USER MOD reduce.3.24.130724 H: found=0, std=0, add=788, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 788 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 110 HIS : no HE2:sc= -1.27 K(o=-1.9,f=-3.8) USER MOD Set 1.2: A 129 TYR OH : rot 180:sc= -0.624 USER MOD Single : A 38 THR OG1 : rot 43:sc= 0.331 USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0346 USER MOD Single : A 48 GLN : amide:sc= -0.188 K(o=-0.19,f=-1.1) USER MOD Single : A 52 TYR OH : rot 103:sc= 0.474 USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.85) USER MOD Single : A 57 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 62 THR OG1 : rot 84:sc= 0.713 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 THR OG1 : rot -21:sc= 0.0641 USER MOD Single : A 75 ASN : amide:sc= -2.21! C(o=-2.2!,f=-7.7!) USER MOD Single : A 80 SER OG : rot 89:sc= 0.67 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 180:sc= 0.695 USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.075) USER MOD Single : A 95 ASN : amide:sc= -1.12 K(o=-1.1,f=-2!) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 THR OG1 : rot 74:sc= 0.388 USER MOD Single : A 103 LYS NZ :NH3+ -178:sc= 1.28 (180deg=1.23) USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= 0.725 (180deg=0.552) USER MOD Single : A 111 ASN : amide:sc= -0.164 X(o=-0.16,f=0) USER MOD Single : A 114 THR OG1 : rot 74:sc= 0.123 USER MOD Single : A 116 MET CE :methyl -164:sc= -0.341 (180deg=-1.07) USER MOD Single : A 120 ASN : amide:sc= 0.0454 K(o=0.045,f=-3.6!) USER MOD Single : A 124 LYS NZ :NH3+ -161:sc= 1.24 (180deg=0.982) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0.263 (180deg=0.263) USER MOD ----------------------------------------------------------------- ATOM 192 N THR A 38 -16.195 -11.454 -0.348 1.00 0.00 N ATOM 193 CA THR A 38 -16.950 -10.287 -0.009 1.00 0.00 C ATOM 194 C THR A 38 -18.385 -10.430 -0.478 1.00 0.00 C ATOM 195 O THR A 38 -18.653 -10.446 -1.685 1.00 0.00 O ATOM 196 CB THR A 38 -16.309 -9.022 -0.625 1.00 0.00 C ATOM 197 OG1 THR A 38 -16.080 -9.244 -2.030 1.00 0.00 O ATOM 198 CG2 THR A 38 -14.985 -8.687 0.057 1.00 0.00 C ATOM 0 HA THR A 38 -16.945 -10.182 1.076 1.00 0.00 H new ATOM 0 HB THR A 38 -16.990 -8.184 -0.480 1.00 0.00 H new ATOM 0 HG1 THR A 38 -16.859 -9.691 -2.422 1.00 0.00 H new ATOM 0 HG21 THR A 38 -14.558 -7.793 -0.397 1.00 0.00 H new ATOM 0 HG22 THR A 38 -15.157 -8.508 1.118 1.00 0.00 H new ATOM 0 HG23 THR A 38 -14.293 -9.521 -0.062 1.00 0.00 H new ATOM 206 N VAL A 39 -19.292 -10.574 0.449 1.00 0.00 N ATOM 207 CA VAL A 39 -20.680 -10.649 0.107 1.00 0.00 C ATOM 208 C VAL A 39 -21.281 -9.281 0.290 1.00 0.00 C ATOM 209 O VAL A 39 -21.421 -8.779 1.412 1.00 0.00 O ATOM 210 CB VAL A 39 -21.447 -11.700 0.940 1.00 0.00 C ATOM 211 CG1 VAL A 39 -22.906 -11.764 0.516 1.00 0.00 C ATOM 212 CG2 VAL A 39 -20.801 -13.064 0.786 1.00 0.00 C ATOM 0 H VAL A 39 -19.092 -10.641 1.447 1.00 0.00 H new ATOM 0 HA VAL A 39 -20.765 -10.973 -0.930 1.00 0.00 H new ATOM 0 HB VAL A 39 -21.405 -11.403 1.988 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -23.427 -12.511 1.116 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -23.371 -10.790 0.665 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -22.967 -12.038 -0.537 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -21.351 -13.796 1.378 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -20.819 -13.359 -0.263 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -19.769 -13.019 1.133 1.00 0.00 H new ATOM 222 N ILE A 40 -21.611 -8.690 -0.805 1.00 0.00 N ATOM 223 CA ILE A 40 -22.096 -7.348 -0.863 1.00 0.00 C ATOM 224 C ILE A 40 -23.530 -7.271 -0.331 1.00 0.00 C ATOM 225 O ILE A 40 -24.391 -8.072 -0.731 1.00 0.00 O ATOM 226 CB ILE A 40 -22.064 -6.860 -2.335 1.00 0.00 C ATOM 227 CG1 ILE A 40 -20.646 -7.015 -2.912 1.00 0.00 C ATOM 228 CG2 ILE A 40 -22.522 -5.415 -2.438 1.00 0.00 C ATOM 229 CD1 ILE A 40 -20.548 -6.741 -4.396 1.00 0.00 C ATOM 0 H ILE A 40 -21.550 -9.140 -1.718 1.00 0.00 H new ATOM 0 HA ILE A 40 -21.461 -6.714 -0.244 1.00 0.00 H new ATOM 0 HB ILE A 40 -22.752 -7.475 -2.916 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -19.975 -6.338 -2.384 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -20.295 -8.028 -2.717 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -22.490 -5.097 -3.480 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -23.542 -5.329 -2.063 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -21.863 -4.781 -1.845 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -19.516 -6.872 -4.723 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -21.191 -7.435 -4.937 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -20.866 -5.718 -4.599 1.00 0.00 H new ATOM 241 N PRO A 41 -23.798 -6.366 0.614 1.00 0.00 N ATOM 242 CA PRO A 41 -25.149 -6.126 1.075 1.00 0.00 C ATOM 243 C PRO A 41 -25.953 -5.391 -0.006 1.00 0.00 C ATOM 244 O PRO A 41 -25.430 -4.477 -0.669 1.00 0.00 O ATOM 245 CB PRO A 41 -24.979 -5.244 2.319 1.00 0.00 C ATOM 246 CG PRO A 41 -23.632 -4.627 2.195 1.00 0.00 C ATOM 247 CD PRO A 41 -22.805 -5.543 1.331 1.00 0.00 C ATOM 0 HA PRO A 41 -25.689 -7.047 1.295 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -25.756 -4.481 2.367 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -25.056 -5.835 3.231 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -23.702 -3.635 1.749 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -23.173 -4.503 3.176 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -22.181 -4.979 0.638 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -22.137 -6.160 1.932 1.00 0.00 H new ATOM 255 N PRO A 42 -27.197 -5.798 -0.242 1.00 0.00 N ATOM 256 CA PRO A 42 -28.038 -5.160 -1.238 1.00 0.00 C ATOM 257 C PRO A 42 -28.407 -3.735 -0.828 1.00 0.00 C ATOM 258 O PRO A 42 -28.512 -3.418 0.367 1.00 0.00 O ATOM 259 CB PRO A 42 -29.283 -6.048 -1.298 1.00 0.00 C ATOM 260 CG PRO A 42 -29.308 -6.768 0.004 1.00 0.00 C ATOM 261 CD PRO A 42 -27.881 -6.914 0.438 1.00 0.00 C ATOM 0 HA PRO A 42 -27.537 -5.068 -2.202 1.00 0.00 H new ATOM 0 HB2 PRO A 42 -30.186 -5.453 -1.437 1.00 0.00 H new ATOM 0 HB3 PRO A 42 -29.230 -6.746 -2.134 1.00 0.00 H new ATOM 0 HG2 PRO A 42 -29.883 -6.211 0.744 1.00 0.00 H new ATOM 0 HG3 PRO A 42 -29.783 -7.743 -0.101 1.00 0.00 H new ATOM 0 HD2 PRO A 42 -27.782 -6.845 1.521 1.00 0.00 H new ATOM 0 HD3 PRO A 42 -27.468 -7.878 0.141 1.00 0.00 H new ATOM 269 N GLY A 43 -28.605 -2.891 -1.806 