1.00 0.00 C ATOM 1590 O ASP A 103 14.403 10.412 -7.041 1.00 0.00 O ATOM 1591 CB ASP A 103 14.172 7.189 -6.504 1.00 0.00 C ATOM 1592 CG ASP A 103 15.377 7.220 -7.462 1.00 0.00 C ATOM 1593 OD1 ASP A 103 16.502 7.529 -6.999 1.00 0.00 O ATOM 1594 OD2 ASP A 103 15.194 6.923 -8.666 1.00 0.00 O ATOM 0 H ASP A 103 12.755 7.385 -4.456 1.00 0.00 H new ATOM 0 HA ASP A 103 15.115 8.687 -5.267 1.00 0.00 H new ATOM 0 HB2 ASP A 103 14.237 6.311 -5.861 1.00 0.00 H new ATOM 0 HB3 ASP A 103 13.250 7.096 -7.078 1.00 0.00 H new ATOM 1599 N LEU A 104 12.296 9.727 -6.615 1.00 0.00 N ATOM 1600 CA LEU A 104 11.576 10.751 -7.365 1.00 0.00 C ATOM 1601 C LEU A 104 11.497 12.082 -6.594 1.00 0.00 C ATOM 1602 O LEU A 104 11.216 13.122 -7.193 1.00 0.00 O ATOM 1603 CB LEU A 104 10.202 10.169 -7.739 1.00 0.00 C ATOM 1604 CG LEU A 104 10.295 8.898 -8.622 1.00 0.00 C ATOM 1605 CD1 LEU A 104 8.942 8.174 -8.612 1.00 0.00 C ATOM 1606 CD2 LEU A 104 10.697 9.239 -10.065 1.00 0.00 C ATOM 0 H LEU A 104 11.667 9.071 -6.151 1.00 0.00 H new ATOM 0 HA LEU A 104 12.111 11.007 -8.280 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.656 9.930 -6.827 1.00 0.00 H new ATOM 0 HB3 LEU A 104 9.625 10.928 -8.267 1.00 0.00 H new ATOM 0 HG LEU A 104 11.068 8.250 -8.209 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.003 7.280 -9.232 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.688 7.891 -7.590 1.00 0.00 H new ATOM 0 HD13 LEU A 104 8.172 8.837 -9.007 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.752 8.323 -10.653 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.954 9.907 -10.501 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.670 9.729 -10.065 1.00 0.00 H new ATOM 1618 N MET A 105 11.813 12.071 -5.291 1.00 0.00 N ATOM 1619 CA MET A 105 12.027 13.273 -4.474 1.00 0.00 C ATOM 1620 C MET A 105 13.467 13.803 -4.549 1.00 0.00 C ATOM 1621 O MET A 105 13.668 15.001 -4.335 1.00 0.00 O ATOM 1622 CB MET A 105 11.635 13.005 -3.012 1.00 0.00 C ATOM 1623 CG MET A 105 10.120 12.864 -2.851 1.00 0.00 C ATOM 1624 SD MET A 105 9.223 14.385 -3.244 1.00 0.00 S ATOM 1625 CE MET A 105 8.478 14.765 -1.646 1.00 0.00 C ATOM 0 H MET A 105 11.929 11.205 -4.764 1.00 0.00 H new ATOM 0 HA MET A 105 11.384 14.049 -4.889 1.00 0.00 H new ATOM 0 HB2 MET A 105 12.124 12.095 -2.665 1.00 0.00 H new ATOM 0 HB3 MET A 105 11.994 13.820 -2.383 1.00 0.00 H new ATOM 0 HG2 MET A 105 9.765 12.062 -3.498 1.00 0.00 H new ATOM 0 HG3 MET A 105 9.895 12.571 -1.826 1.00 0.00 H new ATOM 0 HE1 MET A 105 7.905 15.689 -1.722 1.00 0.00 H new ATOM 0 HE2 MET A 105 7.816 13.951 -1.350 1.00 