USER MOD reduce.3.24.130724 H: found=0, std=0, add=1076, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1066 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 104 CYS SG : rot -155:sc= 1.19 USER MOD Set 1.2: A 105 CYS SG : rot 63:sc= -0.0606 USER MOD Set 1.3: A 108 CYS SG : rot -13:sc= 1.17 USER MOD Set 1.4: A 120 CYS SG : rot -122:sc= -0.186 USER MOD Set 1.5: A 122 CYS SG : rot 84:sc= 1.05 USER MOD Set 1.6: A 145 CYS SG : rot -134:sc= 0.447 USER MOD Set 1.7: A 147 HIS : no HD1:sc= -0.888 K(o=2.5,f=5.2) USER MOD Set 1.8: A 148 CYS SG : rot -105:sc= -0.803 USER MOD Set 1.9: A 150 CYS SG : rot -155:sc= 0.0602 USER MOD Set 1.10: A 153 CYS SG : rot -145:sc= 0.486 USER MOD Set 2.1: A 45 SER OG : rot 180:sc= -0.599! USER MOD Set 2.2: A 46 ASN : amide:sc= -0.0296 K(o=-0.63,f=-1.2) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 THR OG1 : rot 180:sc= -0.689 USER MOD Single : A 29 GLN : amide:sc= -0.149 K(o=-0.15,f=-1) USER MOD Single : A 34 GLN : amide:sc= -0.0386 K(o=-0.039,f=-2.1!) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.465 X(o=-0.46,f=-0.4) USER MOD Single : A 53 MET CE :methyl -128:sc= -2.76! (180deg=-5.64!) USER MOD Single : A 54 GLN : amide:sc= -0.0766 K(o=-0.077,f=-1.3) USER MOD Single : A 56 HIS : no HE2:sc= -1.95! C(o=-2!,f=-5.7!) USER MOD Single : A 57 HIS : no HD1:sc= -5.55! C(o=-5.5!,f=-6.5!) USER MOD Single : A 58 GLN : amide:sc= -0.0802 X(o=-0.08,f=-0.051) USER MOD Single : A 60 SER OG : rot -23:sc= 0.828 USER MOD Single : A 62 TYR OH : rot 109:sc= -5.05! USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 81:sc= 0.872 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -135:sc= 1.21 (180deg=-0.738) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 75 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.0924) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 151:sc= 0.954 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 157:sc=-2.19e-06 (180deg=-0.525) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0665 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 119 THR OG1 : rot -52:sc= 0.757 USER MOD Single : A 128 GLN : amide:sc= -0.418 K(o=-0.42,f=-1.3) USER MOD Single : A 135 LYS NZ :NH3+ -110:sc= 0 (180deg=-0.0412) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.552 K(o=-0.55,f=-0.045) USER MOD Single : A 144 GLN : amide:sc= -1.2 K(o=-1.2,f=-2.1!) USER MOD Single : A 155 SER OG : rot 180:sc= 0.0248 USER MOD ----------------------------------------------------------------- ATOM 216 N ALA A 12 -15.319 -7.515 18.262 1.00 0.00 N ATOM 217 CA ALA A 12 -13.847 -7.335 18.511 1.00 0.00 C ATOM 218 C ALA A 12 -13.559 -7.435 20.019 1.00 0.00 C ATOM 219 O ALA A 12 -14.376 -7.034 20.824 1.00 0.00 O ATOM 220 CB ALA A 12 -13.488 -5.939 17.984 1.00 0.00 C ATOM 0 HA ALA A 12 -13.256 -8.103 18.012 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.425 -5.754 18.140 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.714 -5.883 16.919 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.069 -5.188 18.518 1.00 0.00 H new ATOM 226 N PRO A 13 -12.407 -7.973 20.363 1.00 0.00 N ATOM 227 CA PRO A 13 -12.043 -8.118 21.797 1.00 0.00 C ATOM 228 C PRO A 13 -11.733 -6.751 22.423 1.00 0.00 C ATOM 229 O PRO A 13 -11.464 -5.791 21.727 1.00 0.00 O ATOM 230 CB PRO A 13 -10.796 -8.999 21.768 1.00 0.00 C ATOM 231 CG PRO A 13 -10.205 -8.786 20.412 1.00 0.00 C ATOM 232 CD PRO A 13 -11.347 -8.487 19.477 1.00 0.00 C ATOM 0 HA PRO A 13 -12.847 -8.545 22.396 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.095 -8.717 22.553 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.049 -10.047 21.928 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.493 -7.961 20.427 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.660 -9.672 20.085 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.064 -7.751 18.724 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.671 -9.381 18.944 1.00 0.00 H new ATOM 240 N ASP A 14 -11.777 -6.656 23.739 1.00 0.00 N ATOM 241 CA ASP A 14 -11.486 -5.333 24.417 1.00 0.00 C ATOM 242 C ASP A 14 -10.185 -4.702 23.882 1.00 0.00 C ATOM 243 O ASP A 14 -10.064 -3.492 23.825 1.00 0.00 O ATOM 244 CB ASP A 14 -11.341 -5.634 25.917 1.00 0.00 C ATOM 245 CG ASP A 14 -11.490 -4.336 26.714 1.00 0.00 C ATOM 246 OD1 ASP A 14 -12.518 -3.694 26.577 1.00 0.00 O ATOM 247 OD2 ASP A 14 -10.573 -4.005 27.448 1.00 0.00 O ATOM 0 H ASP A 14 -11.999 -7.426 24.370 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.289 -4.623 24.222 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -12.097 -6.354 26.229 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.369 -6.086 26.116 1.00 0.00 H new ATOM 252 N GLY A 15 -9.212 -5.501 23.486 1.00 0.00 N ATOM 253 CA GLY A 15 -7.932 -4.932 22.954 1.00 0.00 C ATOM 254 C GLY A 15 -8.218 -3.926 21.820 1.00 0.00 C ATOM 255 O GLY A 15 -7.508 -2.948 21.672 1.00 0.00 O ATOM 0 H GLY A 15 -9.254 -6.520 23.510 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.385 -4.438 23.757 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.296 -5.736 22.583 1.00 0.00 H new ATOM 259 N PHE A 16 -9.247 -4.148 21.021 1.00 0.00 N ATOM 260 CA PHE A 16 -9.550 -3.175 19.904 1.00 0.00 C ATOM 261 C PHE A 16 -9.726 -1.749 20.458 1.00 0.00 C ATOM 262 O PHE A 16 -9.381 -0.785 19.800 1.00 0.00 O ATOM 263 CB PHE A 16 -10.858 -3.642 19.246 1.00 0.00 C ATOM 264 CG PHE A 16 -11.129 -2.804 18.019 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.152 -2.681 17.023 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.358 -2.147 17.877 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.401 -1.903 15.888 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.608 -1.368 16.741 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.630 -1.247 15.746 1.00 0.00 C ATOM 0 H PHE A 16 -9.880 -4.945 21.090 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.730 -3.152 19.186 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.785 -4.695 18.972 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.685 -3.553 19.951 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.205 -3.188 17.132 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.113 -2.241 18.644 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.646 -1.808 15.122 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.555 -0.860 16.632 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.824 -0.648 14.869 1.00 0.00 H new ATOM 279 N GLU A 17 -10.255 -1.600 21.658 1.00 0.00 N ATOM 280 CA GLU A 17 -10.438 -0.212 22.231 1.00 0.00 C ATOM 281 C GLU A 17 -9.107 0.557 22.195 1.00 0.00 C ATOM 282 O GLU A 17 -9.081 1.742 21.921 1.00 0.00 O ATOM 283 CB GLU A 17 -10.904 -0.391 23.684 1.00 0.00 C ATOM 284 CG GLU A 17 -11.507 0.921 24.192 1.00 0.00 C ATOM 285 CD GLU A 17 -12.587 0.618 25.233 1.00 0.00 C ATOM 286 OE1 GLU A 17 -13.615 0.084 24.851 1.00 0.00 O ATOM 287 OE2 GLU A 17 -12.367 0.927 26.393 1.00 0.00 O ATOM 0 H GLU A 17 -10.564 -2.364 22.259 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.166 0.357 21.652 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.642 -1.190 23.744 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.064 -0.685 24.313 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.729 1.545 24.631 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -11.935 1.482 23.361 1.00 0.00 H new ATOM 294 N LYS A 18 -8.003 -0.110 22.461 1.00 0.00 N ATOM 295 CA LYS A 18 -6.675 0.605 22.427 1.00 0.00 C ATOM 296 C LYS A 18 -6.423 1.180 21.023 1.00 0.00 C ATOM 297 O LYS A 18 -5.883 2.261 20.885 1.00 0.00 O ATOM 298 CB LYS A 18 -5.599 -0.438 22.771 1.00 0.00 C ATOM 299 CG LYS A 18 -5.778 -0.898 24.219 1.00 0.00 C ATOM 300 CD LYS A 18 -4.420 -1.292 24.802 1.00 0.00 C ATOM 301 CE LYS A 18 -4.075 -2.719 24.374 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.157 -3.226 25.431 1.00 0.00 N ATOM 0 H LYS A 18 -7.960 -1.102 22.697 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.657 1.433 23.136 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.675 -1.290 22.096 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.606 -0.010 22.634 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -6.222 -0.099 24.813 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.463 -1.745 24.260 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -3.650 -0.602 24.457 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -4.446 -1.223 25.890 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.970 -3.336 24.299 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.596 -2.733 23.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.876 -4.202 25.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.311 -2.623 25.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.643 -3.208 26.350 1.00 0.00 H new ATOM 316 N ILE A 19 -6.811 0.473 19.981 1.00 0.00 N ATOM 317 CA ILE A 19 -6.589 0.997 18.595 1.00 0.00 C ATOM 318 C ILE A 19 -7.939 1.265 17.892 1.00 0.00 C ATOM 319 O ILE A 19 -8.060 1.082 16.696 1.00 0.00 O ATOM 320 CB ILE A 19 -5.790 -0.098 17.860 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.625 -1.393 17.742 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.497 -0.399 18.630 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.597 -1.906 16.299 1.00 0.00 C ATOM 0 H ILE A 19 -7.268 -0.437 20.033 1.00 0.00 H new ATOM 0 HA ILE A 19 -6.051 1.945 18.602 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.550 0.261 16.859 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.228 -2.154 18.415 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.653 -1.201 18.048 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.935 -1.173 18.108 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.893 0.506 18.695 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.743 -0.744 19.634 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.188 -2.819 16.226 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -7.015 -1.149 15.636 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.568 -2.116 16.007 1.00 0.00 H new ATOM 335 N LYS A 20 -8.960 1.678 18.623 1.00 0.00 N ATOM 336 CA LYS A 20 -10.299 1.928 17.971 1.00 0.00 C ATOM 337 C LYS A 20 -10.424 3.338 17.345 1.00 0.00 C ATOM 338 O LYS A 20 -10.966 3.457 16.264 1.00 0.00 O ATOM 339 CB LYS A 20 -11.355 1.747 19.074 1.00 0.00 C ATOM 340 CG LYS A 20 -12.759 1.726 18.450 1.00 0.00 C ATOM 341 CD LYS A 20 -13.668 2.721 19.180 1.00 0.00 C ATOM 342 CE LYS A 20 -14.612 3.388 18.176 1.00 0.00 C ATOM 343 NZ LYS A 20 -15.097 4.618 18.863 1.00 0.00 N ATOM 0 H LYS A 20 -8.926 1.851 19.628 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.431 1.231 17.144 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -11.174 0.819 19.615 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.281 2.558 19.798 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.700 1.982 17.392 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -13.179 0.722 18.512 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.244 2.206 19.949 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.066 3.476 19.685 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -14.094 3.632 17.249 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -15.440 2.729 17.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -15.750 5.131 18.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -15.592 4.354 19.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -14.288 5.229 19.093 1.00 0.00 H new ATOM 357 N PRO A 21 -9.966 4.372 18.030 1.00 0.00 N ATOM 358 CA PRO A 21 -10.108 5.745 17.478 1.00 0.00 C ATOM 359 C PRO A 21 -9.098 6.014 16.348 1.00 0.00 C ATOM 360 O PRO A 21 -9.409 6.718 15.404 1.00 0.00 O ATOM 361 CB PRO A 21 -9.843 6.650 18.676 1.00 0.00 C ATOM 362 CG PRO A 21 -9.004 5.839 19.610 1.00 0.00 C ATOM 363 CD PRO A 21 -9.289 4.383 19.335 1.00 0.00 C ATOM 0 HA PRO A 21 -11.088 5.909 17.030 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.326 7.560 18.373 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.775 6.956 19.151 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.946 6.057 19.461 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.237 6.085 20.646 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.370 3.798 19.308 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.920 3.950 20.111 1.00 0.00 H new ATOM 371 N THR A 22 -7.897 5.476 16.426 1.00 0.00 N ATOM 372 CA THR A 22 -6.898 5.740 15.324 1.00 0.00 C ATOM 373 C THR A 22 -7.443 5.223 13.986 1.00 0.00 C ATOM 374 O THR A 22 -7.348 5.896 12.976 1.00 0.00 O ATOM 375 CB THR A 22 -5.604 4.998 15.697 1.00 0.00 C ATOM 376 OG1 THR A 22 -5.154 5.443 16.974 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.527 5.289 14.648 1.00 0.00 C ATOM 0 H THR A 22 -7.568 4.879 17.185 1.00 0.00 H new ATOM 0 HA THR A 22 -6.710 6.808 15.216 1.00 0.00 H new ATOM 0 HB THR A 22 -5.797 3.926 15.731 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.330 4.970 17.214 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.610 4.763 14.913 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.870 4.950 13.670 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.333 6.361 14.613 1.00 0.00 H new ATOM 385 N LEU A 23 -8.021 4.042 13.968 1.00 0.00 N ATOM 386 CA LEU A 23 -8.577 3.512 12.672 1.00 0.00 C ATOM 387 C LEU A 23 -9.745 4.398 12.216 1.00 0.00 C ATOM 388 O LEU A 23 -9.885 4.684 11.041 1.00 0.00 O ATOM 389 CB LEU A 23 -9.060 2.079 12.947 1.00 0.00 C ATOM 390 CG LEU A 23 -7.848 1.160 13.114 1.00 0.00 C ATOM 391 CD1 LEU A 23 -8.158 0.075 14.154 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.517 0.505 11.769 1.00 0.00 C ATOM 0 H LEU A 23 -8.132 3.430 14.777 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.826 3.516 11.882 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.675 2.057 13.847 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.685 1.730 12.125 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.994 1.746 13.453 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.292 -0.577 14.269 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.389 0.543 15.111 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.013 -0.514 13.822 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.654 -0.150 11.886 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.372 -0.079 11.428 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.289 1.277 11.034 1.00 0.00 H new ATOM 404 N THR A 24 -10.583 4.850 13.133 1.00 0.00 N ATOM 405 CA THR A 24 -11.733 5.736 12.720 1.00 0.00 C ATOM 406 C THR A 24 -11.206 6.986 11.994 1.00 0.00 C ATOM 407 O THR A 24 -11.827 7.469 11.065 1.00 0.00 O ATOM 408 CB THR A 24 -12.466 6.144 14.014 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.392 5.086 14.976 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.931 6.466 13.693 1.00 0.00 C ATOM 0 H THR A 24 -10.523 4.648 14.131 1.00 0.00 H new ATOM 0 HA THR A 24 -12.403 5.214 12.037 1.00 0.00 H new ATOM 0 HB THR A 24 -11.988 7.029 14.434 1.00 0.00 H new ATOM 0 HG1 THR A 24 -12.859 5.355 15.795 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.449 6.754 14.608 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.975 7.287 12.977 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.412 5.586 13.266 1.00 0.00 H new ATOM 418 N ASP A 25 -10.065 7.514 12.399 1.00 0.00 N ATOM 419 CA ASP A 25 -9.518 8.737 11.703 1.00 0.00 C ATOM 420 C ASP A 25 -9.344 8.466 10.197 1.00 0.00 C ATOM 421 O ASP A 25 -9.555 9.344 9.382 1.00 0.00 O ATOM 422 CB ASP A 25 -8.150 9.036 12.342 1.00 0.00 C ATOM 423 CG ASP A 25 -8.345 9.925 13.573 1.00 0.00 C ATOM 424 OD1 ASP A 25 -9.186 10.807 13.514 1.00 0.00 O ATOM 425 OD2 ASP A 25 -7.652 9.707 14.552 1.00 0.00 O ATOM 0 H ASP A 25 -9.497 7.159 13.168 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.199 9.581 11.811 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -7.658 8.106 12.626 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.501 9.532 11.621 1.00 0.00 H new ATOM 430 N PHE A 26 -8.958 7.262 9.818 1.00 0.00 N ATOM 431 CA PHE A 26 -8.773 6.963 8.350 1.00 0.00 C ATOM 432 C PHE A 26 -10.081 7.210 7.581 1.00 0.00 C ATOM 433 O PHE A 26 -10.060 7.702 6.467 1.00 0.00 O ATOM 434 CB PHE A 26 -8.387 5.481 8.248 1.00 0.00 C ATOM 435 CG PHE A 26 -6.889 5.346 8.344 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.265 5.355 9.595 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.124 5.212 7.179 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.875 5.232 9.684 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.733 5.088 7.269 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.109 5.098 8.520 1.00 0.00 C ATOM 0 H PHE A 26 -8.766 6.484 10.449 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.007 7.607 7.919 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.866 4.913 9.046 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.741 5.066 7.304 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.857 5.457 10.493 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.606 5.204 6.213 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.393 5.240 10.650 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.141 4.985 6.372 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.035 5.002 8.588 1.00 0.00 H new ATOM 450 N