1.00 0.00 N ATOM 270 CA GLY A 43 -28.943 -1.516 -1.553 1.00 0.00 C ATOM 271 C GLY A 43 -27.745 -0.600 -1.626 1.00 0.00 C ATOM 272 O GLY A 43 -27.833 0.584 -1.288 1.00 0.00 O ATOM 0 H GLY A 43 -28.537 -3.135 -2.794 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -29.689 -1.190 -2.277 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -29.399 -1.434 -0.566 1.00 0.00 H new ATOM 276 N LEU A 44 -26.626 -1.141 -2.027 1.00 0.00 N ATOM 277 CA LEU A 44 -25.439 -0.372 -2.222 1.00 0.00 C ATOM 278 C LEU A 44 -25.389 0.121 -3.637 1.00 0.00 C ATOM 279 O LEU A 44 -26.025 -0.448 -4.527 1.00 0.00 O ATOM 280 CB LEU A 44 -24.174 -1.180 -1.923 1.00 0.00 C ATOM 281 CG LEU A 44 -23.939 -1.598 -0.477 1.00 0.00 C ATOM 282 CD1 LEU A 44 -22.591 -2.277 -0.348 1.00 0.00 C ATOM 283 CD2 LEU A 44 -24.007 -0.403 0.437 1.00 0.00 C ATOM 0 H LEU A 44 -26.518 -2.135 -2.227 1.00 0.00 H new ATOM 0 HA LEU A 44 -25.471 0.467 -1.526 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -24.197 -2.081 -2.536 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -23.314 -0.594 -2.249 1.00 0.00 H new ATOM 0 HG LEU A 44 -24.721 -2.300 -0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -22.430 -2.573 0.689 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -22.566 -3.161 -0.986 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -21.805 -1.587 -0.654 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -23.837 -0.721 1.465 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -23.243 0.319 0.149 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -24.991 0.060 0.359 1.00 0.00 H new ATOM 295 N THR A 45 -24.656 1.154 -3.845 1.00 0.00 N ATOM 296 CA THR A 45 -24.444 1.673 -5.149 1.00 0.00 C ATOM 297 C THR A 45 -23.140 1.078 -5.647 1.00 0.00 C ATOM 298 O THR A 45 -22.388 0.532 -4.837 1.00 0.00 O ATOM 299 CB THR A 45 -24.358 3.200 -5.067 1.00 0.00 C ATOM 300 OG1 THR A 45 -23.276 3.575 -4.194 1.00 0.00 O ATOM 301 CG2 THR A 45 -25.646 3.743 -4.488 1.00 0.00 C ATOM 0 H THR A 45 -24.180 1.670 -3.105 1.00 0.00 H new ATOM 0 HA THR A 45 -25.256 1.420 -5.831 1.00 0.00 H new ATOM 0 HB THR A 45 -24.191 3.603 -6.066 1.00 0.00 H new ATOM 0 HG1 THR A 45 -23.220 4.552 -4.143 1.00 0.00 H new ATOM 0 HG21 THR A 45 -25.588 4.830 -4.428 1.00 0.00 H new ATOM 0 HG22 THR A 45 -26.481 3.459 -5.128 1.00 0.00 H new ATOM 0 HG23 THR A 45 -25.798 3.332 -3.490 1.00 0.00 H new ATOM 309 N ARG A 46 -22.859 1.154 -6.932 1.00 0.00 N ATOM 310 CA ARG A 46 -21.628 0.595 -7.467 1.00 0.00 C ATOM 311 C ARG A 46 -20.390 1.229 -6.806 1.00 0.00 C ATOM 312 O ARG A 46 -19.352 0.569 -6.630 1.00 0.00 O ATOM 313 CB ARG A 46 -21.543 0.648 -9.022 1.00 0.00 C ATOM 314 CG ARG A 46 -21.408 2.019 -9.664 1.00 0.00 C ATOM 315 CD ARG A 46 -22.720 2.760 -9.742 1.00 0.00 C ATOM 316 NE ARG A 46 -22.529 4.109 -10.253 1.00 0.00 N ATOM 317 CZ ARG A 46 -23.485 5.016 -10.392 1.00 0.00 C ATOM 318 NH1 ARG A 46 -24.770 4.681 -10.216 1.00 0.00 N ATOM 319 NH2 ARG A 46 -23.156 6.253 -10.739 1.00 0.00 N ATOM 0 H ARG A 46 -23.462 1.595 -7.626 1.00 0.00 H new ATOM 0 HA ARG A 46 -21.643 -0.464 -7.211 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -20.692 0.043 -9.335 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -22.437 0.173 -9.426 