0.00 H new ATOM 0 HE3 MET A 105 9.262 14.885 -0.898 1.00 0.00 H new ATOM 2019 N PHE A 136 -10.712 5.572 2.797 1.00 0.00 N ATOM 2020 CA PHE A 136 -10.778 5.885 4.226 1.00 0.00 C ATOM 2021 C PHE A 136 -9.532 6.668 4.670 1.00 0.00 C ATOM 2022 O PHE A 136 -8.399 6.243 4.424 1.00 0.00 O ATOM 2023 CB PHE A 136 -10.960 4.591 5.035 1.00 0.00 C ATOM 2024 CG PHE A 136 -11.182 4.820 6.520 1.00 0.00 C ATOM 2025 CD1 PHE A 136 -12.353 5.470 6.963 1.00 0.00 C ATOM 2026 CD2 PHE A 136 -10.231 4.388 7.466 1.00 0.00 C ATOM 2027 CE1 PHE A 136 -12.567 5.692 8.335 1.00 0.00 C ATOM 2028 CE2 PHE A 136 -10.454 4.602 8.840 1.00 0.00 C ATOM 2029 CZ PHE A 136 -11.618 5.255 9.276 1.00 0.00 C ATOM 0 HA PHE A 136 -11.641 6.524 4.414 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -11.808 4.038 4.632 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -10.079 3.964 4.902 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -13.089 5.799 6.245 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -9.330 3.892 7.137 1.00 0.00 H new ATOM 0 HE1 PHE A 136 -13.461 6.199 8.666 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -9.726 4.262 9.562 1.00 0.00 H new ATOM 0 HZ PHE A 136 -11.784 5.421 10.330 1.00 0.00 H new ATOM 2039 N ARG A 137 -9.757 7.804 5.340 1.00 0.00 N ATOM 2040 CA ARG A 137 -8.715 8.659 5.924 1.00 0.00 C ATOM 2041 C ARG A 137 -8.467 8.239 7.376 1.00 0.00 C ATOM 2042 O ARG A 137 -9.392 8.266 8.192 1.00 0.00 O ATOM 2043 CB ARG A 137 -9.150 10.137 5.871 1.00 0.00 C ATOM 2044 CG ARG A 137 -9.285 10.680 4.439 1.00 0.00 C ATOM 2045 CD ARG A 137 -9.873 12.099 4.452 1.00 0.00 C ATOM 2046 NE ARG A 137 -10.226 12.578 3.102 1.00 0.00 N ATOM 2047 CZ ARG A 137 -11.318 12.270 2.408 1.00 0.00 C ATOM 2048 NH1 ARG A 137 -12.192 11.375 2.820 1.00 0.00 N ATOM 2049 NH2 ARG A 137 -11.550 12.883 1.271 1.00 0.00 N ATOM 0 H ARG A 137 -10.698 8.166 5.496 1.00 0.00 H new ATOM 0 HA ARG A 137 -7.794 8.545 5.351 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -10.105 10.246 6.385 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -8.424 10.742 6.415 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -8.309 10.690 3.954 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -9.925 10.021 3.853 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -10.762 12.115 5.083 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -9.152 12.783 4.900 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.564 13.211 2.654 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -12.044 10.887 3.704 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -13.016 11.170 