GLU A 27 -11.216 6.863 8.152 1.00 0.00 N ATOM 451 CA GLU A 27 -12.514 7.077 7.416 1.00 0.00 C ATOM 452 C GLU A 27 -12.722 8.565 7.104 1.00 0.00 C ATOM 453 O GLU A 27 -13.206 8.908 6.042 1.00 0.00 O ATOM 454 CB GLU A 27 -13.638 6.567 8.334 1.00 0.00 C ATOM 455 CG GLU A 27 -13.592 5.039 8.396 1.00 0.00 C ATOM 456 CD GLU A 27 -14.460 4.455 7.280 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.630 4.799 7.224 1.00 0.00 O ATOM 458 OE2 GLU A 27 -13.940 3.676 6.499 1.00 0.00 O ATOM 0 H GLU A 27 -11.302 6.448 9.080 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.508 6.542 6.466 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.524 6.986 9.334 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.607 6.897 7.959 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.564 4.691 8.291 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.948 4.693 9.366 1.00 0.00 H new ATOM 465 N ILE A 28 -12.362 9.452 8.007 1.00 0.00 N ATOM 466 CA ILE A 28 -12.556 10.918 7.717 1.00 0.00 C ATOM 467 C ILE A 28 -11.617 11.333 6.567 1.00 0.00 C ATOM 468 O ILE A 28 -12.014 12.071 5.684 1.00 0.00 O ATOM 469 CB ILE A 28 -12.243 11.686 9.023 1.00 0.00 C ATOM 470 CG1 ILE A 28 -13.361 11.423 10.044 1.00 0.00 C ATOM 471 CG2 ILE A 28 -12.170 13.195 8.749 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.930 10.327 11.018 1.00 0.00 C ATOM 0 H ILE A 28 -11.951 9.234 8.914 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.575 11.143 7.402 1.00 0.00 H new ATOM 0 HB ILE A 28 -11.284 11.343 9.412 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -13.589 12.338 10.591 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -14.274 11.125 9.528 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.949 13.723 9.677 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -11.383 13.395 8.021 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -13.126 13.540 8.354 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.728 10.146 11.739 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.725 9.410 10.466 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -12.029 10.642 11.545 1.00 0.00 H new ATOM 484 N GLN A 29 -10.388 10.854 6.555 1.00 0.00 N ATOM 485 CA GLN A 29 -9.464 11.231 5.427 1.00 0.00 C ATOM 486 C GLN A 29 -9.981 10.595 4.132 1.00 0.00 C ATOM 487 O GLN A 29 -10.098 11.258 3.117 1.00 0.00 O ATOM 488 CB GLN A 29 -8.073 10.680 5.780 1.00 0.00 C ATOM 489 CG GLN A 29 -7.037 11.240 4.803 1.00 0.00 C ATOM 490 CD GLN A 29 -6.499 12.574 5.334 1.00 0.00 C ATOM 491 OE1 GLN A 29 -6.234 12.703 6.513 1.00 0.00 O ATOM 492 NE2 GLN A 29 -6.323 13.581 4.515 1.00 0.00 N ATOM 0 H GLN A 29 -9.992 10.233 7.260 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.416 12.311 5.286 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.810 10.955 6.802 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -8.080 9.591 5.734 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.219 10.530 4.678 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.488 11.383 3.821 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.544 13.478 3.525 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.965 14.469 4.868 1.00 0.00 H new ATOM 501 N LEU A 30 -10.323 9.321 4.160 1.00 0.00 N ATOM 502 CA LEU A 30 -10.868 8.673 2.913 1.00 0.00 C ATOM 503 C LEU A 30 -12.198 9.351 2.536 1.00 0.00 C ATOM 504 O LEU A 30 -12.494 9.530 1.369 1.00 0.00 O ATOM 505 CB LEU A 30 -11.097 7.179 3.233 1.00 0.00 C ATOM 506 CG LEU A 30 -10.514 6.310 2.106 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.697 5.162 2.707 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.655 5.734 1.260 1.00 0.00 C ATOM 0 H LEU A 30 -10.251 8.712 4.975 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.178 8.776 2.075 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.625 6.924 4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.163 6.980 3.343 1.00 0.00 H new ATOM 0 HG LEU A 30 -9.868 6.923 1.478 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.286 4.549 1.905 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -8.883 5.570 3.306 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -10.340 4.549 3.339 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -11.241 5.118 0.462 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -12.303 5.124 1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.234 6.549 0.826 1.00 0.00 H new ATOM 520 N ARG A 31 -13.004 9.742 3.513 1.00 0.00 N ATOM 521 CA ARG A 31 -14.311 10.420 3.182 1.00 0.00 C ATOM 522 C ARG A 31 -14.048 11.680 2.343 1.00 0.00 C ATOM 523 O ARG A 31 -14.762 11.954 1.397 1.00 0.00 O ATOM 524 CB ARG A 31 -14.957 10.819 4.520 1.00 0.00 C ATOM 525 CG ARG A 31 -15.685 9.617 5.126 1.00 0.00 C ATOM 526 CD ARG A 31 -15.786 9.790 6.648 1.00 0.00 C ATOM 527 NE ARG A 31 -17.227 9.558 6.970 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.757 8.346 6.916 1.00 0.00 C ATOM 529 NH1 ARG A 31 -17.039 7.299 6.575 1.00 0.00 N ATOM 530 NH2 ARG A 31 -19.022 8.179 7.204 1.00 0.00 N ATOM 0 H ARG A 31 -12.815 9.622 4.508 1.00 0.00 H new ATOM 0 HA ARG A 31 -14.961 9.757 2.611 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -14.193 11.178 5.210 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.658 11.639 4.365 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -16.681 9.526 4.693 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -15.150 8.698 4.889 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.146 9.078 7.169 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.469 10.787 6.954 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.813 10.349 7.237 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -16.052 7.411 6.345 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -17.469 6.375 6.540 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.595 8.980 7.469 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -19.435 7.247 7.164 1.00 0.00 H new ATOM 544 N ASP A 32 -13.029 12.451 2.679 1.00 0.00 N ATOM 545 CA ASP A 32 -12.748 13.692 1.874 1.00 0.00 C ATOM 546 C ASP A 32 -12.397 13.302 0.433 1.00 0.00 C ATOM 547 O ASP A 32 -12.913 13.877 -0.507 1.00 0.00 O ATOM 548 CB ASP A 32 -11.558 14.401 2.542 1.00 0.00 C ATOM 549 CG ASP A 32 -12.071 15.347 3.628 1.00 0.00 C ATOM 550 OD1 ASP A 32 -12.875 14.911 4.435 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.651 16.493 3.634 1.00 0.00 O ATOM 0 H ASP A 32 -12.394 12.279 3.458 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.617 14.349 1.843 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -10.880 13.666 2.976 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -10.989 14.959 1.798 1.00 0.00 H new ATOM 556 N ALA A 33 -11.536 12.321 0.247 1.00 0.00 N ATOM 557 CA ALA A 33 -11.187 11.905 -1.156 1.00 0.00 C ATOM 558 C ALA A 33 -12.423 11.281 -1.820 1.00 0.00 C ATOM 559 O ALA A 33 -12.708 11.544 -2.973 1.00 0.00 O ATOM 560 CB ALA A 33 -10.063 10.864 -1.045 1.00 0.00 C ATOM 0 H ALA A 33 -11.069 11.800 0.989 1.00 0.00 H new ATOM 0 HA ALA A 33 -10.866 12.755 -1.758 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.775 10.531 -2.042 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.201 11.310 -0.549 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.414 10.010 -0.465 1.00 0.00 H new ATOM 566 N GLN A 34 -13.166 10.463 -1.098 1.00 0.00 N ATOM 567 CA GLN A 34 -14.393 9.839 -1.709 1.00 0.00 C ATOM 568 C GLN A 34 -15.384 10.934 -2.148 1.00 0.00 C ATOM 569 O GLN A 34 -16.070 10.780 -3.142 1.00 0.00 O ATOM 570 CB GLN A 34 -15.030 8.957 -0.625 1.00 0.00 C ATOM 571 CG GLN A 34 -14.342 7.590 -0.607 1.00 0.00 C ATOM 572 CD GLN A 34 -15.036 6.655 -1.604 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.064 6.929 -2.787 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.603 5.552 -1.180 1.00 0.00 N ATOM 0 H GLN A 34 -12.980 10.204 -0.129 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.134 9.252 -2.590 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.936 9.436 0.350 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.096 8.837 -0.819 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.289 7.698 -0.866 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -14.382 7.164 0.396 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.583 5.317 -0.188 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.065 4.929 -1.842 1.00 0.00 H new ATOM 583 N LYS A 35 -15.468 12.038 -1.426 1.00 0.00 N ATOM 584 CA LYS A 35 -16.426 13.124 -1.833 1.00 0.00 C ATOM 585 C LYS A 35 -15.728 14.161 -2.732 1.00 0.00 C ATOM 586 O LYS A 35 -16.347 14.731 -3.611 1.00 0.00 O ATOM 587 CB LYS A 35 -16.906 13.781 -0.532 1.00 0.00 C ATOM 588 CG LYS A 35 -18.099 13.000 0.024 1.00 0.00 C ATOM 589 CD LYS A 35 -19.400 13.635 -0.469 1.00 0.00 C ATOM 590 CE LYS A 35 -19.675 14.916 0.323 1.00 0.00 C ATOM 591 NZ LYS A 35 -21.154 14.956 0.486 1.00 0.00 N ATOM 0 H LYS A 35 -14.922 12.230 -0.586 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.259 12.717 -2.406 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.097 13.799 0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.191 14.817 -0.718 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -18.046 11.959 -0.295 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -18.072 13.001 1.114 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.326 13.861 -1.533 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -20.227 12.935 -0.348 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.171 14.899 1.290 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -19.312 15.795 -0.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -21.421 15.807 1.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.606 14.979 -0.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.469 14.110 1.002 1.00 0.00 H new ATOM 605 N ASP A 36 -14.449 14.416 -2.528 1.00 0.00 N ATOM 606 CA ASP A 36 -13.738 15.430 -3.395 1.00 0.00 C ATOM 607 C ASP A 36 -13.880 15.057 -4.881 1.00 0.00 C ATOM 608 O ASP A 36 -14.011 15.922 -5.727 1.00 0.00 O ATOM 609 CB ASP A 36 -12.256 15.399 -2.986 1.00 0.00 C ATOM 610 CG ASP A 36 -12.031 16.350 -1.809 1.00 0.00 C ATOM 611 OD1 ASP A 36 -12.643 17.406 -1.801 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.250 16.007 -0.936 1.00 0.00 O ATOM 0 H ASP A 36 -13.873 13.975 -1.811 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.165 16.424 -3.261 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -11.965 14.386 -2.709 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -11.629 15.691 -3.828 1.00 0.00 H new ATOM 744 N SER A 45 -8.465 15.106 -9.473 1.00 0.00 N ATOM 745 CA SER A 45 -9.304 13.911 -9.149 1.00 0.00 C ATOM 746 C SER A 45 -8.428 12.654 -9.050 1.00 0.00 C ATOM 747 O SER A 45 -8.444 11.964 -8.048 1.00 0.00 O ATOM 748 CB SER A 45 -10.294 13.785 -10.307 1.00 0.00 C ATOM 749 OG SER A 45 -9.646 13.171 -11.413 1.00 0.00 O ATOM 0 HA SER A 45 -9.813 14.019 -8.191 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.156 13.192 -10.001 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.668 14.769 -10.590 1.00 0.00 H new ATOM 0 HG SER A 45 -10.278 13.087 -12.157 1.00 0.00 H new ATOM 755 N ASN A 46 -7.662 12.351 -10.076 1.00 0.00 N ATOM 756 CA ASN A 46 -6.783 11.124 -10.019 1.00 0.00 C ATOM 757 C ASN A 46 -5.846 11.205 -8.801 1.00 0.00 C ATOM 758 O ASN A 46 -5.601 10.211 -8.141 1.00 0.00 O ATOM 759 CB ASN A 46 -5.957 11.101 -11.317 1.00 0.00 C ATOM 760 CG ASN A 46 -6.669 10.236 -12.364 1.00 0.00 C ATOM 761 OD1 ASN A 46 -6.056 9.380 -12.971 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.944 10.418 -12.608 1.00 0.00 N ATOM 0 H ASN A 46 -7.604 12.889 -10.941 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.383 10.219 -9.923 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -5.827 12.115 -11.695 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -4.961 10.705 -11.119 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.417 9.842 -13.305 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -8.463 11.135 -12.101 1.00 0.00 H new ATOM 769 N GLU A 47 -5.327 12.377 -8.490 1.00 0.00 N ATOM 770 CA GLU A 47 -4.414 12.491 -7.297 1.00 0.00 C ATOM 771 C GLU A 47 -5.198 12.176 -6.013 1.00 0.00 C ATOM 772 O GLU A 47 -4.692 11.517 -5.125 1.00 0.00 O ATOM 773 CB GLU A 47 -3.899 13.938 -7.264 1.00 0.00 C ATOM 774 CG GLU A 47 -3.120 14.233 -8.548 1.00 0.00 C ATOM 775 CD GLU A 47 -2.051 15.290 -8.265 1.00 0.00 C ATOM 776 OE1 GLU A 47 -2.388 16.463 -8.266 1.00 0.00 O ATOM 777 OE2 GLU A 47 -0.912 14.908 -8.051 1.00 0.00 O ATOM 0 H GLU A 47 -5.492 13.245 -9.000 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.584 11.788 -7.366 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -4.735 14.630 -7.166 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.258 14.087 -6.395 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.655 13.321 -8.921 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -3.799 14.586 -9.325 1.00 0.00 H new ATOM 784 N GLN A 48 -6.432 12.636 -5.906 1.00 0.00 N ATOM 785 CA GLN A 48 -7.228 12.341 -4.661 1.00 0.00 C ATOM 786 C GLN A 48 -7.429 10.824 -4.520 1.00 0.00 C ATOM 787 O GLN A 48 -7.330 10.283 -3.434 1.00 0.00 O ATOM 788 CB GLN A 48 -8.588 13.040 -4.823 1.00 0.00 C ATOM 789 CG GLN A 48 -9.156 13.387 -3.445 1.00 0.00 C ATOM 790 CD GLN A 48 -8.245 14.406 -2.750 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.074 15.508 -3.235 1.00 0.00 O ATOM 792 NE2 GLN A 48 -7.645 14.090 -1.629 1.00 0.00 N ATOM 0 H GLN A 48 -6.914 13.192 -6.613 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.711 12.698 -3.770 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.474 13.946 -5.419 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.280 12.391 -5.359 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.161 13.795 -3.548 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.239 12.486 -2.838 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -7.785 13.167 -1.218 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.038 14.767 -1.167 1.00 0.00 H new ATOM 801 N LEU A 49 -7.707 10.129 -5.608 1.00 0.00 N ATOM 802 CA LEU A 49 -7.906 8.637 -5.504 1.00 0.00 C ATOM 803 C LEU A 49 -6.629 7.973 -4.968 1.00 0.00 C ATOM 804 O LEU A 49 -6.696 7.061 -4.165 1.00 0.00 O ATOM 805 CB LEU A 49 -8.211 8.127 -6.927 1.00 0.00 C ATOM 806 CG LEU A 49 -9.725 8.148 -7.193 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.437 7.219 -6.206 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.264 9.576 -7.034 1.00 0.00 C ATOM 0 H LEU A 49 -7.803 10.520 -6.545 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.720 8.397 -4.820 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.698 8.749 -7.660 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.829 7.113 -7.046 1.00 0.00 H new ATOM 0 HG LEU A 49 -9.911 7.805 -8.211 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.510 7.237 -6.398 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -10.063 6.202 -6.329 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -10.245 7.555 -5.187 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.337 9.583 -7.224 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.073 9.926 -6.020 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -9.765 10.234 -7.745 1.00 0.00 H new ATOM 820 N TRP A 50 -5.463 8.419 -5.399 1.00 0.00 N ATOM 821 CA TRP A 50 -4.193 7.789 -4.888 1.00 0.00 C ATOM 822 C TRP A 50 -4.096 7.961 -3.367 1.00 0.00 C ATOM 823 O TRP A 50 -3.660 7.061 -2.672 1.00 0.00 O ATOM 824 CB TRP A 50 -3.021 8.492 -5.604 1.00 0.00 C ATOM 825 CG TRP A 50 -3.116 8.293 -7.099 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.869 7.351 -7.734 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.434 9.036 -8.153 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.696 7.486 -9.099 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.824 8.505 -9.406 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.527 10.112 -8.146 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.336 9.020 -10.603 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.029 10.629 -9.355 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.436 10.083 -10.581 1.00 0.00 C ATOM 0 H TRP A 50 -5.337 9.177 -6.070 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.171 6.719 -5.093 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.032 9.557 -5.372 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.074 8.096 -5.238 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.498 6.619 -7.250 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.159 6.901 -9.794 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.212 10.543 -7.207 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.654 8.597 -11.545 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.329 11.451 -9.339 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.052 10.486 -11.507 1.00 0.00 H new ATOM 844 N GLU A 51 -4.517 9.090 -2.832 1.00 0.00 N ATOM 845 CA GLU A 51 -4.455 9.263 -1.337 1.00 0.00 C ATOM 846 C GLU A 51 -5.329 8.198 -0.649 1.00 0.00 C ATOM 847 O GLU A 51 -5.024 7.767 0.448 1.00 0.00 O ATOM 848 CB GLU A 51 -4.986 10.671 -1.026 1.00 0.00 C ATOM 849 CG GLU A 51 -4.648 11.036 0.421 1.00 0.00 C ATOM 850 CD GLU A 51 -4.587 12.558 0.562 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.451 