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -20.694 2.613 -9.094 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -20.999 1.906 -10.668 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -23.410 2.217 -10.388 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -23.176 2.803 -8.753 1.00 0.00 H new ATOM 0 HE ARG A 46 -21.584 4.378 -10.526 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -25.018 3.722 -9.973 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -25.500 5.385 -10.325 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -22.178 6.496 -10.895 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -23.881 6.962 -10.850 1.00 0.00 H new ATOM 333 N GLU A 47 -20.516 2.489 -6.428 1.00 0.00 N ATOM 334 CA GLU A 47 -19.453 3.208 -5.762 1.00 0.00 C ATOM 335 C GLU A 47 -19.314 2.689 -4.340 1.00 0.00 C ATOM 336 O GLU A 47 -18.210 2.405 -3.867 1.00 0.00 O ATOM 337 CB GLU A 47 -19.734 4.729 -5.705 1.00 0.00 C ATOM 338 CG GLU A 47 -20.218 5.357 -7.005 1.00 0.00 C ATOM 339 CD GLU A 47 -21.727 5.333 -7.127 1.00 0.00 C ATOM 340 OE1 GLU A 47 -22.317 4.250 -7.096 1.00 0.00 O ATOM 341 OE2 GLU A 47 -22.342 6.422 -7.182 1.00 0.00 O ATOM 0 H GLU A 47 -21.361 3.040 -6.576 1.00 0.00 H new ATOM 0 HA GLU A 47 -18.537 3.048 -6.330 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -20.481 4.914 -4.933 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -18.821 5.238 -5.394 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -19.867 6.388 -7.061 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -19.779 4.825 -7.849 1.00 0.00 H new ATOM 348 N GLN A 48 -20.449 2.527 -3.676 1.00 0.00 N ATOM 349 CA GLN A 48 -20.468 2.109 -2.289 1.00 0.00 C ATOM 350 C GLN A 48 -20.025 0.653 -2.164 1.00 0.00 C ATOM 351 O GLN A 48 -19.425 0.265 -1.160 1.00 0.00 O ATOM 352 CB GLN A 48 -21.854 2.279 -1.693 1.00 0.00 C ATOM 353 CG GLN A 48 -21.862 2.255 -0.189 1.00 0.00 C ATOM 354 CD GLN A 48 -21.173 3.462 0.409 1.00 0.00 C ATOM 355 OE1 GLN A 48 -19.977 3.451 0.674 1.00 0.00 O ATOM 356 NE2 GLN A 48 -21.917 4.515 0.602 1.00 0.00 N ATOM 0 H GLN A 48 -21.372 2.681 -4.082 1.00 0.00 H new ATOM 0 HA GLN A 48 -19.772 2.741 -1.737 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -22.276 3.223 -2.037 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -22.502 1.486 -2.066 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -22.892 2.215 0.166 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -21.369 1.348 0.160 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -22.910 4.488 0.370 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -21.506 5.366 0.985 1.00 0.00 H new ATOM 365 N GLU A 49 -20.322 -0.147 -3.189 1.00 0.00 N ATOM 366 CA GLU A 49 -19.887 -1.537 -3.227 1.00 0.00 C ATOM 367 C GLU A 49 -18.413 -1.599 -3.152 1.00 0.00 C ATOM 368 O GLU A 49 -17.864 -2.297 -2.306 1.00 0.00 O ATOM 369 CB GLU A 49 -20.315 -2.250 -4.493 1.00 0.00 C ATOM 370 CG GLU A 49 -21.771 -2.550 -4.602 1.00 0.00 C ATOM 371 CD GLU A 49 -22.117 -3.224 -5.913 1.00 0.00 C ATOM 372 OE1 GLU A 49 -21.223 -3.395 -6.782 1.00 0.00 O ATOM 373 OE2 GLU A 49 -23.282 -3.615 -6.096 1.00 0.00 O ATOM 0 H GLU A 49 -20.862 0.147 -4.002 1.00 0.00 H new ATOM 0 HA GLU A 49 -20.354 -2.032 -2.376 