2.256 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -10.896 13.587 0.929 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.384 12.655 0.730 1.00 0.00 H new ATOM 2063 N LEU A 138 -7.231 7.863 7.718 1.00 0.00 N ATOM 2064 CA LEU A 138 -6.866 7.502 9.095 1.00 0.00 C ATOM 2065 C LEU A 138 -6.708 8.754 9.973 1.00 0.00 C ATOM 2066 O LEU A 138 -6.259 9.802 9.504 1.00 0.00 O ATOM 2067 CB LEU A 138 -5.595 6.628 9.115 1.00 0.00 C ATOM 2068 CG LEU A 138 -5.681 5.307 8.324 1.00 0.00 C ATOM 2069 CD1 LEU A 138 -4.375 4.530 8.485 1.00 0.00 C ATOM 2070 CD2 LEU A 138 -6.827 4.418 8.805 1.00 0.00 C ATOM 0 H LEU A 138 -6.459 7.800 7.055 1.00 0.00 H new ATOM 0 HA LEU A 138 -7.678 6.911 9.518 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -4.766 7.215 8.718 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -5.353 6.395 10.152 1.00 0.00 H new ATOM 0 HG LEU A 138 -5.860 5.568 7.281 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.436 3.596 7.926 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.547 5.128 8.104 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -4.210 4.311 9.540 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -6.846 3.500 8.218 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.680 4.173 9.857 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.773 4.946 8.684 1.00 0.00 H new ATOM 2082 N ARG A 139 -7.071 8.628 11.256 1.00 0.00 N ATOM 2083 CA ARG A 139 -6.946 9.700 12.259 1.00 0.00 C ATOM 2084 C ARG A 139 -5.524 9.846 12.824 1.00 0.00 C ATOM 2085 O ARG A 139 -5.127 10.927 13.259 1.00 0.00 O ATOM 2086 CB ARG A 139 -7.936 9.457 13.410 1.00 0.00 C ATOM 2087 CG ARG A 139 -9.379 9.849 13.047 1.00 0.00 C ATOM 2088 CD ARG A 139 -10.218 8.757 12.362 1.00 0.00 C ATOM 2089 NE ARG A 139 -10.557 7.655 13.287 1.00 0.00 N ATOM 2090 CZ ARG A 139 -11.550 7.641 14.173 1.00 0.00 C ATOM 2091 NH1 ARG A 139 -12.371 8.660 14.327 1.00 0.00 N ATOM 2092 NH2 ARG A 139 -11.732 6.583 14.931 1.00 0.00 N ATOM 0 H ARG A 139 -7.466 7.767 11.634 1.00 0.00 H new ATOM 0 HA ARG A 139 -7.178 10.633 11.745 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -7.910 8.404 13.690 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -7.618 10.027 14.283 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -9.892 10.156 13.958 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -9.345 10.719 12.391 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -11.135 9.197 11.971 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -9.667 8.358 11.510 1.00 0.00 H new ATOM 0 HE ARG A 139 -9.971 6.821 13.242 