13.220 0.011 1.00 0.00 O ATOM 852 OE2 GLU A 51 -3.677 13.036 1.220 1.00 0.00 O ATOM 0 H GLU A 51 -4.893 9.883 -3.352 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.435 9.146 -0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -4.544 11.397 -1.708 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -6.065 10.706 -1.179 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -5.400 10.627 1.096 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.692 10.595 0.705 1.00 0.00 H new ATOM 859 N ILE A 52 -6.409 7.757 -1.276 1.00 0.00 N ATOM 860 CA ILE A 52 -7.267 6.708 -0.624 1.00 0.00 C ATOM 861 C ILE A 52 -6.526 5.365 -0.641 1.00 0.00 C ATOM 862 O ILE A 52 -6.270 4.796 0.405 1.00 0.00 O ATOM 863 CB ILE A 52 -8.582 6.645 -1.424 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.289 8.000 -1.293 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.478 5.537 -0.862 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.596 8.012 -2.094 1.00 0.00 C ATOM 0 H ILE A 52 -6.725 8.074 -2.193 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.483 6.945 0.418 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.375 6.428 -2.472 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.499 8.206 -0.243 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.632 8.794 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.407 5.496 -1.431 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.963 4.579 -0.938 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.702 5.746 0.184 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.080 8.983 -1.986 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.379 7.829 -3.147 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.259 7.232 -1.720 1.00 0.00 H new ATOM 878 N MET A 53 -6.152 4.854 -1.802 1.00 0.00 N ATOM 879 CA MET A 53 -5.397 3.547 -1.804 1.00 0.00 C ATOM 880 C MET A 53 -4.078 3.703 -1.020 1.00 0.00 C ATOM 881 O MET A 53 -3.598 2.750 -0.434 1.00 0.00 O ATOM 882 CB MET A 53 -5.137 3.129 -3.268 1.00 0.00 C ATOM 883 CG MET A 53 -4.377 4.216 -4.039 1.00 0.00 C ATOM 884 SD MET A 53 -5.062 4.347 -5.715 1.00 0.00 S ATOM 885 CE MET A 53 -4.557 2.711 -6.297 1.00 0.00 C ATOM 0 H MET A 53 -6.329 5.268 -2.717 1.00 0.00 H new ATOM 0 HA MET A 53 -5.982 2.769 -1.314 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.565 2.202 -3.286 1.00 0.00 H new ATOM 0 HB3 MET A 53 -6.087 2.927 -3.764 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.462 5.172 -3.523 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.316 3.972 -4.085 1.00 0.00 H new ATOM 0 HE1 MET A 53 -4.018 2.810 -7.239 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.908 2.245 -5.555 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.440 2.090 -6.448 1.00 0.00 H new ATOM 895 N GLN A 54 -3.498 4.895 -0.966 1.00 0.00 N ATOM 896 CA GLN A 54 -2.232 5.064 -0.167 1.00 0.00 C ATOM 897 C GLN A 54 -2.553 4.911 1.330 1.00 0.00 C ATOM 898 O GLN A 54 -1.779 4.339 2.073 1.00 0.00 O ATOM 899 CB GLN A 54 -1.699 6.476 -0.459 1.00 0.00 C ATOM 900 CG GLN A 54 -0.797 6.436 -1.693 1.00 0.00 C ATOM 901 CD GLN A 54 -0.236 7.838 -1.966 1.00 0.00 C ATOM 902 OE1 GLN A 54 -0.155 8.655 -1.071 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.160 8.157 -3.175 1.00 0.00 N ATOM 0 H GLN A 54 -3.840 5.736 -1.430 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.487 4.314 -0.435 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.529 7.163 -0.625 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -1.142 6.851 0.400 1.00 0.00 H new ATOM 0 HG2 GLN A 54 0.019 5.731 -1.537 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.361 6.084 -2.557 1.00 0.00 H new ATOM 0 HE21 GLN A 54 0.094 7.474 -3.930 1.00 0.00 H new ATOM 0 HE22 GLN A 54 0.534 9.088 -3.360 1.00 0.00 H new ATOM 912 N LEU A 55 -3.700 5.400 1.784 1.00 0.00 N ATOM 913 CA LEU A 55 -4.056 5.247 3.247 1.00 0.00 C ATOM 914 C LEU A 55 -3.946 3.769 3.669 1.00 0.00 C ATOM 915 O LEU A 55 -3.601 3.472 4.798 1.00 0.00 O ATOM 916 CB LEU A 55 -5.509 5.728 3.410 1.00 0.00 C ATOM 917 CG LEU A 55 -5.527 7.226 3.722 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.954 7.763 3.569 1.00 0.00 C ATOM 919 CD2 LEU A 55 -5.051 7.452 5.160 1.00 0.00 C ATOM 0 H LEU A 55 -4.392 5.889 1.216 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.377 5.828 3.872 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -6.072 5.530 2.498 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.997 5.174 4.212 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.865 7.749 3.031 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.967 8.830 3.791 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.296 7.601 2.547 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.615 7.240 4.260 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -5.063 8.519 5.384 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.714 6.929 5.849 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -4.036 7.069 5.272 1.00 0.00 H new ATOM 931 N HIS A 56 -4.229 2.835 2.773 1.00 0.00 N ATOM 932 CA HIS A 56 -4.121 1.377 3.153 1.00 0.00 C ATOM 933 C HIS A 56 -2.718 1.076 3.710 1.00 0.00 C ATOM 934 O HIS A 56 -2.574 0.312 4.645 1.00 0.00 O ATOM 935 CB HIS A 56 -4.361 0.568 1.869 1.00 0.00 C ATOM 936 CG HIS A 56 -4.754 -0.836 2.230 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.078 -1.229 2.342 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.006 -1.954 2.507 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.088 -2.531 2.675 1.00 0.00 C ATOM 940 NE2 HIS A 56 -4.850 -3.023 2.789 1.00 0.00 N ATOM 0 H HIS A 56 -4.524 3.016 1.814 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.847 1.119 3.924 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.145 1.035 1.273 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.459 0.559 1.258 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -6.896 -0.638 2.198 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -2.927 -1.997 2.506 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -6.987 -3.109 2.831 1.00 0.00 H new ATOM 948 N HIS A 57 -1.683 1.679 3.153 1.00 0.00 N ATOM 949 CA HIS A 57 -0.298 1.416 3.688 1.00 0.00 C ATOM 950 C HIS A 57 -0.217 1.880 5.145 1.00 0.00 C ATOM 951 O HIS A 57 0.185 1.130 6.015 1.00 0.00 O ATOM 952 CB HIS A 57 0.681 2.224 2.823 1.00 0.00 C ATOM 953 CG HIS A 57 1.135 1.382 1.666 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.318 1.632 0.992 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.582 0.281 1.061 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.440 0.700 0.031 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.408 -0.149 0.029 1.00 0.00 N ATOM 0 H HIS A 57 -1.735 2.328 2.368 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.056 0.354 3.652 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.199 3.132 2.460 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.539 2.535 3.419 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.352 -0.181 1.344 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.271 0.644 -0.656 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.259 -0.942 -0.595 1.00 0.00 H new ATOM 965 N GLN A 58 -0.606 3.108 5.426 1.00 0.00 N ATOM 966 CA GLN A 58 -0.555 3.595 6.851 1.00 0.00 C ATOM 967 C GLN A 58 -1.404 2.674 7.749 1.00 0.00 C ATOM 968 O GLN A 58 -1.053 2.429 8.889 1.00 0.00 O ATOM 969 CB GLN A 58 -1.126 5.022 6.852 1.00 0.00 C ATOM 970 CG GLN A 58 -0.703 5.742 8.135 1.00 0.00 C ATOM 971 CD GLN A 58 0.740 6.243 7.990 1.00 0.00 C ATOM 972 OE1 GLN A 58 0.974 7.273 7.389 1.00 0.00 O ATOM 973 NE2 GLN A 58 1.727 5.559 8.515 1.00 0.00 N ATOM 0 H GLN A 58 -0.951 3.784 4.744 1.00 0.00 H new ATOM 0 HA GLN A 58 0.464 3.587 7.237 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.767 5.569 5.980 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.213 4.990 6.782 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.372 6.580 8.332 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.780 5.066 8.986 1.00 0.00 H new ATOM 0 HE21 GLN A 58 1.536 4.694 9.020 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.686 5.892 8.418 1.00 0.00 H new ATOM 982 N ARG A 59 -2.506 2.142 7.246 1.00 0.00 N ATOM 983 CA ARG A 59 -3.339 1.220 8.096 1.00 0.00 C ATOM 984 C ARG A 59 -2.565 -0.086 8.330 1.00 0.00 C ATOM 985 O ARG A 59 -2.424 -0.529 9.456 1.00 0.00 O ATOM 986 CB ARG A 59 -4.640 0.941 7.323 1.00 0.00 C ATOM 987 CG ARG A 59 -5.810 0.871 8.306 1.00 0.00 C ATOM 988 CD ARG A 59 -6.408 2.267 8.488 1.00 0.00 C ATOM 989 NE ARG A 59 -7.488 2.360 7.458 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.651 1.747 7.623 1.00 0.00 C ATOM 991 NH1 ARG A 59 -8.898 1.023 8.691 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.576 1.858 6.705 1.00 0.00 N ATOM 0 H ARG A 59 -2.857 2.304 6.302 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.563 1.664 9.066 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.815 1.727 6.588 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.556 0.003 6.774 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.570 0.184 7.935 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.470 0.482 9.266 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -6.809 2.397 9.493 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.655 3.041 8.342 1.00 0.00 H new ATOM 0 HE ARG A 59 -7.326 2.906 6.612 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -8.187 0.923 9.415 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -9.801 0.560 8.796 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -9.400 2.414 5.868 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.473 1.389 6.826 1.00 0.00 H new ATOM 1006 N SER A 60 -2.044 -0.702 7.282 1.00 0.00 N ATOM 1007 CA SER A 60 -1.264 -1.971 7.481 1.00 0.00 C ATOM 1008 C SER A 60 -0.037 -1.684 8.356 1.00 0.00 C ATOM 1009 O SER A 60 0.324 -2.492 9.180 1.00 0.00 O ATOM 1010 CB SER A 60 -0.825 -2.454 6.090 1.00 0.00 C ATOM 1011 OG SER A 60 -0.075 -1.428 5.452 1.00 0.00 O ATOM 0 H SER A 60 -2.125 -0.385 6.316 1.00 0.00 H new ATOM 0 HA SER A 60 -1.866 -2.733 7.977 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.223 -3.358 6.179 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.698 -2.710 5.489 1.00 0.00 H new ATOM 0 HG SER A 60 -0.305 -0.561 5.847 1.00 0.00 H new ATOM 1017 N ARG A 61 0.602 -0.541 8.198 1.00 0.00 N ATOM 1018 CA ARG A 61 1.801 -0.241 9.063 1.00 0.00 C ATOM 1019 C ARG A 61 1.363 -0.146 10.535 1.00 0.00 C ATOM 1020 O ARG A 61 2.061 -0.606 11.419 1.00 0.00 O ATOM 1021 CB ARG A 61 2.371 1.105 8.589 1.00 0.00 C ATOM 1022 CG ARG A 61 3.759 1.316 9.200 1.00 0.00 C ATOM 1023 CD ARG A 61 4.831 0.851 8.211 1.00 0.00 C ATOM 1024 NE ARG A 61 5.286 2.098 7.524 1.00 0.00 N ATOM 1025 CZ ARG A 61 6.038 2.992 8.149 1.00 0.00 C ATOM 1026 NH1 ARG A 61 6.416 2.818 9.396 1.00 0.00 N ATOM 1027 NH2 ARG A 61 6.416 4.073 7.518 1.00 0.00 N ATOM 0 H ARG A 61 0.354 0.183 7.524 1.00 0.00 H new ATOM 0 HA ARG A 61 2.553 -1.026 8.984 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.435 1.122 7.501 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.706 1.917 8.882 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.905 2.369 9.442 1.00 0.00 H new ATOM 0 HG3 ARG A 61 3.845 0.760 10.133 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.657 0.359 8.725 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.426 0.132 7.498 1.00 0.00 H new ATOM 0 HE ARG A 61 5.012 2.264 6.556 1.00 0.00 H new ATOM 0 HH11 ARG A 61 6.130 1.981 9.903 1.00 0.00 H new ATOM 0 HH12 ARG A 61 6.995 3.520 9.856 1.00 0.00 H new ATOM 0 HH21 ARG A 61 6.132 4.224 6.550 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.995 4.765 7.994 1.00 0.00 H new ATOM 1041 N TYR A 62 0.211 0.439 10.808 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.252 0.540 12.240 1.00 0.00 C ATOM 1043 C TYR A 62 -0.436 -0.874 12.818 1.00 0.00 C ATOM 1044 O TYR A 62 0.073 -1.182 13.880 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.596 1.291 12.216 1.00 0.00 C ATOM 1046 CG TYR A 62 -2.130 1.437 13.621 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.822 0.376 14.216 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.935 2.629 14.328 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.319 0.507 15.516 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.433 2.760 15.630 1.00 0.00 C ATOM 1051 CZ TYR A 62 -3.125 1.699 16.224 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.615 1.828 17.508 1.00 0.00 O ATOM 0 H TYR A 62 -0.418 0.844 10.115 1.00 0.00 H new ATOM 0 HA TYR A 62 0.472 1.066 12.862 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.465 2.274 11.764 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.314 0.750 11.600 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.972 -0.544 13.671 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.400 3.448 13.869 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.853 -0.312 15.975 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.283 3.680 16.176 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.870 1.826 18.144 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.144 -1.741 12.120 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.328 -3.140 12.647 1.00 0.00 C ATOM 1064 C ILE A 63 -0.010 -3.918 12.484 1.00 0.00 C ATOM 1065 O ILE A 63 0.401 -4.643 13.371 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.456 -3.778 11.814 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.754 -2.993 12.044 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.660 -5.233 12.242 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.864 -3.545 11.145 1.00 0.00 C ATOM 0 H ILE A 63 -1.594 -1.546 11.226 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.590 -3.150 13.705 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.187 -3.751 10.758 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -4.052 -3.065 13.090 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.593 -1.936 11.830 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.459 -5.678 11.649 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.737 -5.791 12.085 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -2.929 -5.267 13.298 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.782 -2.983 11.314 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.567 -3.450 10.100 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -5.034 -4.596 11.380 1.00 0.00 H new ATOM 1081 N TYR A 64 0.664 -3.758 11.364 1.00 0.00 N ATOM 1082 CA TYR A 64 1.970 -4.481 11.162 1.00 0.00 C ATOM 1083 C TYR A 64 2.982 -4.056 12.238 1.00 0.00 C ATOM 1084 O TYR A 64 3.804 -4.845 12.655 1.00 0.00 O ATOM 1085 CB TYR A 64 2.485 -4.077 9.769 1.00 0.00 C ATOM 1086 CG TYR A 64 3.674 -4.926 9.397 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.514 -6.301 9.218 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.931 -4.338 9.221 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.607 -7.094 8.866 1.00 0.00 C ATOM 1090 CE2 TYR A 64 6.029 -5.131 8.865 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.867 -6.511 8.688 1.00 0.00 C ATOM 1092 OH TYR A 64 6.947 -7.294 8.338 1.00 0.00 O ATOM 0 H TYR A 64 0.371 -3.165 10.588 1.00 0.00 H new ATOM 0 HA TYR A 64 1.837 -5.560 11.237 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.694 -4.199 9.029 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.764 -3.023 9.766 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.542 -6.752 9.352 1.00 0.00 H new ATOM 0 HD2 TYR A 64 5.055 -3.274 9.359 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.481 -8.158 8.731 1.00 0.00 H new ATOM 0 HE2 TYR A 64 7.000 -4.679 8.727 1.00 0.00 H new ATOM 0 HH TYR A 64 7.745 -6.732 8.254 1.00 0.00 H new ATOM 1102 N THR A 65 2.938 -2.818 12.695 1.00 0.00 N ATOM 1103 CA THR A 65 3.923 -2.384 13.747 1.00 0.00 C ATOM 1104 C THR A 65 3.488 -2.877 15.137 1.00 0.00 C ATOM 1105 O THR A 65 4.321 -3.209 15.959 1.00 0.00 O ATOM 1106 CB THR A 65 3.951 -0.846 13.713 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.231 -0.409 12.391 1.00 0.00 O ATOM 1108 CG2 THR A 65 5.036 -0.332 14.662 1.00 0.00 C ATOM 0 H THR A 65 2.276 -2.104 12.392 1.00 0.00 H new ATOM 0 HA THR A 65 4.910 -2.803 13.551 1.00 0.00 H new ATOM 0 HB THR A 65 2.982 -0.458 14.028 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.410 -0.438 11.856 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.055 0.758 14.637 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.821 -0.668 15.676 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.006 -0.719 14.349 1.00 0.00 H new ATOM 1116 N LEU A 66 2.200 -2.913 15.426 1.00 0.00 N ATOM 1117 CA LEU A 66 1.769 -3.374 16.793 1.00 0.00 C ATOM 1118 C LEU A 66 1.700 -4.916 16.901 1.00 0.00 C ATOM 1119 O LEU A 66 1.965 -5.463 17.956 1.00 0.00 O ATOM 1120 CB LEU A 66 0.398 -2.718 17.077 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.709 -3.325 16.202 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.272 -4.584 16.876 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.832 -2.292 16.029 1.00 0.00 C ATOM 0 H LEU A 66 1.446 -2.650 14.791 1.00 0.00 H new ATOM 0 HA LEU A 66 2.504 -3.071 17.539 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.143 -2.846 18.129 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.462 -1.646 16.893 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.299 -3.594 15.229 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -2.057 -5.011 16.252 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.474 -5.315 17.006 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.686 -4.321 17.850 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.623 -2.714 15.409 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -2.238 -2.029 17.006 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.433 -1.398 15.549 1.00 0.00 H new ATOM 1135 N TYR A 67 1.340 -5.625 15.846 1.00 0.00 N ATOM 1136 CA TYR A 67 1.259 -7.130 15.958 1.00 0.00 C ATOM 1137 C TYR A 67 2.619 -7.805 15.685 1.00 0.00 C ATOM 1138 O TYR A 67 2.924 -8.826 16.275 1.00 0.00 O ATOM 1139 CB TYR A 67 0.214 -7.596 14.925 1.00 0.00 C ATOM 1140 CG TYR A 67 0.051 -9.103 15.007 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.856 -9.936 14.221 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.898 -9.667 15.873 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.715 -11.328 14.301 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.040 -11.058 15.952 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.231 -11.888 15.167 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.370 -13.259 15.243 1.00 0.00 O ATOM 0 H TYR A 67 1.104 -5.239 14.932 1.00 0.00 H new ATOM 0 HA TYR A 67 0.976 -7.412 16.972 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.741 -7.106 15.113 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.527 -7.308 13.921 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.587 -9.505 13.552 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.521 -9.027 16.480 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.337 -11.969 13.694 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.773 -11.490 16.618 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.070 -13.481 15.892 1.00 0.00 H new ATOM 1156 N TYR A 68 3.427 -7.278 14.787 1.00 0.00 N ATOM 1157 CA TYR A 68 4.741 -7.953 14.487 1.00 0.00 C ATOM 1158 C TYR A 68 5.930 -7.309 15.232 1.00 0.00 C ATOM 1159 O TYR A 68 6.958 -7.943 15.390 1.00 0.00 O ATOM 1160 CB TYR A 68 4.935 -7.836 12.969 1.00 0.00 C ATOM 1161 CG TYR A 68 4.264 -8.999 12.275 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.664 -10.311 12.561 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.244 -8.768 11.339 1.00 0.00 C ATOM 1164 CE1 TYR A 68 4.049 -11.388 11.913 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.629 -9.846 10.692 1.00 0.00 C ATOM 1166 CZ TYR A 68 3.033 -11.156 10.979 1.00 0.00 C ATOM 1167 OH TYR A 68 2.427 -12.219 10.340 1.00 0.00 O ATOM 0 H TYR A 68 3.240 -6.426 14.257 1.00 0.00 H new ATOM 0 HA TYR A 68 4.714 -8.989 14.825 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.515 -6.896 12.611 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.998 -7.822 12.729 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.448 -10.491 13.282 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.933 -7.758 11.118 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.359 -12.399 12.134 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.844 -9.668 9.972 1.00 0.00 H new ATOM 0 HH TYR A 68 1.742 -11.883 9.724 1.00 0.00 H new ATOM 1177 N LYS A 69 5.827 -6.073 15.686 1.00 0.00 N ATOM 1178 CA LYS A 69 6.991 -5.452 16.399 1.00 0.00 C ATOM 1179 C LYS A 69 6.623 -5.080 17.846 1.00 0.00 C ATOM 1180 O LYS A 69 7.270 -5.521 18.778 1.00 0.00 O ATOM 1181 CB LYS A 69 7.336 -4.198 15.594 1.00 0.00 C ATOM 1182 CG LYS A 69 7.831 -4.604 14.203 1.00 0.00 C ATOM 1183 CD LYS A 69 6.632 -4.792 13.260 1.00 0.00 C ATOM 1184 CE LYS A 69 6.777 -3.871 12.044 1.00 0.00 C ATOM 1185 NZ LYS A 69 7.848 -4.491 11.216 1.00 0.00 N ATOM 0 H LYS A 69 5.002 -5.481 15.594 1.00 0.00 H new ATOM 0 HA LYS A 69 7.832 -6.142 16.464 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.459 -3.556 15.507 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.103 -3.621 16.111 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.500 -3.840 13.808 1.00 0.00 H new ATOM 0 HG3 LYS A 69 8.405 -5.529 14.266 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.573 -5.831 12.936 1.00 0.00 H new ATOM 0 HD3 LYS A 69 5.705 -4.569 13.788 1.00 0.00 H new ATOM 0 HE2 LYS A 69 5.841 -3.799 11.490 1.00 0.00 H new ATOM 0 HE3 LYS A 69 7.047 -2.859 12.345 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 8.509 -3.755 10.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 8.362 -5.195 11.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 7.422 -4.957 10.390 1.00 0.00 H new ATOM 1199 N ARG A 70 5.598 -4.275 18.049 1.00 0.00 N ATOM 1200 CA ARG A 70 5.224 -3.896 19.463 1.00 0.00 C ATOM 1201 C ARG A 70 4.722 -5.125 20.241 1.00 0.00 C ATOM 1202 O ARG A 70 4.891 -5.205 21.444 1.00 0.00 O ATOM 1203 CB ARG A 70 4.112 -2.843 19.364 1.00 0.00 C ATOM 1204 CG ARG A 70 4.228 -1.863 20.533 1.00 0.00 C ATOM 1205 CD ARG A 70 2.904 -1.118 20.710 1.00 0.00 C ATOM 1206 NE ARG A 70 3.269 0.161 21.392 1.00 0.00 N ATOM 1207 CZ ARG A 70 3.887 1.136 20.743 1.00 0.00 C ATOM 1208 NH1 ARG A 70 4.200 1.021 19.472 1.00 0.00 N ATOM 1209 NH2 ARG A 70 4.193 2.240 21.374 1.00 0.00 N ATOM 0 H ARG A 70 5.015 -3.871 17.317 1.00 0.00 H new ATOM 0 HA ARG A 70 6.090 -3.504 19.996 1.00 0.00 H new ATOM 0 HB2 ARG A 70 4.188 -2.307 18.418 1.00 0.00 H new ATOM 0 HB3 ARG A 70 3.136 -3.328 19.378 1.00 0.00 H new ATOM 0 HG2 ARG A 70 4.480 -2.400 21.447 1.00 0.00 H new ATOM 0 HG3 ARG A 70 5.034 -1.153 20.347 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.425 -0.930 19.749 1.00 0.00 H new ATOM 0 HD3 ARG A 70 2.201 -1.698 21.308 1.00 0.00 H new ATOM 0 HE ARG A 70 3.037 0.285 22.378 1.00 0.00 H new ATOM 0 HH11 ARG A 70 3.967 0.167 18.965 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.676 1.785 18.993 1.00 0.00 H new ATOM 0 HH21 ARG A 70 3.956 2.346 22.360 1.00 0.00 H new ATOM 0 HH22 ARG A 70 4.669 2.995 20.880 1.00 0.00 H new ATOM 1223 N LYS A 71 4.099 -6.087 19.579 1.00 0.00 N ATOM 1224 CA LYS A 71 3.586 -7.300 20.297 1.00 0.00 C ATOM 1225 C LYS A 71 2.588 -6.886 21.387 1.00 0.00 C ATOM 1226 O LYS A 71 2.622 -7.395 22.491 1.00 0.00 O ATOM 1227 CB LYS A 71 4.815 -7.982 20.914 1.00 0.00 C ATOM 1228 CG LYS A 71 4.457 -9.414 21.313 1.00 0.00 C ATOM 1229 CD LYS A 71 5.703 -10.120 21.854 1.00 0.00 C ATOM 1230 CE LYS A 71 5.944 -9.689 23.303 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.588 -10.866 23.950 1.00 0.00 N ATOM 0 H LYS A 71 3.927 -6.078 18.574 1.00 0.00 H new ATOM 0 HA LYS A 71 3.061 -7.976 19.622 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.638 -7.987 20.200 1.00 0.00 H new ATOM 0 HB3 LYS A 71 5.154 -7.424 21.787 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.673 -9.407 22.070 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.064 -9.955 20.452 1.00 0.00 H new ATOM 0 HD2 LYS A 71 5.573 -11.201 21.802 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.569 -9.873 21.241 1.00 0.00 H new ATOM 0 HE2 LYS A 71 6.587 -8.810 23.352 1.00 0.00 H new ATOM 0 HE3 LYS A 71 5.009 -9.428 23.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 6.785 -10.649 24.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 5.950 -11.685 23.893 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 7.479 -11.087 23.461 1.00 0.00 H new ATOM 1245 N ALA A 72 1.689 -5.975 21.080 1.00 0.00 N ATOM 1246 CA ALA A 72 0.680 -5.541 22.092 1.00 0.00 C ATOM 1247 C ALA A 72 -0.733 -5.910 21.607 1.00 0.00 C ATOM 1248 O ALA A 72 -1.671 -5.157 21.796 1.00 0.00 O ATOM 1249 CB ALA A 72 0.837 -4.024 22.186 1.00 0.00 C ATOM 0 H ALA A 72 1.615 -5.517 20.172 1.00 0.00 H new ATOM 0 HA ALA A 72 0.825 -6.021 23.060 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.127 -3.629 22.912 1.00 0.00 H new ATOM 0 HB2 ALA A 72 1.852 -3.782 22.502 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.645 -3.577 21.211 1.00 0.00 H new ATOM 1255 N ILE A 73 -0.893 -7.058 20.976 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.246 -7.460 20.476 1.00 0.00 C ATOM 1257 C ILE A 73 -2.334 -8.994 20.353 1.00 0.00 C ATOM 1258 O ILE A 73 -1.322 -9.670 20.331 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.369 -6.789 19.098 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.726 -7.133 18.473 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.247 -7.276 18.174 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -3.907 -6.351 17.169 1.00 0.00 C ATOM 0 H ILE A 73 -0.146 -7.727 20.789 1.00 0.00 H new ATOM 0 HA ILE A 73 -3.048 -7.156 21.148 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.288 -5.709 19.224 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.786 -8.204 18.278 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.529 -6.890 19.168 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.343 -6.795 17.201 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.281 -7.023 18.610 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.319 -8.357 18.053 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.873 -6.598 16.728 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.866 -5.282 17.377 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.111 -6.616 16.473 1.00 0.00 H new ATOM 1274 N SER A 74 -3.524 -9.548 20.261 1.00 0.00 N ATOM 1275 CA SER A 74 -3.643 -11.033 20.129 1.00 0.00 C ATOM 1276 C SER A 74 -4.081 -11.400 18.702 1.00 0.00 C ATOM 1277 O SER A 74 -4.827 -10.671 18.079 1.00 0.00 O ATOM 1278 CB SER A 74 -4.711 -11.451 21.142 1.00 0.00 C ATOM 1279 OG SER A 74 -4.089 -11.739 22.387 1.00 0.00 O ATOM 0 H SER A 74 -4.408 -9.039 20.272 1.00 0.00 H new ATOM 0 HA SER A 74 -2.695 -11.538 20.316 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.444 -10.654 21.264 1.00 0.00 H new ATOM 0 HB3 SER A 74 -5.249 -12.327 20.780 1.00 0.00 H new ATOM 0 HG SER A 74 -4.770 -12.006 23.039 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.617 -12.521 18.174 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.011 -12.931 16.769 1.00 0.00 C ATOM 1287 C LYS A 75 -5.528 -12.777 16.537 1.00 0.00 C ATOM 1288 O LYS A 75 -5.953 -12.464 15.442 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.613 -14.408 16.618 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.429 -14.737 15.135 1.00 0.00 C ATOM 1291 CD LYS A 75 -4.742 -15.279 14.566 1.00 0.00 C ATOM 1292 CE LYS A 75 -4.569 -15.571 13.074 1.00 0.00 C ATOM 1293 NZ LYS A 75 -3.892 -16.897 13.018 1.00 0.00 N ATOM 0 H LYS A 75 -2.987 -13.167 18.650 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.511 -12.295 16.039 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.689 -14.604 17.162 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.381 -15.049 17.051 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.124 -13.844 14.589 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.635 -15.473 15.011 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.032 -16.187 15.094 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.542 -14.554 14.715 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.531 -15.597 12.563 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.970 -14.801 12.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.098 -16.854 12.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.534 -17.144 13.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.571 -17.620 12.705 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.350 -12.983 17.552 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.835 -12.822 17.344 1.00 0.00 C ATOM 1309 C ASP A 76 -8.136 -11.375 16.931 1.00 0.00 C ATOM 1310 O ASP A 76 -8.814 -11.139 15.948 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.516 -13.149 18.682 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.504 -14.663 18.905 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -9.232 -15.350 18.208 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -7.766 -15.109 19.768 1.00 0.00 O ATOM 0 H ASP A 76 -6.064 -13.250 18.494 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.201 -13.484 16.559 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -7.997 -12.646 19.498 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.541 -12.779 18.680 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.618 -10.401 17.656 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.873 -8.973 17.258 1.00 0.00 C ATOM 1321 C LEU A 77 -7.159 -8.701 15.926 1.00 0.00 C ATOM 1322 O LEU A 77 -7.718 -8.093 15.033 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.295 -8.081 18.370 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.545 -6.609 18.030 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.034 -6.292 18.184 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.734 -5.719 18.980 1.00 0.00 C ATOM 0 H LEU A 77 -7.042 -10.530 18.488 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.937 -8.771 17.132 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.758 -8.328 19.325 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.226 -8.263 18.477 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.238 -6.419 17.001 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.210 -5.244 17.942 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.612 -6.923 17.508 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.342 -6.483 19.212 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.912 -4.671 18.738 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.040 -5.911 20.008 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.673 -5.942 18.870 1.00 0.00 H new ATOM 1338 N TYR A 78 -5.933 -9.169 15.776 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.203 -8.946 14.477 1.00 0.00 C ATOM 1340 C TYR A 78 -5.982 -9.621 13.331 1.00 0.00 C ATOM 1341 O TYR A 78 -6.085 -9.073 12.249 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.804 -9.579 14.643 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.019 -9.485 13.347 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -2.985 -8.285 12.626 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.322 -10.604 12.873 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.256 -8.204 11.432 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.594 -10.522 11.680 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.560 -9.323 10.961 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.842 -9.244 9.785 1.00 0.00 O ATOM 0 H TYR A 78 -5.414 -9.687 16.485 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.114 -7.887 14.236 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.262 -9.072 15.441 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.904 -10.623 14.939 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.521 -7.421 12.990 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.346 -11.530 13.428 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.231 -7.279 10.876 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.058 -11.386 11.315 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.418 -10.108 9.602 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.551 -10.791 13.562 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.337 -11.460 12.466 1.00 0.00 C ATOM 1361 C ASP A 79 -8.682 -10.738 12.305 1.00 0.00 C ATOM 1362 O ASP A 79 -9.131 -10.502 11.200 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.557 -12.918 12.900 1.00 0.00 C ATOM 1364 CG ASP A 79 -7.979 -13.752 11.689 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -8.910 -13.347 11.011 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -7.366 -14.781 11.460 1.00 0.00 O ATOM 0 H ASP A 79 -6.506 -11.301 14.444 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.813 -11.424 11.511 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.642 -13.322 13.332 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.323 -12.967 13.674 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.323 -10.365 13.397 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.634 -9.631 13.276 1.00 0.00 C ATOM 1373 C TRP A 80 -10.415 -8.325 12.492 1.00 0.00 C ATOM 1374 O TRP A 80 -11.241 -7.939 11.687 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.105 -9.330 14.711 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.417 -8.611 14.681 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.620 -9.197 14.495 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.675 -7.186 14.842 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.602 -8.223 14.530 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.068 -6.967 14.742 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.843 -6.074 15.062 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.618 -5.689 14.857 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.392 -4.786 15.178 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.778 -4.595 15.075 1.00 0.00 C ATOM 0 H TRP A 80 -9.002 -10.533 14.350 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.381 -10.220 12.744 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.203 -10.259 15.272 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.361 -8.723 15.227 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.788 -10.253 14.344 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.598 -8.410 14.414 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.775 -6.211 15.142 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.686 -5.547 14.778 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.744 -3.939 15.347 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.195 -3.603 15.164 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.301 -7.648 12.707 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.047 -6.379 11.944 1.00 0.00 C ATOM 1397 C LEU A 81 -8.871 -6.709 10.457 1.00 0.00 C ATOM 1398 O LEU A 81 -9.566 -6.175 9.615 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.742 -5.777 12.495 1.00 0.00 C ATOM 1400 CG LEU A 81 -7.926 -5.385 13.959 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.565 -5.377 14.657 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.538 -3.987 14.035 1.00 0.00 C ATOM 0 H LEU A 81 -8.571 -7.916 13.367 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.876 -5.680 12.053 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.931 -6.499 12.402 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.459 -4.903 11.909 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.585 -6.102 14.448 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.694 -5.097 15.703 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.121 -6.371 14.599 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.909 -4.657 14.167 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.671 -3.704 15.079 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -7.875 -3.273 13.547 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.506 -3.986 13.533 1.00 0.00 H new ATOM 1414 N ILE A 82 -7.945 -7.587 10.120 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.741 -7.930 8.667 1.00 0.00 C ATOM 1416 C ILE A 82 -9.060 -8.438 8.030 1.00 0.00 C ATOM 1417 O ILE A 82 -9.264 -8.289 6.839 1.00 0.00 O ATOM 1418 CB ILE A 82 -6.600 -8.988 8.618 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.846 -8.851 7.290 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -7.135 -10.422 8.756 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -4.636 -7.934 7.483 1.00 0.00 C ATOM 0 H ILE A 82 -7.332 -8.073 10.775 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.457 -7.056 8.082 1.00 0.00 H new ATOM 0 HB ILE A 82 -5.934 -8.802 9.460 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.521 -9.831 6.941 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.507 -8.443 6.525 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.304 -11.126 8.716 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.654 -10.527 9.709 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -7.827 -10.632 7.941 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.099 -7.836 6.539 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.973 -6.951 7.812 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -3.972 -8.361 8.235 1.00 0.00 H new ATOM 1433 N LYS A 83 -9.957 -9.025 8.805 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.248 -9.518 8.209 1.00 0.00 C ATOM 1435 C LYS A 83 -12.344 -8.427 8.226 1.00 0.00 C ATOM 1436 O LYS A 83 -13.343 -8.561 7.542 1.00 0.00 O ATOM 1437 CB LYS A 83 -11.682 -10.719 9.063 1.00 0.00 C ATOM 1438 CG LYS A 83 -12.808 -11.473 8.351 1.00 0.00 C ATOM 1439 CD LYS A 83 -12.220 -12.330 7.228 1.00 0.00 C ATOM 1440 CE LYS A 83 -11.438 -13.499 7.832 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.404 -14.532 6.761 1.00 0.00 N ATOM 0 H LYS A 83 -9.851 -9.181 9.807 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.103 -9.791 7.164 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -10.835 -11.384 9.231 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -12.020 -10.379 10.042 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -13.343 -12.103 9.061 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -13.531 -10.767 7.943 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -13.018 -12.705 6.587 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -11.565 -11.726 6.601 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -10.432 -13.195 8.119 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -11.925 -13.878 8.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.884 -15.366 7.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -12.376 -14.807 6.513 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -10.929 -14.145 5.921 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.188 -7.355 8.987 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.253 -6.295 9.006 1.00 0.00 C ATOM 1457 C GLU A 84 -12.807 -5.014 8.260 1.00 0.00 C ATOM 1458 O GLU A 84 -13.305 -3.940 8.536 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.476 -5.983 10.478 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.040 -7.207 11.193 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.432 -7.526 10.645 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.241 -6.616 10.571 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.665 -8.676 10.309 1.00 0.00 O ATOM 0 H GLU A 84 -11.381 -7.175 9.585 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.156 -6.642 8.504 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.536 -5.683 10.941 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.164 -5.144 10.580 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.378 -8.061 11.051 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.094 -7.021 12.266 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.883 -5.121 7.317 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.388 -3.935 6.517 1.00 0.00 C ATOM 1472 C LYS A 85 -10.414 -3.064 7.322 1.00 0.00 C ATOM 1473 O LYS A 85 -10.709 -1.931 7.652 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.619 -3.122 6.077 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.356 -2.499 4.705 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.683 -2.305 3.971 1.00 0.00 C ATOM 1477 CE LYS A 85 -14.086 -3.614 3.289 1.00 0.00 C ATOM 1478 NZ LYS A 85 -14.876 -3.200 2.096 1.00 0.00 N ATOM 0 H LYS A 85 -11.441 -6.004 7.063 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.831 -4.288 5.649 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.497 -3.767 6.033 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.833 -2.342 6.807 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.848 -1.541 4.820 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.696 -3.142 4.122 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -14.457 -1.995 4.673 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -13.588 -1.511 3.230 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -13.210 -4.194 3.000 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -14.678 -4.241 3.956 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -15.188 -4.045 1.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -15.707 -2.655 2.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -14.285 -2.610 1.476 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.239 -3.583 7.621 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.228 -2.792 8.380 1.00 0.00 C ATOM 1494 C TYR A 86 -6.876 -2.887 7.659 1.00 0.00 C ATOM 1495 O TYR A 86 -6.343 -1.899 7.192 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.141 -3.456 9.755 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.363 -3.116 10.571 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.617 -3.645 10.231 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.237 -2.270 11.678 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.740 -3.321 11.006 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.359 -1.950 12.450 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.609 -2.475 12.114 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.716 -2.160 12.875 1.00 0.00 O ATOM 0 H TYR A 86 -8.943 -4.526 7.367 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.495 -1.738 8.462 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.059 -4.537 9.641 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.243 -3.121 10.273 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.717 -4.298 9.377 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.271 -1.863 11.937 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.708 -3.725 10.748 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.259 -1.298 13.305 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.439 -1.984 13.798 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.325 -4.076 7.555 1.00 0.00 N ATOM 1514 CA ALA A 87 -5.019 -4.247 6.854 1.00 0.00 C ATOM 1515 C ALA A 87 -5.114 -5.432 5.880 1.00 0.00 C ATOM 1516 O ALA A 87 -6.067 -6.189 5.921 1.00 0.00 O ATOM 1517 CB ALA A 87 -4.006 -4.540 7.961 1.00 0.00 C ATOM 0 H ALA A 87 -6.729 -4.935 7.928 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.735 -3.369 6.274 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -3.018 -4.678 7.523 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.979 -3.704 8.660 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.298 -5.447 8.491 1.00 0.00 H new ATOM 1523 N ASP A 88 -4.146 -5.603 5.004 1.00 0.00 N ATOM 1524 CA ASP A 88 -4.210 -6.744 4.041 1.00 0.00 C ATOM 1525 C ASP A 88 -2.982 -7.652 4.199 1.00 0.00 C ATOM 1526 O ASP A 88 -1.874 -7.262 3.882 1.00 0.00 O ATOM 1527 CB ASP A 88 -4.220 -6.094 2.657 1.00 0.00 C ATOM 1528 CG ASP A 88 -4.609 -7.136 1.606 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.872 -8.095 1.449 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -5.638 -6.955 0.976 1.00 0.00 O ATOM 0 H ASP A 88 -3.324 -5.005 4.918 1.00 0.00 H new ATOM 0 HA ASP A 88 -5.087 -7.370 4.206 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -4.925 -5.263 2.639 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -3.237 -5.682 2.430 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.168 -8.867 4.682 1.00 0.00 N ATOM 1536 CA LYS A 89 -1.989 -9.793 4.845 1.00 0.00 C ATOM 1537 C LYS A 89 -1.293 -10.014 3.489 1.00 0.00 C ATOM 1538 O LYS A 89 -0.084 -10.145 3.430 1.00 0.00 O ATOM 1539 CB LYS A 89 -2.542 -11.125 5.376 1.00 0.00 C ATOM 1540 CG LYS A 89 -2.596 -11.082 6.905 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.276 -12.469 7.467 1.00 0.00 C ATOM 1542 CE LYS A 89 -3.062 -12.691 8.761 1.00 0.00 C ATOM 1543 NZ LYS A 89 -2.257 -13.675 9.536 1.00 0.00 N ATOM 0 H LYS A 89 -4.069 -9.252 4.966 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.254 -9.371 5.530 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -3.538 -11.305 4.971 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -1.911 -11.950 5.047 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -1.882 -10.351 7.284 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -3.585 -10.763 7.236 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -2.533 -13.237 6.737 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -1.207 -12.557 7.659 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.185 -11.759 9.313 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.062 -13.074 8.555 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -2.732 -13.878 10.438 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -2.163 -14.554 8.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.313 -13.281 9.723 1.00 0.00 H new ATOM 1557 N LEU A 90 -2.037 -10.061 2.397 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.382 -10.278 1.055 1.00 0.00 C ATOM 1559 C LEU A 90 -0.339 -9.181 0.794 1.00 0.00 C ATOM 1560 O LEU A 90 0.735 -9.457 0.292 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.496 -10.212 -0.002 1.00 0.00 C ATOM 1562 CG LEU A 90 -2.044 -10.943 -1.267 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -2.057 -12.453 -1.018 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.997 -10.609 -2.417 1.00 0.00 C ATOM 0 H LEU A 90 -3.052 -9.960 2.376 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.870 -11.240 1.021 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.408 -10.666 0.387 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.731 -9.173 -0.234 1.00 0.00 H new ATOM 0 HG LEU A 90 -1.034 -10.626 -1.527 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.735 -12.973 -1.920 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.379 -12.693 -0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -3.067 -12.770 -0.757 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.675 -11.130 -3.319 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -4.007 -10.925 -2.156 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -2.988 -9.534 -2.596 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.633 -7.941 1.141 1.00 0.00 N ATOM 1577 CA LEU A 91 0.382 -6.853 0.909 1.00 0.00 C ATOM 1578 C LEU A 91 1.537 -7.039 1.898 1.00 0.00 C ATOM 1579 O LEU A 91 2.691 -7.065 1.508 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.331 -5.507 1.143 1.00 0.00 C ATOM 1581 CG LEU A 91 0.664 -4.347 0.980 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.256 -4.355 -0.434 1.00 0.00 C ATOM 1583 CD2 LEU A 91 -0.060 -3.021 1.216 1.00 0.00 C ATOM 0 H LEU A 91 -1.511 -7.641 1.565 1.00 0.00 H new ATOM 0 HA LEU A 91 0.789 -6.884 -0.102 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.152 -5.394 0.436 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.766 -5.486 2.142 1.00 0.00 H new ATOM 0 HG LEU A 91 1.469 -4.464 1.705 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.960 -3.529 -0.539 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.775 -5.298 -0.606 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.455 -4.244 -1.165 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.644 -2.197 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.867 -2.913 0.491 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.474 -3.007 2.224 1.00 0.00 H new ATOM 1595 N ILE A 92 1.242 -7.200 3.175 1.00 0.00 N ATOM 1596 CA ILE A 92 2.353 -7.419 4.166 1.00 0.00 C ATOM 1597 C ILE A 92 3.122 -8.710 3.798 1.00 0.00 C ATOM 1598 O ILE A 92 4.311 -8.805 4.037 1.00 0.00 O ATOM 1599 CB ILE A 92 1.693 -7.522 5.562 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.094 -6.152 5.925 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.744 -7.915 6.612 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.414 -6.209 7.299 1.00 0.00 C ATOM 0 H ILE A 92 0.300 -7.190 3.566 1.00 0.00 H new ATOM 0 HA ILE A 92 3.075 -6.602 4.160 1.00 0.00 H new ATOM 0 HB ILE A 92 0.912 -8.282 5.543 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.879 -5.396 5.932 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.370 -5.853 5.167 1.00 0.00 H new ATOM 0 HG21 ILE A 92 2.271 -7.985 7.592 1.00 0.00 H new ATOM 0 HG22 ILE A 92 3.178 -8.879 6.349 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.529 -7.159 6.641 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -0.004 -5.231 7.539 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.385 -6.950 7.279 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.147 -6.486 8.057 1.00 0.00 H new ATOM 1614 N ALA A 93 2.466 -9.694 3.200 1.00 0.00 N ATOM 1615 CA ALA A 93 3.206 -10.949 2.813 1.00 0.00 C ATOM 1616 C ALA A 93 4.221 -10.623 1.705 1.00 0.00 C ATOM 1617 O ALA A 93 5.362 -11.039 1.769 1.00 0.00 O ATOM 1618 CB ALA A 93 2.156 -11.945 2.295 1.00 0.00 C ATOM 0 H ALA A 93 1.473 -9.681 2.969 1.00 0.00 H new ATOM 0 HA ALA A 93 3.749 -11.368 3.660 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.648 -12.873 2.002 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.431 -12.152 3.082 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.644 -11.518 1.433 1.00 0.00 H new ATOM 1624 N LYS A 94 3.826 -9.868 0.691 1.00 0.00 N ATOM 1625 CA LYS A 94 4.806 -9.519 -0.402 1.00 0.00 C ATOM 1626 C LYS A 94 6.002 -8.764 0.192 1.00 0.00 C ATOM 1627 O LYS A 94 7.138 -9.052 -0.131 1.00 0.00 O ATOM 1628 CB LYS A 94 4.064 -8.635 -1.422 1.00 0.00 C ATOM 1629 CG LYS A 94 3.430 -9.519 -2.504 1.00 0.00 C ATOM 1630 CD LYS A 94 2.052 -8.976 -2.872 1.00 0.00 C ATOM 1631 CE LYS A 94 1.601 -9.583 -4.202 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.482 -11.044 -3.936 1.00 0.00 N ATOM 0 H LYS A 94 2.887 -9.487 0.576 1.00 0.00 H new ATOM 0 HA LYS A 94 5.185 -10.419 -0.886 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.294 -8.050 -0.919 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.757 -7.927 -1.877 1.00 0.00 H new ATOM 0 HG2 LYS A 94 4.069 -9.544 -3.387 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.343 -10.544 -2.144 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.334 -9.217 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 94 2.087 -7.889 -2.950 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.649 -9.162 -4.526 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.324 -9.383 -4.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 0.832 -11.471 -4.627 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 2.418 -11.490 -4.