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -20.023 -1.641 -5.348 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -19.763 -3.187 -4.565 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -22.071 -3.192 -3.774 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -22.339 -1.624 -4.510 1.00 0.00 H new ATOM 380 N ARG A 50 -17.771 -0.830 -4.010 1.00 0.00 N ATOM 381 CA ARG A 50 -16.353 -0.788 -4.048 1.00 0.00 C ATOM 382 C ARG A 50 -15.809 -0.352 -2.737 1.00 0.00 C ATOM 383 O ARG A 50 -14.935 -0.973 -2.248 1.00 0.00 O ATOM 384 CB ARG A 50 -15.832 0.093 -5.165 1.00 0.00 C ATOM 385 CG ARG A 50 -15.983 -0.489 -6.545 1.00 0.00 C ATOM 386 CD ARG A 50 -15.291 -1.835 -6.633 1.00 0.00 C ATOM 387 NE ARG A 50 -15.108 -2.249 -8.021 1.00 0.00 N ATOM 388 CZ ARG A 50 -14.067 -2.938 -8.505 1.00 0.00 C ATOM 389 NH1 ARG A 50 -13.118 -3.410 -7.693 1.00 0.00 N ATOM 390 NH2 ARG A 50 -13.990 -3.162 -9.810 1.00 0.00 N ATOM 0 H ARG A 50 -18.231 -0.225 -4.691 1.00 0.00 H new ATOM 0 HA ARG A 50 -16.007 -1.801 -4.255 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -16.354 1.049 -5.129 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -14.777 0.299 -4.985 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -17.040 -0.601 -6.785 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -15.559 0.193 -7.282 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -14.322 -1.781 -6.137 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -15.879 -2.584 -6.103 1.00 0.00 H new ATOM 0 HE ARG A 50 -15.840 -1.990 -8.682 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -13.180 -3.248 -6.688 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -12.331 -3.933 -8.078 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -14.718 -2.811 -10.432 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -13.202 -3.685 -10.192 1.00 0.00 H new ATOM 404 N ALA A 51 -16.412 0.660 -2.144 1.00 0.00 N ATOM 405 CA ALA A 51 -15.977 1.186 -0.849 1.00 0.00 C ATOM 406 C ALA A 51 -16.017 0.099 0.246 1.00 0.00 C ATOM 407 O ALA A 51 -15.092 -0.017 1.037 1.00 0.00 O ATOM 408 CB ALA A 51 -16.845 2.361 -0.467 1.00 0.00 C ATOM 0 H ALA A 51 -17.217 1.146 -2.540 1.00 0.00 H new ATOM 0 HA ALA A 51 -14.942 1.515 -0.939 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -16.522 2.754 0.497 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -16.756 3.140 -1.224 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -17.884 2.039 -0.398 1.00 0.00 H new ATOM 414 N TYR A 52 -17.068 -0.695 0.271 1.00 0.00 N ATOM 415 CA TYR A 52 -17.163 -1.792 1.211 1.00 0.00 C ATOM 416 C TYR A 52 -16.064 -2.840 0.932 1.00 0.00 C ATOM 417 O TYR A 52 -15.366 -3.300 1.851 1.00 0.00 O ATOM 418 CB TYR A 52 -18.591 -2.401 1.159 1.00 0.00 C ATOM 419 CG TYR A 52 -18.644 -3.890 1.400 1.00 0.00 C ATOM 420 CD1 TYR A 52 -18.494 -4.435 2.666 1.00 0.00 C ATOM 421 CD2 TYR A 52 -18.797 -4.746 0.329 1.00 0.00 C ATOM 422 CE1 TYR A 52 -18.503 -5.802 2.849 1.00 0.00 C ATOM 423 CE2 TYR A 52 -18.796 -6.109 0.497 1.00 0.00 C ATOM 424 CZ TYR A 52 -18.650 -6.632 1.758 1.00 0.00 C ATOM 425 OH TYR A 52 -18.626 -7.989 1.927 1.00 0.00 O ATOM 0 H TYR A 52 -17.871 -0.600 -0.351 1.00 0.00 H new ATOM 0 HA TYR A 52 -16.997 -1.425 2.224 