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -12.257 9.498 13.756 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -13.121 8.611 15.017 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -11.114 5.777 14.839 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -12.492 6.568 15.611 1.00 0.00 H new ATOM 2106 N HIS A 140 -4.753 8.761 12.786 1.00 0.00 N ATOM 2107 CA HIS A 140 -3.344 8.679 13.199 1.00 0.00 C ATOM 2108 C HIS A 140 -2.513 7.760 12.271 1.00 0.00 C ATOM 2109 O HIS A 140 -3.062 6.923 11.549 1.00 0.00 O ATOM 2110 CB HIS A 140 -3.270 8.260 14.676 1.00 0.00 C ATOM 2111 CG HIS A 140 -3.714 6.845 14.935 1.00 0.00 C ATOM 2112 ND1 HIS A 140 -2.871 5.732 14.944 1.00 0.00 N ATOM 2113 CD2 HIS A 140 -4.993 6.441 15.185 1.00 0.00 C ATOM 2114 CE1 HIS A 140 -3.669 4.682 15.199 1.00 0.00 C ATOM 2115 NE2 HIS A 140 -4.947 5.074 15.346 1.00 0.00 N ATOM 0 H HIS A 140 -5.108 7.866 12.449 1.00 0.00 H new ATOM 0 HA HIS A 140 -2.890 9.665 13.101 1.00 0.00 H new ATOM 0 HB2 HIS A 140 -2.244 8.378 15.025 1.00 0.00 H new ATOM 0 HB3 HIS A 140 -3.887 8.937 15.266 1.00 0.00 H new ATOM 0 HD2 HIS A 140 -5.869 7.070 15.245 1.00 0.00 H new ATOM 0 HE1 HIS A 140 -3.330 3.660 15.276 1.00 0.00 H new ATOM 0 HE2 HIS A 140 -5.742 4.466 15.542 1.00 0.00 H new ATOM 2123 N PHE A 141 -1.189 7.952 12.250 1.00 0.00 N ATOM 2124 CA PHE A 141 -0.289 7.341 11.263 1.00 0.00 C ATOM 2125 C PHE A 141 0.108 5.894 11.645 1.00 0.00 C ATOM 2126 O PHE A 141 0.618 5.695 12.753 1.00 0.00 O ATOM 2127 CB PHE A 141 0.933 8.258 11.091 1.00 0.00 C ATOM 2128 CG PHE A 141 1.670 8.050 9.783 1.00 0.00 C ATOM 2129 CD1 PHE A 141 1.185 8.658 8.611 1.00 0.00 C ATOM 2130 CD2 PHE A 141 2.845 7.276 9.734 1.00 0.00 C ATOM 2131 CE1 PHE A 141 1.867 8.494 7.393 1.00 0.00 C ATOM 2132 CE2 PHE A 141 3.518 7.101 8.513 1.00 0.00 C ATOM 2133 CZ PHE A 141 3.033 7.710 7.344 1.00 0.00 C ATOM 0 H PHE A 141 -0.706 8.543 12.926 1.00 0.00 H new ATOM 0 HA PHE A 141 -0.808 7.249 10.309 1.00 0.00 H new ATOM 0 HB2 PHE A 141 0.609 9.297 11.154 1.00 0.00 H new ATOM 0 HB3 PHE A 141 1.623 8.089 11.918 1.00 0.00 H new ATOM 0 HD1 PHE A 141 0.285 9.253 8.647 1.00 0.00 H new ATOM 0 HD2 PHE A 141 3.228 6.817 10.633 1.00 0.00 H new ATOM 0 HE1 PHE A 141 1.496 8.969 6.497 1.00 0.00 H new ATOM 0 HE2 PHE A 141 4.412 6.496 8.473 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.555 7.576 6.408 1.00 0.00 H new ATOM 2143 N PRO A 142 -0.112 4.884 10.771 1.00 0.00 N ATOM 2144 CA PRO A 142 0.044 3.473 11.130 1.00 0.00 C ATOM 2145 C PRO A 142 1.471 2.922 10.952 1.00 0.00 C ATOM 2146 O PRO A 142 1.849 2.001 11.677 1.00 0.00 