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.113 -11.193 -2.975 1.00 0.00 H new ATOM 1646 N TRP A 95 5.765 -7.808 1.072 1.00 0.00 N ATOM 1647 CA TRP A 95 6.924 -7.058 1.683 1.00 0.00 C ATOM 1648 C TRP A 95 7.886 -8.037 2.386 1.00 0.00 C ATOM 1649 O TRP A 95 9.084 -7.825 2.395 1.00 0.00 O ATOM 1650 CB TRP A 95 6.335 -6.067 2.707 1.00 0.00 C ATOM 1651 CG TRP A 95 6.035 -4.746 2.051 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.786 -4.156 1.088 1.00 0.00 C ATOM 1653 CD2 TRP A 95 4.923 -3.838 2.306 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.204 -2.954 0.737 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.055 -2.713 1.458 1.00 0.00 C ATOM 1656 CE3 TRP A 95 3.821 -3.882 3.180 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.131 -1.669 1.476 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 2.889 -2.832 3.200 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.044 -1.728 2.349 1.00 0.00 C ATOM 0 H TRP A 95 4.840 -7.519 1.389 1.00 0.00 H new ATOM 0 HA TRP A 95 7.490 -6.532 0.914 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.424 -6.480 3.139 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.039 -5.921 3.527 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.693 -4.561 0.664 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.579 -2.322 0.030 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.691 -4.728 3.839 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.256 -0.821 0.819 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.047 -2.875 3.875 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.323 -0.924 2.369 1.00 0.00 H new ATOM 1670 N ARG A 96 7.379 -9.109 2.963 1.00 0.00 N ATOM 1671 CA ARG A 96 8.294 -10.092 3.647 1.00 0.00 C ATOM 1672 C ARG A 96 8.947 -11.024 2.610 1.00 0.00 C ATOM 1673 O ARG A 96 10.092 -11.408 2.757 1.00 0.00 O ATOM 1674 CB ARG A 96 7.421 -10.899 4.622 1.00 0.00 C ATOM 1675 CG ARG A 96 7.195 -10.091 5.908 1.00 0.00 C ATOM 1676 CD ARG A 96 5.705 -10.097 6.278 1.00 0.00 C ATOM 1677 NE ARG A 96 5.649 -10.653 7.666 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.786 -11.949 7.894 1.00 0.00 C ATOM 1679 NH1 ARG A 96 5.979 -12.802 6.914 1.00 0.00 N ATOM 1680 NH2 ARG A 96 5.732 -12.398 9.122 1.00 0.00 N ATOM 0 H ARG A 96 6.387 -9.344 2.991 1.00 0.00 H new ATOM 0 HA ARG A 96 9.098 -9.580 4.175 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.464 -11.136 4.157 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.904 -11.847 4.858 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.782 -10.516 6.722 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.539 -9.066 5.768 1.00 0.00 H new ATOM 0 HD2 ARG A 96 5.285 -9.092 6.239 1.00 0.00 H new ATOM 0 HD3 ARG A 96 5.129 -10.710 5.584 1.00 0.00 H new ATOM 0 HE ARG A 96 5.502 -10.020 8.452 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.026 -12.470 5.951 1.00 0.00 H new ATOM 0 HH12 ARG A 96 6.082 -13.796 7.116 1.00 0.00 H new ATOM 0 HH21 ARG A 96 5.585 -11.750 9.896 1.00 0.00 H new ATOM 0 HH22 ARG A 96 5.837 -13.396 9.305 1.00 0.00 H new ATOM 1694 N LYS A 97 8.236 -11.393 1.559 1.00 0.00 N ATOM 1695 CA LYS A 97 8.844 -12.303 0.516 1.00 0.00 C ATOM 1696 C LYS A 97 10.175 -11.726 0.003 1.00 0.00 C ATOM 1697 O LYS A 97 10.608 -10.676 0.442 1.00 0.00 O ATOM 1698 CB LYS A 97 7.841 -12.373 -0.650 1.00 0.00 C ATOM 1699 CG LYS A 97 6.860 -13.527 -0.443 1.00 0.00 C ATOM 1700 CD LYS A 97 7.619 -14.857 -0.439 1.00 0.00 C ATOM 1701 CE LYS A 97 6.691 -15.977 -0.913 1.00 0.00 C ATOM 1702 NZ LYS A 97 6.071 -16.515 0.330 1.00 0.00 N ATOM 0 H LYS A 97 7.273 -11.108 1.379 1.00 0.00 H new ATOM 0 HA LYS A 97 9.043 -13.287 0.940 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.295 -11.433 -0.725 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.376 -12.507 -1.590 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.327 -13.399 0.499 1.00 0.00 H new ATOM 0 HG3 LYS A 97 6.112 -13.527 -1.235 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.490 -14.792 -1.091 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.986 -15.075 0.564 1.00 0.00 H new ATOM 0 HE2 LYS A 97 5.934 -15.598 -1.600 1.00 0.00 H new ATOM 0 HE3 LYS A 97 7.245 -16.751 -1.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.420 -17.289 0.086 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.815 -16.874 0.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 5.544 -15.758 0.811 1.00 0.00 H new ATOM 1716 N THR A 98 10.818 -12.392 -0.935 1.00 0.00 N ATOM 1717 CA THR A 98 12.107 -11.860 -1.479 1.00 0.00 C ATOM 1718 C THR A 98 11.873 -11.291 -2.883 1.00 0.00 C ATOM 1719 O THR A 98 11.121 -11.849 -3.661 1.00 0.00 O ATOM 1720 CB THR A 98 13.068 -13.054 -1.531 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.324 -14.264 -1.556 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.973 -13.032 -0.299 1.00 0.00 C ATOM 0 H THR A 98 10.505 -13.274 -1.342 1.00 0.00 H new ATOM 0 HA THR A 98 12.514 -11.058 -0.863 1.00 0.00 H new ATOM 0 HB THR A 98 13.679 -12.990 -2.431 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.939 -15.026 -1.591 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.657 -13.880 -0.335 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.546 -12.105 -0.285 1.00 0.00 H new ATOM 0 HG23 THR A 98 13.363 -13.095 0.602 1.00 0.00 H new ATOM 1730 N GLY A 99 12.491 -10.174 -3.213 1.00 0.00 N ATOM 1731 CA GLY A 99 12.270 -9.574 -4.560 1.00 0.00 C ATOM 1732 C GLY A 99 11.304 -8.376 -4.452 1.00 0.00 C ATOM 1733 O GLY A 99 11.366 -7.462 -5.252 1.00 0.00 O ATOM 0 H GLY A 99 13.132 -9.661 -2.608 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.221 -9.248 -4.982 1.00 0.00 H new ATOM 0 HA3 GLY A 99 11.860 -10.323 -5.238 1.00 0.00 H new ATOM 1737 N TYR A 100 10.415 -8.360 -3.469 1.00 0.00 N ATOM 1738 CA TYR A 100 9.468 -7.201 -3.339 1.00 0.00 C ATOM 1739 C TYR A 100 10.065 -6.146 -2.391 1.00 0.00 C ATOM 1740 O TYR A 100 9.475 -5.810 -1.380 1.00 0.00 O ATOM 1741 CB TYR A 100 8.171 -7.766 -2.743 1.00 0.00 C ATOM 1742 CG TYR A 100 7.592 -8.822 -3.653 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.107 -8.471 -4.917 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.526 -10.150 -3.221 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.556 -9.451 -5.752 1.00 0.00 C ATOM 1746 CE2 TYR A 100 6.974 -11.132 -4.052 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.489 -10.783 -5.320 1.00 0.00 C ATOM 1748 OH TYR A 100 5.945 -11.749 -6.141 1.00 0.00 O ATOM 0 H TYR A 100 10.310 -9.090 -2.765 1.00 0.00 H new ATOM 0 HA TYR A 100 9.286 -6.725 -4.302 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.370 -8.193 -1.760 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.448 -6.963 -2.601 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.157 -7.445 -5.249 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.901 -10.419 -2.245 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.183 -9.181 -6.729 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.922 -12.157 -3.717 1.00 0.00 H new ATOM 0 HH TYR A 100 5.977 -12.618 -5.689 1.00 0.00 H new ATOM 1758 N GLU A 101 11.229 -5.617 -2.706 1.00 0.00 N ATOM 1759 CA GLU A 101 11.843 -4.581 -1.802 1.00 0.00 C ATOM 1760 C GLU A 101 11.228 -3.198 -2.074 1.00 0.00 C ATOM 1761 O GLU A 101 11.048 -2.413 -1.162 1.00 0.00 O ATOM 1762 CB GLU A 101 13.348 -4.566 -2.111 1.00 0.00 C ATOM 1763 CG GLU A 101 13.941 -5.949 -1.835 1.00 0.00 C ATOM 1764 CD GLU A 101 15.155 -6.174 -2.737 1.00 0.00 C ATOM 1765 OE1 GLU A 101 14.966 -6.651 -3.844 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.254 -5.865 -2.307 1.00 0.00 O ATOM 0 H GLU A 101 11.774 -5.852 -3.536 1.00 0.00 H new ATOM 0 HA GLU A 101 11.659 -4.818 -0.754 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.513 -4.289 -3.152 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.848 -3.816 -1.499 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.233 -6.028 -0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.192 -6.720 -2.016 1.00 0.00 H new ATOM 1773 N LYS A 102 10.909 -2.884 -3.315 1.00 0.00 N ATOM 1774 CA LYS A 102 10.315 -1.546 -3.616 1.00 0.00 C ATOM 1775 C LYS A 102 8.922 -1.700 -4.252 1.00 0.00 C ATOM 1776 O LYS A 102 8.725 -1.360 -5.406 1.00 0.00 O ATOM 1777 CB LYS A 102 11.291 -0.899 -4.601 1.00 0.00 C ATOM 1778 CG LYS A 102 12.473 -0.294 -3.835 1.00 0.00 C ATOM 1779 CD LYS A 102 12.269 1.218 -3.673 1.00 0.00 C ATOM 1780 CE LYS A 102 13.125 1.968 -4.696 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.662 3.147 -3.959 1.00 0.00 N ATOM 0 H LYS A 102 11.035 -3.495 -4.122 1.00 0.00 H new ATOM 0 HA LYS A 102 10.178 -0.945 -2.717 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.649 -1.642 -5.314 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.783 -0.125 -5.176 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.563 -0.765 -2.856 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.403 -0.489 -4.369 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.217 1.469 -3.811 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.540 1.525 -2.663 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.931 1.338 -5.074 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.532 2.277 -5.556 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.260 3.711 -4.596 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.873 3.731 -3.617 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.228 2.822 -3.150 1.00 0.00 H new ATOM 1795 N LEU A 103 7.947 -2.199 -3.515 1.00 0.00 N ATOM 1796 CA LEU A 103 6.579 -2.350 -4.098 1.00 0.00 C ATOM 1797 C LEU A 103 5.618 -1.326 -3.452 1.00 0.00 C ATOM 1798 O LEU A 103 5.794 -0.946 -2.310 1.00 0.00 O ATOM 1799 CB LEU A 103 6.175 -3.821 -3.823 1.00 0.00 C ATOM 1800 CG LEU A 103 5.464 -3.980 -2.468 1.00 0.00 C ATOM 1801 CD1 LEU A 103 3.970 -3.692 -2.644 1.00 0.00 C ATOM 1802 CD2 LEU A 103 5.650 -5.409 -1.956 1.00 0.00 C ATOM 0 H LEU A 103 8.044 -2.503 -2.546 1.00 0.00 H new ATOM 0 HA LEU A 103 6.543 -2.148 -5.169 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.519 -4.172 -4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 103 7.064 -4.451 -3.842 1.00 0.00 H new ATOM 0 HG LEU A 103 5.890 -3.280 -1.749 1.00 0.00 H new ATOM 0 HD11 LEU A 103 3.463 -3.804 -1.686 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.836 -2.674 -3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.546 -4.393 -3.363 1.00 0.00 H new ATOM 0 HD21 LEU A 103 5.146 -5.520 -0.996 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.224 -6.111 -2.673 1.00 0.00 H new ATOM 0 HD23 LEU A 103 6.713 -5.616 -1.834 1.00 0.00 H new ATOM 1814 N CYS A 104 4.618 -0.868 -4.177 1.00 0.00 N ATOM 1815 CA CYS A 104 3.675 0.143 -3.586 1.00 0.00 C ATOM 1816 C CYS A 104 2.252 -0.414 -3.350 1.00 0.00 C ATOM 1817 O CYS A 104 1.567 0.052 -2.462 1.00 0.00 O ATOM 1818 CB CYS A 104 3.669 1.340 -4.549 1.00 0.00 C ATOM 1819 SG CYS A 104 3.120 0.872 -6.215 1.00 0.00 S ATOM 0 H CYS A 104 4.416 -1.145 -5.138 1.00 0.00 H new ATOM 0 HA CYS A 104 4.015 0.434 -2.592 1.00 0.00 H new ATOM 0 HB2 CYS A 104 3.013 2.117 -4.157 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.671 1.766 -4.604 1.00 0.00 H new ATOM 0 HG CYS A 104 3.611 1.706 -7.084 1.00 0.00 H new ATOM 1824 N CYS A 105 1.786 -1.393 -4.103 1.00 0.00 N ATOM 1825 CA CYS A 105 0.403 -1.933 -3.844 1.00 0.00 C ATOM 1826 C CYS A 105 0.374 -3.447 -4.114 1.00 0.00 C ATOM 1827 O CYS A 105 1.404 -4.066 -4.300 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.557 -1.245 -4.830 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.294 0.548 -4.931 1.00 0.00 S ATOM 0 H CYS A 105 2.292 -1.834 -4.871 1.00 0.00 H new ATOM 0 HA CYS A 105 0.115 -1.746 -2.809 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.429 -1.683 -5.820 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.585 -1.440 -4.525 1.00 0.00 H new ATOM 0 HG CYS A 105 0.903 0.786 -5.379 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.803 -4.048 -4.158 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.882 -5.521 -4.441 1.00 0.00 C ATOM 1836 C LEU A 106 -1.174 -5.762 -5.936 1.00 0.00 C ATOM 1837 O LEU A 106 -0.630 -6.673 -6.531 1.00 0.00 O ATOM 1838 CB LEU A 106 -2.024 -6.059 -3.569 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.497 -6.366 -2.165 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.661 -6.813 -1.278 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.440 -7.482 -2.236 1.00 0.00 C ATOM 0 H LEU A 106 -1.700 -3.585 -4.011 1.00 0.00 H new ATOM 0 HA LEU A 106 0.057 -6.026 -4.214 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.829 -5.326 -3.514 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.443 -6.960 -4.016 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.039 -5.471 -1.745 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.292 -7.033 -0.276 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.404 -6.017 -1.224 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.118 -7.708 -1.701 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.069 -7.696 -1.234 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.889 -8.382 -2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.387 -7.160 -2.868 1.00 0.00 H new ATOM 1853 N ARG A 107 -1.999 -4.937 -6.562 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.275 -5.122 -8.029 1.00 0.00 C ATOM 1855 C ARG A 107 -1.503 -4.058 -8.842 1.00 0.00 C ATOM 1856 O ARG A 107 -1.963 -3.594 -9.866 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.788 -4.935 -8.192 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.233 -5.523 -9.533 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.656 -6.088 -9.400 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.596 -4.946 -9.692 1.00 0.00 N ATOM 1861 CZ ARG A 107 -7.830 -5.167 -10.126 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -8.295 -6.386 -10.286 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -8.613 -4.154 -10.388 1.00 0.00 N ATOM 0 H ARG A 107 -2.485 -4.155 -6.123 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.956 -6.100 -8.389 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.316 -5.426 -7.374 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.042 -3.876 -8.145 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -4.207 -4.754 -10.306 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -3.546 -6.310 -9.843 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.814 -6.910 -10.098 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.825 -6.484 -8.398 1.00 0.00 H new ATOM 0 HE ARG A 107 -6.278 -3.987 -9.553 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -7.703 -7.189 -10.075 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -9.248 -6.528 -10.621 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.274 -3.201 -10.259 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -9.563 -4.317 -10.722 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.332 -3.667 -8.381 1.00 0.00 N ATOM 1878 CA CYS A 108 0.487 -2.634 -9.095 1.00 0.00 C ATOM 1879 C CYS A 108 1.923 -3.199 -9.296 1.00 0.00 C ATOM 1880 O CYS A 108 2.862 -2.453 -9.480 1.00 0.00 O ATOM 1881 CB CYS A 108 0.477 -1.493 -8.069 1.00 0.00 C ATOM 1882 SG CYS A 108 0.563 0.175 -8.769 1.00 0.00 S ATOM 0 H CYS A 108 0.094 -4.027 -7.527 1.00 0.00 H new ATOM 0 HA CYS A 108 0.128 -2.335 -10.080 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.431 -1.572 -7.471 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.319 -1.629 -7.390 1.00 0.00 H new ATOM 0 HG CYS A 108 0.901 0.103 -10.022 1.00 0.00 H new ATOM 1887 N ILE A 109 2.096 -4.524 -9.241 1.00 0.00 N ATOM 1888 CA ILE A 109 3.460 -5.140 -9.399 1.00 0.00 C ATOM 1889 C ILE A 109 3.332 -6.610 -9.859 1.00 0.00 C ATOM 1890 O ILE A 109 4.076 -7.462 -9.408 1.00 0.00 O ATOM 1891 CB ILE A 109 4.088 -5.115 -7.990 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.147 -5.814 -6.985 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.330 -3.673 -7.541 1.00 0.00 C ATOM 1894 CD1 ILE A 109 3.951 -6.747 -6.072 1.00 0.00 C ATOM 0 H ILE A 109 1.342 -5.194 -9.093 1.00 0.00 H new ATOM 0 HA ILE A 109 4.056 -4.602 -10.136 1.00 0.00 H new ATOM 0 HB ILE A 109 5.042 -5.642 -8.025 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.624 -5.069 -6.386 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.387 -6.383 -7.521 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.773 -3.672 -6.545 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.007 -3.183 -8.240 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.382 -3.135 -7.517 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.278 -7.235 -5.367 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.454 -7.502 -6.676 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.694 -6.168 -5.523 1.00 0.00 H new ATOM 1906 N GLN A 110 2.393 -6.922 -10.730 1.00 0.00 N ATOM 1907 CA GLN A 110 2.237 -8.356 -11.174 1.00 0.00 C ATOM 1908 C GLN A 110 3.317 -8.726 -12.203 1.00 0.00 C ATOM 1909 O GLN A 110 3.031 -8.880 -13.374 1.00 0.00 O ATOM 1910 CB GLN A 110 0.837 -8.469 -11.800 1.00 0.00 C ATOM 1911 CG GLN A 110 -0.210 -8.572 -10.691 1.00 0.00 C ATOM 1912 CD GLN A 110 -1.606 -8.708 -11.313 1.00 0.00 C ATOM 1913 OE1 GLN A 110 -1.838 -8.235 -12.408 1.00 0.00 O ATOM 1914 NE2 GLN A 110 -2.554 -9.336 -10.661 1.00 0.00 N ATOM 0 H GLN A 110 1.738 -6.261 -11.147 1.00 0.00 H new ATOM 0 HA GLN A 110 2.349 -9.040 -10.333 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.635 -7.599 -12.426 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.785 -9.345 -12.446 1.00 0.00 H new ATOM 0 HG2 GLN A 110 0.002 -9.432 -10.056 1.00 0.00 H new ATOM 0 HG3 GLN A 110 -0.169 -7.688 -10.055 1.00 0.00 H new ATOM 0 HE21 GLN