O ATOM 2147 CB PRO A 142 -0.935 2.734 10.214 1.00 0.00 C ATOM 2148 CG PRO A 142 -0.886 3.564 8.932 1.00 0.00 C ATOM 2149 CD PRO A 142 -0.778 4.990 9.476 1.00 0.00 C ATOM 0 HA PRO A 142 -0.156 3.337 12.193 1.00 0.00 H new ATOM 0 HB2 PRO A 142 -0.628 1.703 10.041 1.00 0.00 H new ATOM 0 HB3 PRO A 142 -1.939 2.701 10.637 1.00 0.00 H new ATOM 0 HG2 PRO A 142 -0.032 3.300 8.308 1.00 0.00 H new ATOM 0 HG3 PRO A 142 -1.780 3.427 8.323 1.00 0.00 H new ATOM 0 HD2 PRO A 142 -0.208 5.624 8.796 1.00 0.00 H new ATOM 0 HD3 PRO A 142 -1.764 5.442 9.582 1.00 0.00 H new ATOM 2157 N CYS A 143 2.265 3.453 10.012 1.00 0.00 N ATOM 2158 CA CYS A 143 3.607 2.942 9.700 1.00 0.00 C ATOM 2159 C CYS A 143 4.658 3.451 10.703 1.00 0.00 C ATOM 2160 O CYS A 143 4.711 4.646 11.006 1.00 0.00 O ATOM 2161 CB CYS A 143 3.969 3.332 8.256 1.00 0.00 C ATOM 2162 SG CYS A 143 2.900 2.468 7.066 1.00 0.00 S ATOM 0 H CYS A 143 1.992 4.254 9.443 1.00 0.00 H new ATOM 0 HA CYS A 143 3.601 1.855 9.787 1.00 0.00 H new ATOM 0 HB2 CYS A 143 3.866 4.410 8.129 1.00 0.00 H new ATOM 0 HB3 CYS A 143 5.013 3.087 8.059 1.00 0.00 H new ATOM 0 HG CYS A 143 3.078 2.969 5.880 1.00 0.00 H new ATOM 2168 N GLY A 144 5.522 2.554 11.194 1.00 0.00 N ATOM 2169 CA GLY A 144 6.542 2.869 12.209 1.00 0.00 C ATOM 2170 C GLY A 144 7.791 3.578 11.675 1.00 0.00 C ATOM 2171 O GLY A 144 8.560 4.120 12.470 1.00 0.00 O ATOM 0 H GLY A 144 5.535 1.578 10.897 1.00 0.00 H new ATOM 0 HA2 GLY A 144 6.088 3.495 12.977 1.00 0.00 H new ATOM 0 HA3 GLY A 144 6.848 1.942 12.694 1.00 0.00 H new ATOM 2175 N ASN A 145 7.986 3.617 10.353 1.00 0.00 N ATOM 2176 CA ASN A 145 9.025 4.408 9.683 1.00 0.00 C ATOM 2177 C ASN A 145 8.387 5.617 8.980 1.00 0.00 C ATOM 2178 O ASN A 145 7.373 5.456 8.299 1.00 0.00 O ATOM 2179 CB ASN A 145 9.781 3.543 8.659 1.00 0.00 C ATOM 2180 CG ASN A 145 10.312 2.241 9.249 1.00 0.00 C ATOM 2181 OD1 ASN A 145 11.266 2.228 10.018 1.00 0.00 O ATOM 2182 ND2 ASN A 145 9.709 1.116 8.906 1.00 0.00 N ATOM 0 H ASN A 145 7.410 3.085 9.701 1.00 0.00 H new ATOM 0 HA ASN A 145 9.735 4.761 10.431 1.00 0.00 H new ATOM 0 HB2 ASN A 145 9.116 3.313 7.826 1.00 0.00 H new ATOM 0 HB3 ASN A 145 10.614 4.117 8.253 1.00 0.00 H new ATOM 0 HD21 ASN A 145 10.037 0.226 9.282 1.00 0.00 H new ATOM 0 HD22 ASN A 145 8.916 1.137 8.265 1.00 0.00 H new ATOM 2189 N VAL A 146 8.986 6.805 9.108 1.00 0.00 N ATOM 2190 CA VAL A 146 8.551 8.058 8.465 1.00 0.00 C ATOM 2191 C VAL A 146 9.774 8.804 7.930 1.00 0.00 C ATOM 2192 O VAL A 146 10.800 8.909 8.603 1.00 0.00 O ATOM 2193 CB VAL A 146 7.740 8.954 9.439 1.00 0.00 C ATOM 