A 110 -2.363 -9.734 -9.742 1.00 0.00 H new ATOM 0 HE22 GLN A 110 -3.483 -9.426 -11.073 1.00 0.00 H new ATOM 2034 N THR A 119 1.155 -6.509 -15.699 1.00 0.00 N ATOM 2035 CA THR A 119 1.945 -5.866 -14.594 1.00 0.00 C ATOM 2036 C THR A 119 1.817 -4.342 -14.675 1.00 0.00 C ATOM 2037 O THR A 119 1.402 -3.809 -15.688 1.00 0.00 O ATOM 2038 CB THR A 119 3.411 -6.270 -14.815 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.471 -7.602 -15.304 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.179 -6.164 -13.494 1.00 0.00 C ATOM 0 HA THR A 119 1.583 -6.185 -13.617 1.00 0.00 H new ATOM 0 HB THR A 119 3.864 -5.601 -15.546 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.948 -8.189 -14.719 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.218 -6.451 -13.653 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.138 -5.137 -13.131 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.728 -6.828 -12.757 1.00 0.00 H new ATOM 2048 N CYS A 120 2.192 -3.630 -13.631 1.00 0.00 N ATOM 2049 CA CYS A 120 2.106 -2.138 -13.691 1.00 0.00 C ATOM 2050 C CYS A 120 3.454 -1.579 -14.174 1.00 0.00 C ATOM 2051 O CYS A 120 4.480 -2.218 -14.020 1.00 0.00 O ATOM 2052 CB CYS A 120 1.784 -1.654 -12.274 1.00 0.00 C ATOM 2053 SG CYS A 120 1.454 0.119 -12.345 1.00 0.00 S ATOM 0 H CYS A 120 2.548 -4.014 -12.756 1.00 0.00 H new ATOM 0 HA CYS A 120 1.335 -1.800 -14.384 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.919 -2.186 -11.878 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.619 -1.859 -11.604 1.00 0.00 H new ATOM 0 HG CYS A 120 2.278 0.746 -11.559 1.00 0.00 H new ATOM 2058 N ILE A 121 3.467 -0.410 -14.780 1.00 0.00 N ATOM 2059 CA ILE A 121 4.770 0.151 -15.291 1.00 0.00 C ATOM 2060 C ILE A 121 5.626 0.744 -14.149 1.00 0.00 C ATOM 2061 O ILE A 121 6.840 0.740 -14.236 1.00 0.00 O ATOM 2062 CB ILE A 121 4.384 1.219 -16.344 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.629 1.650 -17.155 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.714 2.433 -15.680 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.594 2.508 -16.318 1.00 0.00 C ATOM 0 H ILE A 121 2.646 0.174 -14.942 1.00 0.00 H new ATOM 0 HA ILE A 121 5.391 -0.628 -15.733 1.00 0.00 H new ATOM 0 HB ILE A 121 3.662 0.777 -17.030 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.151 0.764 -17.515 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.313 2.213 -18.033 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.454 3.167 -16.442 1.00 0.00 H new ATOM 0 HG22 ILE A 121 2.810 2.112 -15.162 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.402 2.882 -14.964 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.454 2.788 -16.927 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.081 3.408 -15.980 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.932 1.937 -15.454 1.00 0.00 H new ATOM 2077 N CYS A 122 5.028 1.261 -13.091 1.00 0.00 N ATOM 2078 CA CYS A 122 5.875 1.855 -11.990 1.00 0.00 C ATOM 2079 C CYS A 122 6.837 0.799 -11.411 1.00 0.00 C ATOM 2080 O CYS A 122 7.960 1.116 -11.065 1.00 0.00 O ATOM 2081 CB CYS A 122 4.906 2.430 -10.922 1.00 0.00 C ATOM 2082 SG CYS A 122 4.168 1.123 -9.891 1.00 0.00 S ATOM 0 H CYS A 122 4.020 1.298 -12.942 1.00 0.00 H new ATOM 0 HA CYS A 122 6.510 2.656 -12.369 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.444 3.132 -10.286 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.114 2.991 -11.417 1.00 0.00 H new ATOM 0 HG CYS A 122 4.985 0.818 -8.927 1.00 0.00 H new ATOM 2087 N ARG A 123 6.426 -0.453 -11.319 1.00 0.00 N ATOM 2088 CA ARG A 123 7.367 -1.505 -10.778 1.00 0.00 C ATOM 2089 C ARG A 123 8.669 -1.523 -11.604 1.00 0.00 C ATOM 2090 O ARG A 123 9.733 -1.791 -11.077 1.00 0.00 O ATOM 2091 CB ARG A 123 6.651 -2.859 -10.905 1.00 0.00 C ATOM 2092 CG ARG A 123 7.107 -3.785 -9.778 1.00 0.00 C ATOM 2093 CD ARG A 123 8.494 -4.344 -10.105 1.00 0.00 C ATOM 2094 NE ARG A 123 8.458 -5.763 -9.635 1.00 0.00 N ATOM 2095 CZ ARG A 123 8.503 -6.062 -8.346 1.00 0.00 C ATOM 2096 NH1 ARG A 123 8.583 -5.126 -7.428 1.00 0.00 N ATOM 2097 NH2 ARG A 123 8.468 -7.315 -7.972 1.00 0.00 N ATOM 0 H ARG A 123 5.501 -0.788 -11.588 1.00 0.00 H new ATOM 0 HA ARG A 123 7.626 -1.296 -9.740 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.571 -2.717 -10.859 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.872 -3.310 -11.872 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.136 -3.240 -8.835 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.395 -4.601 -9.653 1.00 0.00 H new ATOM 0 HD2 ARG A 123 8.701 -4.287 -11.174 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.277 -3.780 -9.598 1.00 0.00 H new ATOM 0 HE ARG A 123 8.398 -6.515 -10.321 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.612 -4.144 -7.702 1.00 0.00 H new ATOM 0 HH12 ARG A 123 8.616 -5.381 -6.441 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.406 -8.055 -8.672 1.00 0.00 H new ATOM 0 HH22 ARG A 123 8.502 -7.552 -6.981 1.00 0.00 H new ATOM 2111 N VAL A 124 8.600 -1.232 -12.892 1.00 0.00 N ATOM 2112 CA VAL A 124 9.850 -1.231 -13.727 1.00 0.00 C ATOM 2113 C VAL A 124 10.601 0.102 -13.536 1.00 0.00 C ATOM 2114 O VAL A 124 10.031 1.154 -13.749 1.00 0.00 O ATOM 2115 CB VAL A 124 9.392 -1.382 -15.188 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.612 -1.391 -16.115 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.624 -2.696 -15.350 1.00 0.00 C ATOM 0 H VAL A 124 7.742 -0.999 -13.392 1.00 0.00 H new ATOM 0 HA VAL A 124 10.526 -2.037 -13.442 1.00 0.00 H new ATOM 0 HB VAL A 124 8.745 -0.545 -15.449 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.283 -1.498 -17.149 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.160 -0.456 -16.004 1.00 0.00 H new ATOM 0 HG13 VAL A 124 11.262 -2.226 -15.853 1.00 0.00 H new ATOM 0 HG21 VAL A 124 8.300 -2.803 -16.385 1.00 0.00 H new ATOM 0 HG22 VAL A 124 9.272 -3.531 -15.085 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.752 -2.691 -14.695 1.00 0.00 H new ATOM 2127 N PRO A 125 11.860 0.030 -13.150 1.00 0.00 N ATOM 2128 CA PRO A 125 12.658 1.270 -12.951 1.00 0.00 C ATOM 2129 C PRO A 125 12.869 2.003 -14.287 1.00 0.00 C ATOM 2130 O PRO A 125 12.428 1.545 -15.324 1.00 0.00 O ATOM 2131 CB PRO A 125 13.986 0.763 -12.389 1.00 0.00 C ATOM 2132 CG PRO A 125 14.071 -0.656 -12.848 1.00 0.00 C ATOM 2133 CD PRO A 125 12.658 -1.173 -12.865 1.00 0.00 C ATOM 0 HA PRO A 125 12.169 1.987 -12.291 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.825 1.351 -12.761 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.008 0.830 -11.301 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.521 -0.719 -13.839 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.694 -1.246 -12.176 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.519 -1.938 -13.629 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.382 -1.622 -11.911 1.00 0.00 H new ATOM 2141 N ARG A 126 13.541 3.138 -14.270 1.00 0.00 N ATOM 2142 CA ARG A 126 13.771 3.888 -15.557 1.00 0.00 C ATOM 2143 C ARG A 126 14.856 3.192 -16.395 1.00 0.00 C ATOM 2144 O ARG A 126 14.753 3.126 -17.606 1.00 0.00 O ATOM 2145 CB ARG A 126 14.227 5.303 -15.167 1.00 0.00 C ATOM 2146 CG ARG A 126 14.379 6.157 -16.427 1.00 0.00 C ATOM 2147 CD ARG A 126 12.996 6.550 -16.948 1.00 0.00 C ATOM 2148 NE ARG A 126 13.259 7.310 -18.208 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.699 8.559 -18.180 1.00 0.00 C ATOM 2150 NH1 ARG A 126 13.921 9.182 -17.044 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.922 9.191 -19.303 1.00 0.00 N ATOM 0 H ARG A 126 13.935 3.572 -13.435 1.00 0.00 H new ATOM 0 HA ARG A 126 12.863 3.920 -16.158 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.501 5.757 -14.493 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.175 5.256 -14.630 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.963 7.050 -16.205 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.923 5.602 -17.191 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.381 5.670 -17.139 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.460 7.162 -16.222 1.00 0.00 H new ATOM 0 HE ARG A 126 13.096 6.858 -19.108 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.754 8.703 -16.159 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.260 10.144 -17.048 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.757 8.722 -20.194 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.261 10.153 -19.288 1.00 0.00 H new ATOM 2165 N ALA A 127 15.896 2.672 -15.770 1.00 0.00 N ATOM 2166 CA ALA A 127 16.977 1.982 -16.568 1.00 0.00 C ATOM 2167 C ALA A 127 16.375 0.824 -17.378 1.00 0.00 C ATOM 2168 O ALA A 127 16.725 0.624 -18.526 1.00 0.00 O ATOM 2169 CB ALA A 127 18.003 1.443 -15.557 1.00 0.00 C ATOM 0 H ALA A 127 16.043 2.693 -14.761 1.00 0.00 H new ATOM 0 HA ALA A 127 17.446 2.672 -17.269 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.806 0.934 -16.090 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.417 2.271 -14.982 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.514 0.741 -14.882 1.00 0.00 H new ATOM 2175 N GLN A 128 15.464 0.068 -16.799 1.00 0.00 N ATOM 2176 CA GLN A 128 14.843 -1.066 -17.572 1.00 0.00 C ATOM 2177 C GLN A 128 13.987 -0.493 -18.709 1.00 0.00 C ATOM 2178 O GLN A 128 14.018 -0.988 -19.821 1.00 0.00 O ATOM 2179 CB GLN A 128 13.967 -1.854 -16.586 1.00 0.00 C ATOM 2180 CG GLN A 128 13.487 -3.148 -17.247 1.00 0.00 C ATOM 2181 CD GLN A 128 14.651 -4.142 -17.332 1.00 0.00 C ATOM 2182 OE1 GLN A 128 15.457 -4.068 -18.238 1.00 0.00 O ATOM 2183 NE2 GLN A 128 14.779 -5.080 -16.425 1.00 0.00 N ATOM 0 H GLN A 128 15.128 0.183 -15.843 1.00 0.00 H new ATOM 0 HA GLN A 128 15.601 -1.715 -18.010 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.534 -2.083 -15.683 1.00 0.00 H new ATOM 0 HB3 GLN A 128 13.112 -1.251 -16.281 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.667 -3.580 -16.673 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.101 -2.938 -18.244 1.00 0.00 H new ATOM 0 HE21 GLN A 128 14.105 -5.147 -15.662 1.00 0.00 H new ATOM 0 HE22 GLN A 128 15.552 -5.743 -16.482 1.00 0.00 H new ATOM 2192 N LEU A 129 13.228 0.555 -18.449 1.00 0.00 N ATOM 2193 CA LEU A 129 12.387 1.152 -19.544 1.00 0.00 C ATOM 2194 C LEU A 129 13.299 1.701 -20.651 1.00 0.00 C ATOM 2195 O LEU A 129 13.007 1.558 -21.823 1.00 0.00 O ATOM 2196 CB LEU A 129 11.573 2.293 -18.910 1.00 0.00 C ATOM 2197 CG LEU A 129 10.315 1.721 -18.254 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.851 2.659 -17.137 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.209 1.592 -19.303 1.00 0.00 C ATOM 0 H LEU A 129 13.156 1.015 -17.541 1.00 0.00 H new ATOM 0 HA LEU A 129 11.726 0.408 -19.988 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.177 2.816 -18.168 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.299 3.024 -19.670 1.00 0.00 H new ATOM 0 HG LEU A 129 10.537 0.739 -17.835 1.00 0.00 H new ATOM 0 HD11 LEU A 129 8.955 2.252 -16.669 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.639 2.753 -16.390 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.628 3.641 -17.555 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.312 1.184 -18.837 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.987 2.574 -19.720 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.539 0.925 -20.100 1.00 0.00 H new ATOM 2211 N GLU A 130 14.411 2.322 -20.295 1.00 0.00 N ATOM 2212 CA GLU A 130 15.334 2.866 -21.359 1.00 0.00 C ATOM 2213 C GLU A 130 15.801 1.729 -22.284 1.00 0.00 C ATOM 2214 O GLU A 130 15.928 1.918 -23.480 1.00 0.00 O ATOM 2215 CB GLU A 130 16.540 3.479 -20.629 1.00 0.00 C ATOM 2216 CG GLU A 130 16.210 4.914 -20.213 1.00 0.00 C ATOM 2217 CD GLU A 130 17.501 5.652 -19.858 1.00 0.00 C ATOM 2218 OE1 GLU A 130 18.139 6.159 -20.766 1.00 0.00 O ATOM 2219 OE2 GLU A 130 17.829 5.699 -18.684 1.00 0.00 O ATOM 0 H GLU A 130 14.715 2.473 -19.333 1.00 0.00 H new ATOM 0 HA GLU A 130 14.827 3.610 -21.973 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.789 2.883 -19.751 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.415 3.470 -21.279 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.695 5.430 -21.024 1.00 0.00 H new ATOM 0 HG3 GLU A 130 15.534 4.910 -19.358 1.00 0.00 H new ATOM 2226 N GLU A 131 16.055 0.548 -21.749 1.00 0.00 N ATOM 2227 CA GLU A 131 16.511 -0.588 -22.632 1.00 0.00 C ATOM 2228 C GLU A 131 15.478 -0.853 -23.740 1.00 0.00 C ATOM 2229 O GLU A 131 15.837 -1.161 -24.862 1.00 0.00 O ATOM 2230 CB GLU A 131 16.645 -1.827 -21.731 1.00 0.00 C ATOM 2231 CG GLU A 131 17.656 -2.798 -22.345 1.00 0.00 C ATOM 2232 CD GLU A 131 19.072 -2.385 -21.939 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.273 -2.100 -20.770 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.932 -2.362 -22.806 1.00 0.00 O ATOM 0 H GLU A 131 15.968 0.324 -20.758 1.00 0.00 H new ATOM 0 HA GLU A 131 17.459 -0.347 -23.113 1.00 0.00 H new ATOM 0 HB2 GLU A 131 16.969 -1.531 -20.733 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.677 -2.315 -21.620 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.451 -3.814 -22.008 1.00 0.00 H new ATOM 0 HG3 GLU A 131 17.563 -2.798 -23.431 1.00 0.00 H new ATOM 2241 N GLU A 132 14.200 -0.734 -23.442 1.00 0.00 N ATOM 2242 CA GLU A 132 13.161 -0.984 -24.505 1.00 0.00 C ATOM 2243 C GLU A 132 13.343 0.020 -25.653 1.00 0.00 C ATOM 2244 O GLU A 132 13.354 -0.356 -26.809 1.00 0.00 O ATOM 2245 CB GLU A 132 11.787 -0.791 -23.843 1.00 0.00 C ATOM 2246 CG GLU A 132 11.502 -1.968 -22.908 1.00 0.00 C ATOM 2247 CD GLU A 132 10.287 -1.647 -22.037 1.00 0.00 C ATOM 2248 OE1 GLU A 132 10.189 -0.517 -21.584 1.00 0.00 O ATOM 2249 OE2 GLU A 132 9.474 -2.534 -21.835 1.00 0.00 O ATOM 0 H GLU A 132 13.834 -0.479 -22.525 1.00 0.00 H new ATOM 0 HA GLU A 132 13.252 -1.989 -24.918 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.769 0.144 -23.284 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.011 -0.722 -24.605 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.317 -2.871 -23.489 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.371 -2.165 -22.280 1.00 0.00 H new ATOM 2256 N ALA A 133 13.491 1.296 -25.348 1.00 0.00 N ATOM 2257 CA ALA A 133 13.680 2.305 -26.456 1.00 0.00 C ATOM 2258 C ALA A 133 14.944 1.961 -27.268 1.00 0.00 C ATOM 2259 O ALA A 133 14.962 2.108 -28.476 1.00 0.00 O ATOM 2260 CB ALA A 133 13.834 3.693 -25.799 1.00 0.00 C ATOM 0 H ALA A 133 13.490 1.677 -24.402 1.00 0.00 H new ATOM 0 HA ALA A 133 12.827 2.296 -27.135 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.973 4.448 -26.573 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.938 3.924 -25.223 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.700 3.688 -25.137 1.00 0.00 H new ATOM 2266 N ARG A 134 15.999 1.504 -26.620 1.00 0.00 N ATOM 2267 CA ARG A 134 17.252 1.157 -27.385 1.00 0.00 C ATOM 2268 C ARG A 134 16.968 0.028 -28.392 1.00 0.00 C ATOM 2269 O ARG A 134 17.479 0.042 -29.496 1.00 0.00 O ATOM 2270 CB ARG A 134 18.291 0.693 -26.351 1.00 0.00 C ATOM 2271 CG ARG A 134 19.623 0.419 -27.051 1.00 0.00 C ATOM 2272 CD ARG A 134 20.777 0.755 -26.103 1.00 0.00 C ATOM 2273 NE ARG A 134 20.760 2.246 -25.987 1.00 0.00 N ATOM 2274 CZ ARG A 134 21.191 3.018 -26.971 1.00 0.00 C ATOM 2275 NH1 ARG A 134 21.648 2.508 -28.093 1.00 0.00 N ATOM 2276 NH2 ARG A 134 21.164 4.319 -26.832 1.00 0.00 N ATOM 0 H ARG A 134 16.048 1.358 -25.612 1.00 0.00 H new ATOM 0 HA ARG A 134 17.615 2.018 -27.947 1.00 0.00 H new ATOM 0 HB2 ARG A 134 18.422 1.456 -25.584 1.00 0.00 H new ATOM 0 HB3 ARG A 134 17.941 -0.208 -25.848 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.679 -0.627 -27.353 1.00 0.00 H new ATOM 0 HG3 ARG A 134 19.698 1.017 -27.959 1.00 0.00 H new ATOM 0 HD2 ARG A 134 20.640 0.282 -25.131 1.00 0.00 H new ATOM 0 HD3 ARG A 134 21.729 0.401 -26.499 1.00 0.00 H new ATOM 0 HE ARG A 134 20.409 2.676 -25.132 1.00 0.00 H new ATOM 0 HH11 ARG A 134 21.676 1.496 -28.219 1.00 0.00 H new ATOM 0 HH12 ARG A 134 21.975 3.124 -28.837 1.00 0.00 H new ATOM 0 HH21 ARG A 134 20.812 4.732 -25.969 1.00 0.00 H new ATOM 0 HH22 ARG A 134 21.495 4.920 -27.587 1.00 0.00 H new ATOM 2290 N LYS A 135 16.159 -0.950 -28.027 1.00 0.00 N ATOM 2291 CA LYS A 135 15.859 -2.066 -28.993 1.00 0.00 C ATOM 2292 C LYS A 135 14.671 -1.686 -29.891 1.00 0.00 C ATOM 2293 O LYS A 135 14.675 -1.968 -31.075 1.00 0.00 O ATOM 2294 CB LYS A 135 15.514 -3.295 -28.139 1.00 0.00 C ATOM 2295 CG LYS A 135 16.804 -3.943 -27.633 1.00 0.00 C ATOM 2296 CD LYS A 135 16.461 -5.111 -26.706 1.00 0.00 C ATOM 2297 CE LYS A 135 17.750 -5.699 -26.128 1.00 0.00 C ATOM 2298 NZ LYS A 135 18.270 -6.604 -27.190 1.00 0.00 N ATOM 0 H LYS A 135 15.701 -1.023 -27.118 1.00 0.00 H new ATOM 0 HA LYS A 135 16.709 -2.266 -29.646 1.00 0.00 H new ATOM 0 HB2 LYS A 135 14.887 -3.002 -27.297 1.00 0.00 H new ATOM 0 HB3 LYS A 135 14.941 -4.011 -28.728 1.00 0.00 H new ATOM 0 HG2 LYS A 135 17.400 -4.296 -28.474 1.00 0.00 H new ATOM 0 HG3 LYS A 135 17.408 -3.208 -27.101 1.00 0.00 H new ATOM 0 HD2 LYS A 135 15.811 -4.771 -25.900 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.914 -5.877 -27.256 1.00 0.00 H new ATOM 0 HE2 LYS A 135 18.469 -4.915 -25.890 1.00 0.00 H new ATOM 0 HE3 LYS A 135 17.556 -6.245 -25.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 18.172 -7.593 -26.882 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 17.728 -6.459 -28.066 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 19.273 -6.394 -27.365 1.00 0.00 H new ATOM 2312 N LYS A 136 13.657 -1.044 -29.345 1.00 0.00 N ATOM 2313 CA LYS A 136 12.478 -0.649 -30.198 1.00 0.00 C ATOM 2314 C LYS A 136 12.861 0.458 -31.198 1.00 0.00 C ATOM 2315 O LYS A 136 12.242 0.590 -32.237 1.00 0.00 O ATOM 2316 CB LYS A 136 11.391 -0.138 -29.239 1.00 0.00 C ATOM 2317 CG LYS A 136 10.572 -1.319 -28.716 1.00 0.00 C ATOM 2318 CD LYS A 136 9.485 -0.806 -27.769 1.00 0.00 C ATOM 2319 CE LYS A 136 8.476 -1.924 -27.495 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.779 -1.512 -26.246 1.00 0.00 N ATOM 0 H LYS A 136 13.593 -0.780 -28.362 1.00 0.00 H new ATOM 0 HA LYS A 136 12.129 -1.501 -30.781 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.848 0.397 -28.407 1.00 0.00 H new ATOM 0 HB3 LYS A 136 10.741 0.569 -29.754 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.119 -1.858 -29.548 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.221 -2.023 -28.195 1.00 0.00 H new ATOM 0 HD2 LYS A 136 9.932 -0.468 -26.834 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.980 0.054 -28.210 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.774 -2.034 -28.321 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.975 -2.885 -27.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.070 -2.229 -25.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 8.472 -1.422 -25.476 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.308 -0.597 -26.397 1.00 0.00 H new ATOM 2334 N GLY A 137 13.862 1.264 -30.900 1.00 0.00 N ATOM 2335 CA GLY A 137 14.250 2.357 -31.840 1.00 0.00 C ATOM 2336 C GLY A 137 13.463 3.634 -31.501 1.00 0.00 C ATOM 2337 O GLY A 137 13.125 4.404 -32.380 1.00 0.00 O ATOM 0 H GLY A 137 14.420 1.207 -30.048 1.00 0.00 H new ATOM 0 HA2 GLY A 137 15.321 2.548 -31.769 1.00 0.00 H new ATOM 0 HA3 GLY A 137 14.048 2.055 -32.868 1.00 0.00 H new ATOM 2341 N THR A 138 13.164 3.870 -30.237 1.00 0.00 N ATOM 2342 CA THR A 138 12.400 5.099 -29.862 1.00 0.00 C ATOM 2343 C THR A 138 12.899 5.635 -28.505 1.00 0.00 C ATOM 2344 O THR A 138 13.982 5.295 -28.069 1.00 0.00 O ATOM 2345 CB THR A 138 10.937 4.643 -29.775 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.121 5.749 -29.417 1.00 0.00 O ATOM 2347 CG2 THR A 138 10.793 3.539 -28.722 1.00 0.00 C ATOM 0 H THR A 138 13.418 3.263 -29.457 1.00 0.00 H new ATOM 0 HA THR A 138 12.524 5.908 -30.581 1.00 0.00 H new ATOM 0 HB THR A 138 10.625 4.253 -30.744 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.186 5.461 -29.362 1.00 0.00 H new ATOM 0 HG21 THR A 138 9.752 3.222 -28.667 1.00 0.00 H new ATOM 0 HG22 THR A 138 11.417 2.689 -28.998 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.108 3.920 -27.750 1.00 0.00 H new ATOM 2355 N GLN A 139 12.126 6.467 -27.835 1.00 0.00 N ATOM 2356 CA GLN A 139 12.574 7.005 -26.516 1.00 0.00 C ATOM 2357 C GLN A 139 11.508 6.726 -25.446 1.00 0.00 C ATOM 2358 O GLN A 139 10.332 6.644 -25.749 1.00 0.00 O ATOM 2359 CB GLN A 139 12.733 8.510 -26.737 1.00 0.00 C ATOM 2360 CG GLN A 139 14.160 8.810 -27.197 1.00 0.00 C ATOM 2361 CD GLN A 139 14.234 10.243 -27.739 1.00 0.00 C ATOM 2362 OE1 GLN A 139 13.723 10.523 -28.806 1.00 0.00 O ATOM 2363 NE2 GLN A 139 14.849 11.173 -27.049 1.00 0.00 N ATOM 0 H GLN A 139 11.211 6.791 -28.148 1.00 0.00 H new ATOM 0 HA GLN A 139 13.500 6.545 -26.171 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.018 8.856 -27.484 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.516 9.049 -25.815 1.00 0.00 H new ATOM 0 HG2 GLN A 139 14.854 8.688 -26.366 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.461 8.102 -27.969 1.00 0.00 H new ATOM 0 HE21 GLN A 139 15.279 10.943 -26.153 1.00 0.00 H new ATOM 0 HE22 GLN A 139 14.897 12.127 -27.408 1.00 0.00 H new ATOM 2372 N VAL A 140 11.903 6.574 -24.198 1.00 0.00 N ATOM 2373 CA VAL A 140 10.899 6.298 -23.125 1.00 0.00 C ATOM 2374 C VAL A 140 11.134 7.223 -21.919 1.00 0.00 C ATOM 2375 O VAL A 140 12.205 7.778 -21.760 1.00 0.00 O ATOM 2376 CB VAL A 140 11.119 4.828 -22.740 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.557 4.623 -22.241 1.00 0.00 C ATOM 2378 CG2 VAL A 140 10.131 4.439 -21.633 1.00 0.00 C ATOM 0 H VAL A 140 12.872 6.630 -23.883 1.00 0.00 H new ATOM 0 HA VAL A 140 9.878 6.479 -23.460 1.00 0.00 H new ATOM 0 HB VAL A 140 10.955 4.200 -23.616 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.703 3.577 -21.971 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.258 4.895 -23.030 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.732 5.251 -21.368 1.00 0.00 H new ATOM 0 HG21 VAL A 140 10.285 3.396 -21.358 1.00 0.00 H new ATOM 0 HG22 VAL A 140 10.294 5.072 -20.761 1.00 0.00 H new ATOM 0 HG23 VAL A 140 9.111 4.572 -21.993 1.00 0.00 H new ATOM 2388 N SER A 141 10.141 7.394 -21.066 1.00 0.00 N ATOM 2389 CA SER A 141 10.322 8.286 -19.873 1.00 0.00 C ATOM 2390 C SER A 141 9.138 8.148 -18.900 1.00 0.00 C ATOM 2391 O SER A 141 8.100 8.751 -19.094 1.00 0.00 O ATOM 2392 CB SER A 141 10.379 9.698 -20.447 1.00 0.00 C ATOM 2393 OG SER A 141 10.530 10.633 -19.387 1.00 0.00 O ATOM 0 H SER A 141 9.223 6.957 -21.146 1.00 0.00 H new ATOM 0 HA SER A 141 11.218 8.032 -19.307 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.212 9.785 -21.145 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.469 9.911 -21.008 1.00 0.00 H new ATOM 0 HG SER A 141 10.568 11.541 -19.754 1.00 0.00 H new ATOM 2399 N PHE A 142 9.280 7.353 -17.857 1.00 0.00 N ATOM 2400 CA PHE A 142 8.151 7.181 -16.888 1.00 0.00 C ATOM 2401 C PHE A 142 8.414 7.974 -15.593 1.00 0.00 C ATOM 2402 O PHE A 142 9.539 8.309 -15.271 1.00 0.00 O ATOM 2403 CB PHE A 142 8.096 5.672 -16.599 1.00 0.00 C ATOM 2404 CG PHE A 142 7.093 5.387 -15.497 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.724 5.314 -15.783 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.540 5.205 -14.186 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.810 5.054 -14.751 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.628 4.950 -13.164 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.265 4.873 -13.441 1.00 0.00 C ATOM 0 H PHE A 142 10.123 6.822 -17.640 1.00 0.00 H new ATOM 0 HA PHE A 142 7.210 7.554 -17.292 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.818 5.131 -17.503 1.00 0.00 H new ATOM 0 HB3 PHE A 142 9.083 5.314 -16.304 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.373 5.457 -16.794 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.595 5.262 -13.964 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.754 4.994 -14.968 1.00 0.00 H new ATOM 0 HE2 PHE A 142 6.979 4.811 -12.152 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.561 4.674 -12.646 1.00 0.00 H new ATOM 2419 N HIS A 143 7.372 8.250 -14.839 1.00 0.00 N ATOM 2420 CA HIS A 143 7.531 8.992 -13.552 1.00 0.00 C ATOM 2421 C HIS A 143 6.619 8.348 -12.493 1.00 0.00 C ATOM 2422 O HIS A 143 7.083 7.839 -11.492 1.00 0.00 O ATOM 2423 CB HIS A 143 7.082 10.422 -13.855 1.00 0.00 C ATOM 2424 CG HIS A 143 8.198 11.164 -14.540 1.00 0.00 C ATOM 2425 ND1 HIS A 143 7.960 12.137 -15.497 1.00 0.00 N ATOM 2426 CD2 HIS A 143 9.562 11.084 -14.417 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.154 12.601 -15.909 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.164 11.993 -15.283 1.00 0.00 N ATOM 0 H HIS A 143 6.412 7.989 -15.066 1.00 0.00 H new ATOM 0 HA HIS A 143 8.552 8.971 -13.170 1.00 0.00 H new ATOM 0 HB2 HIS A 143 6.196 10.410 -14.490 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.806 10.931 -12.932 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.089 10.417 -13.750 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.280 13.371 -16.655 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.162 12.159 -15.411 1.00 0.00 H new ATOM 2436 N GLN A 144 5.326 8.348 -12.728 1.00 0.00 N ATOM 2437 CA GLN A 144 4.375 7.718 -11.763 1.00 0.00 C ATOM 2438 C GLN A 144 3.258 7.005 -12.547 1.00 0.00 C ATOM 2439 O GLN A 144 2.900 7.433 -13.629 1.00 0.00 O ATOM 2440 CB GLN A 144 3.808 8.881 -10.934 1.00 0.00 C ATOM 2441 CG GLN A 144 3.113 9.898 -11.846 1.00 0.00 C ATOM 2442 CD GLN A 144 2.587 11.065 -11.001 1.00 0.00 C ATOM 2443 OE1 GLN A 144 1.405 11.143 -10.730 1.00 0.00 O ATOM 2444 NE2 GLN A 144 3.414 11.985 -10.569 1.00 0.00 N ATOM 0 H GLN A 144 4.890 8.761 -13.552 1.00 0.00 H new ATOM 0 HA GLN A 144 4.851 6.975 -11.123 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.100 8.500 -10.198 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.612 9.368 -10.382 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.811 10.265 -12.598 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.291 9.422 -12.380 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.407 11.924 -10.794 1.00 0.00 H new ATOM 0 HE22 GLN A 144 3.065 12.762 -10.008 1.00 0.00 H new ATOM 2453 N CYS A 145 2.711 5.924 -12.029 1.00 0.00 N ATOM 2454 CA CYS A 145 1.625 5.213 -12.796 1.00 0.00 C ATOM 2455 C CYS A 145 0.238 5.767 -12.432 1.00 0.00 C ATOM 2456 O CYS A 145 0.038 6.298 -11.355 1.00 0.00 O ATOM 2457 CB CYS A 145 1.734 3.708 -12.470 1.00 0.00 C ATOM 2458 SG CYS A 145 1.352 3.370 -10.722 1.00 0.00 S ATOM 0 H CYS A 145 2.960 5.510 -11.131 1.00 0.00 H new ATOM 0 HA CYS A 145 1.750 5.373 -13.867 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.050 3.147 -13.107 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.741 3.358 -12.697 1.00 0.00 H new ATOM 0 HG CYS A 145 2.251 2.571 -10.228 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.721 5.654 -13.331 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.097 6.189 -13.030 1.00 0.00 C ATOM 2465 C VAL A 146 -2.830 5.311 -11.995 1.00 0.00 C ATOM 2466 O VAL A 146 -3.704 5.795 -11.299 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.872 6.217 -14.366 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -3.040 4.798 -14.925 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -4.253 6.837 -14.137 1.00 0.00 C ATOM 0 H VAL A 146 -0.613 5.221 -14.248 1.00 0.00 H new ATOM 0 HA VAL A 146 -2.027 7.187 -12.597 1.00 0.00 H new ATOM 0 HB VAL A 146 -2.308 6.812 -15.085 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -3.588 4.840 -15.866 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -2.059 4.356 -15.096 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -3.593 4.188 -14.210 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -4.803 6.858 -15.078 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -4.803 6.241 -13.409 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -4.138 7.854 -13.761 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.500 4.030 -11.881 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.213 3.154 -10.870 1.00 0.00 C ATOM 2481 C HIS A 147 -3.227 3.838 -9.489 1.00 0.00 C ATOM 2482 O HIS A 147 -4.279 4.110 -8.942 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.428 1.828 -10.795 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.474 1.091 -12.120 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.286 1.481 -13.185 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.800 -0.028 -12.564 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -3.078 0.613 -14.192 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.185 -0.323 -13.867 1.00 0.00 N ATOM 0 H HIS A 147 -1.782 3.561 -12.433 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.248 2.981 -11.166 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.392 2.030 -10.523 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.846 1.198 -10.010 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -1.081 -0.590 -11.986 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.575 0.668 -15.149 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.855 -1.092 -14.450 1.00 0.00 H new ATOM 2496 N CYS A 148 -2.071 4.132 -8.932 1.00 0.00 N ATOM 2497 CA CYS A 148 -2.027 4.809 -7.603 1.00 0.00 C ATOM 2498 C CYS A 148 -1.151 6.077 -7.676 1.00 0.00 C ATOM 2499 O CYS A 148 -0.805 6.534 -8.749 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.417 3.761 -6.657 1.00 0.00 C ATOM 2501 SG CYS A 148 0.330 3.452 -7.071 1.00 0.00 S ATOM 0 H CYS A 148 -1.160 3.930 -9.345 1.00 0.00 H new ATOM 0 HA CYS A 148 -3.009 5.138 -7.264 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.495 4.106 -5.626 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.981 2.831 -6.725 1.00 0.00 H new ATOM 0 HG CYS A 148 0.438 2.303 -7.669 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.764 6.625 -6.543 1.00 0.00 N ATOM 2507 CA GLY A 149 0.114 7.831 -6.555 1.00 0.00 C ATOM 2508 C GLY A 149 1.548 7.373 -6.254 1.00 0.00 C ATOM 2509 O GLY A 149 2.124 7.739 -5.247 1.00 0.00 O ATOM 0 H GLY A 149 -1.021 6.286 -5.616 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.067 8.327 -7.524 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.220 8.554 -5.811 1.00 0.00 H new ATOM 2513 N CYS A 150 2.124 6.557 -7.116 1.00 0.00 N ATOM 2514 CA CYS A 150 3.516 6.059 -6.869 1.00 0.00 C ATOM 2515 C CYS A 150 4.511 6.847 -7.731 1.00 0.00 C ATOM 2516 O CYS A 150 4.235 7.150 -8.873 1.00 0.00 O ATOM 2517 CB CYS A 150 3.465 4.572 -7.277 1.00 0.00 C ATOM 2518 SG CYS A 150 5.114 3.820 -7.293 1.00 0.00 S ATOM 0 H CYS A 150 1.689 6.218 -7.974 1.00 0.00 H new ATOM 0 HA CYS A 150 3.842 6.182 -5.836 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.824 4.027 -6.584 1.00 0.00 H new ATOM 0 HB3 CYS A 150 3.015 4.482 -8.266 1.00 0.00 H new ATOM 0 HG CYS A 150 5.120 2.805 -8.105 1.00 0.00 H new ATOM 2523 N ARG A 151 5.676 7.164 -7.202 1.00 0.00 N ATOM 2524 CA ARG A 151 6.683 7.915 -8.019 1.00 0.00 C ATOM 2525 C ARG A 151 7.698 6.929 -8.617 1.00 0.00 C ATOM 2526 O ARG A 151 8.894 7.120 -8.504 1.00 0.00 O ATOM 2527 CB ARG A 151 7.375 8.886 -7.054 1.00 0.00 C ATOM 2528 CG ARG A 151 6.543 10.164 -6.933 1.00 0.00 C ATOM 2529 CD ARG A 151 7.461 11.343 -6.601 1.00 0.00 C ATOM 2530 NE ARG A 151 6.617 12.559 -6.802 1.00 0.00 N ATOM 2531 CZ ARG A 151 5.702 12.916 -5.912 1.00 0.00 C ATOM 2532 NH1 ARG A 151 5.500 12.217 -4.818 1.00 0.00 N ATOM 2533 NH2 ARG A 151 4.982 13.989 -6.121 1.00 0.00 N ATOM 0 H ARG A 151 5.967 6.937 -6.251 1.00 0.00 H new ATOM 0 HA ARG A 151 6.219 8.452 -8.846 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.492 8.421 -6.075 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.376 9.123 -7.415 1.00 0.00 H new ATOM 0 HG2 ARG A 151 6.012 10.354 -7.866 1.00 0.00 H new ATOM 0 HG3 ARG A 151 5.789 10.047 -6.155 1.00 0.00 H new ATOM 0 HD2 ARG A 151 7.827 11.282 -5.576 1.00 0.00 H new ATOM 0 HD3 ARG A 151 8.335 11.358 -7.251 1.00 0.00 H new ATOM 0 HE ARG A 151 6.747 13.125 -7.640 1.00 0.00 H new ATOM 0 HH11 ARG A 151 6.053 11.379 -4.639 1.00 0.00 H new ATOM 0 HH12 ARG A 151 4.790 12.512 -4.148 1.00 0.00 H new ATOM 0 HH21 ARG A 151 5.127 14.544 -6.964 1.00 0.00 H new ATOM 0 HH22 ARG A 151 4.276 14.270 -5.441 1.00 0.00 H new ATOM 2547 N GLY A 152 7.229 5.874 -9.252 1.00 0.00 N ATOM 2548 CA GLY A 152 8.159 4.882 -9.852 1.00 0.00 C ATOM 2549 C GLY A 152 8.848 4.073 -8.745 1.00 0.00 C ATOM 2550 O GLY A 152 9.820 4.516 -8.163 1.00 0.00 O ATOM 0 H GLY A 152 6.238 5.666 -9.375 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.611 4.213 -10.516 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.906 5.393 -10.460 1.00 0.00 H new ATOM 2554 N CYS A 153 8.359 2.882 -8.453 1.00 0.00 N ATOM 2555 CA CYS A 153 9.002 2.049 -7.390 1.00 0.00 C ATOM 2556 C CYS A 153 9.721 0.842 -8.023 1.00 0.00 C ATOM 2557 O CYS A 153 9.137 0.091 -8.782 1.00 0.00 O ATOM 2558 CB CYS A 153 7.861 1.617 -6.441 1.00 0.00 C ATOM 2559 SG CYS A 153 6.701 0.476 -7.254 1.00 0.00 S ATOM 0 H CYS A 153 7.548 2.459 -8.905 1.00 0.00 H new ATOM 0 HA CYS A 153 9.765 2.599 -6.838 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.284 1.137 -5.559 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.321 2.499 -6.096 1.00 0.00 H new ATOM 0 HG CYS A 153 5.496 0.700 -6.820 1.00 0.00 H new ATOM 2564 N ALA A 154 10.993 0.660 -7.731 1.00 0.00 N ATOM 2565 CA ALA A 154 11.744 -0.488 -8.329 1.00 0.00 C ATOM 2566 C ALA A 154 12.856 -0.954 -7.379 1.00 0.00 C ATOM 2567 O ALA A 154 13.377 -0.175 -6.603 1.00 0.00 O ATOM 2568 CB ALA A 154 12.343 0.069 -9.618 1.00 0.00 C ATOM 0 H ALA A 154 11.537 1.256 -7.107 1.00 0.00 H new ATOM 0 HA ALA A 154 11.103 -1.351 -8.510 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.913 -0.712 -10.122 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.542 0.413 -10.272 1.00 0.00 H new ATOM 0 HB3 ALA A 154 13.002 0.904 -9.382 1.00 0.00 H new ATOM 2574 N SER A 155 13.227 -2.216 -7.431 1.00 0.00 N ATOM 2575 CA SER A 155 14.309 -2.714 -6.519 1.00 0.00 C ATOM 2576 C SER A 155 15.626 -2.897 -7.292 1.00 0.00 C ATOM 2577 O SER A 155 16.671 -2.463 -6.845 1.00 0.00 O ATOM 2578 CB SER A 155 13.811 -4.057 -5.981 1.00 0.00 C ATOM 2579 OG SER A 155 12.391 -4.038 -5.915 1.00 0.00 O ATOM 0 H SER A 155 12.831 -2.915 -8.059 1.00 0.00 H new ATOM 0 HA SER A 155 14.511 -2.008 -5.713 1.00 0.00 H new ATOM 0 HB2 SER A 155 14.146 -4.868 -6.628 1.00 0.00 H new ATOM 0 HB3 SER A 155 14.230 -4.244 -4.992 1.00 0.00 H new ATOM 0 HG SER A 155 12.068 -4.897 -5.572 1.00 0.00 H new