2194 CG1 VAL A 146 7.533 10.383 8.908 1.00 0.00 C ATOM 2195 CG2 VAL A 146 6.350 8.358 9.687 1.00 0.00 C ATOM 0 H VAL A 146 9.819 6.930 9.683 1.00 0.00 H new ATOM 0 HA VAL A 146 7.887 7.809 7.637 1.00 0.00 H new ATOM 0 HB VAL A 146 8.327 8.996 10.356 1.00 0.00 H new ATOM 0 HG11 VAL A 146 6.960 10.961 9.633 1.00 0.00 H new ATOM 0 HG12 VAL A 146 8.502 10.857 8.751 1.00 0.00 H new ATOM 0 HG13 VAL A 146 6.991 10.345 7.963 1.00 0.00 H new ATOM 0 HG21 VAL A 146 5.796 9.000 10.372 1.00 0.00 H new ATOM 0 HG22 VAL A 146 5.811 8.285 8.742 1.00 0.00 H new ATOM 0 HG23 VAL A 146 6.453 7.364 10.123 1.00 0.00 H new ATOM 2205 N ASN A 147 9.631 9.335 6.717 1.00 0.00 N ATOM 2206 CA ASN A 147 10.597 10.171 6.013 1.00 0.00 C ATOM 2207 C ASN A 147 9.912 11.467 5.540 1.00 0.00 C ATOM 2208 O ASN A 147 8.745 11.471 5.134 1.00 0.00 O ATOM 2209 CB ASN A 147 11.183 9.348 4.856 1.00 0.00 C ATOM 2210 CG ASN A 147 12.377 9.993 4.157 1.00 0.00 C ATOM 2211 OD1 ASN A 147 12.953 10.975 4.612 1.00 0.00 O ATOM 2212 ND2 ASN A 147 12.804 9.433 3.040 1.00 0.00 N ATOM 0 H ASN A 147 8.785 9.183 6.167 1.00 0.00 H new ATOM 0 HA ASN A 147 11.416 10.473 6.665 1.00 0.00 H new ATOM 0 HB2 ASN A 147 11.486 8.373 5.238 1.00 0.00 H new ATOM 0 HB3 ASN A 147 10.399 9.172 4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 147 13.614 9.817 2.554 1.00 0.00 H new ATOM 0 HD22 ASN A 147 12.324 8.616 2.663 1.00 0.00 H new ATOM 2219 N TYR A 148 10.628 12.584 5.637 1.00 0.00 N ATOM 2220 CA TYR A 148 10.113 13.934 5.397 1.00 0.00 C ATOM 2221 C TYR A 148 10.420 14.393 3.962 1.00 0.00 C ATOM 2222 O TYR A 148 11.525 14.179 3.457 1.00 0.00 O ATOM 2223 CB TYR A 148 10.701 14.880 6.457 1.00 0.00 C ATOM 2224 CG TYR A 148 10.434 14.411 7.878 1.00 0.00 C ATOM 2225 CD1 TYR A 148 9.152 14.568 8.441 1.00 0.00 C ATOM 2226 CD2 TYR A 148 11.439 13.740 8.604 1.00 0.00 C ATOM 2227 CE1 TYR A 148 8.870 14.051 9.720 1.00 0.00 C ATOM 2228 CE2 TYR A 148 11.164 13.222 9.883 1.00 0.00 C ATOM 2229 CZ TYR A 148 9.877 13.375 10.446 1.00 0.00 C ATOM 2230 OH TYR A 148 9.612 12.863 11.680 1.00 0.00 O ATOM 0 H TYR A 148 11.615 12.577 5.893 1.00 0.00 H new ATOM 0 HA TYR A 148 9.027 13.943 5.490 1.00 0.00 H new ATOM 0 HB2 TYR A 148 11.777 14.966 6.304 1.00 0.00 H new ATOM 0 HB3 TYR A 148 10.279 15.876 6.323 1.00 0.00 H new ATOM 0 HD1 TYR A 148 8.382 15.087 7.889 1.00 0.00 H new ATOM 0 HD2 TYR A 148 12.424 13.623 8.177 1.00 0.00 H new ATOM 0 HE1 TYR A 148 7.885 14.171 10.146 1.00 0.00 H new ATOM 0 HE2 TYR A 148 11.937 12.707 10.435 1.00 0.00 H new ATOM 0 HH TYR A 148 10.417 12.431 12.035 1.00 0.00 H new