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -19.212 -1.903 1.903 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -19.028 -2.187 0.184 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -18.369 -3.783 3.517 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -18.920 -4.336 -0.662 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -18.396 -6.219 3.839 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -18.909 -6.763 -0.355 1.00 0.00 H new ATOM 0 HH TYR A 52 -19.540 -8.340 1.887 1.00 0.00 H new ATOM 435 N ILE A 53 -15.909 -3.173 -0.335 1.00 0.00 N ATOM 436 CA ILE A 53 -14.937 -4.156 -0.787 1.00 0.00 C ATOM 437 C ILE A 53 -13.513 -3.660 -0.499 1.00 0.00 C ATOM 438 O ILE A 53 -12.709 -4.367 0.115 1.00 0.00 O ATOM 439 CB ILE A 53 -15.137 -4.439 -2.314 1.00 0.00 C ATOM 440 CG1 ILE A 53 -16.543 -5.032 -2.547 1.00 0.00 C ATOM 441 CG2 ILE A 53 -14.055 -5.373 -2.859 1.00 0.00 C ATOM 442 CD1 ILE A 53 -16.986 -5.102 -4.001 1.00 0.00 C ATOM 0 H ILE A 53 -16.460 -2.765 -1.090 1.00 0.00 H new ATOM 0 HA ILE A 53 -15.087 -5.089 -0.243 1.00 0.00 H new ATOM 0 HB ILE A 53 -15.049 -3.497 -2.856 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -16.569 -6.038 -2.127 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -17.267 -4.436 -1.992 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -14.226 -5.547 -3.921 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -13.075 -4.916 -2.719 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -14.092 -6.323 -2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -17.986 -5.533 -4.056 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -16.999 -4.098 -4.426 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -16.291 -5.725 -4.564 1.00 0.00 H new ATOM 454 N VAL A 54 -13.247 -2.426 -0.874 1.00 0.00 N ATOM 455 CA VAL A 54 -11.951 -1.823 -0.695 1.00 0.00 C ATOM 456 C VAL A 54 -11.606 -1.644 0.761 1.00 0.00 C ATOM 457 O VAL A 54 -10.487 -1.833 1.112 1.00 0.00 O ATOM 458 CB VAL A 54 -11.753 -0.488 -1.480 1.00 0.00 C ATOM 459 CG1 VAL A 54 -11.875 -0.695 -2.968 1.00 0.00 C ATOM 460 CG2 VAL A 54 -12.701 0.574 -1.025 1.00 0.00 C ATOM 0 H VAL A 54 -13.932 -1.812 -1.315 1.00 0.00 H new ATOM 0 HA VAL A 54 -11.252 -2.537 -1.131 1.00 0.00 H new ATOM 0 HB VAL A 54 -10.740 -0.149 -1.263 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -11.731 0.256 -3.481 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -11.117 -1.404 -3.300 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -12.865 -1.087 -3.201 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -12.528 1.485 -1.597 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -13.726 0.237 -1.179 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -12.541 0.775 0.034 1.00 0.00 H new ATOM 470 N GLN A 55 -12.588 -1.329 1.613 1.00 0.00 N ATOM 471 CA GLN A 55 -12.330 -1.147 3.047 1.00 0.00 C ATOM 472 C GLN A 55 -11.748 -2.421 3.645 1.00 0.00 C ATOM 473 O GLN A 55 -10.777 -2.379 4.409 1.00 0.00 O ATOM 474 CB GLN A 55 -13.601 -0.775 3.801 1.00 0.00 C ATOM 475 CG GLN A 55 -13.357 -0.423 5.266 1.00 0.00 C ATOM 476 CD GLN A 55 -14.634 -0.194 6.040 1.00 0.00 C ATOM 477 OE1 GLN A 55 -15.670 -0.785 5.742 1.00 0.00 O ATOM 478 NE2 GLN A 55 -14.577 0.650 7.035 1.00 0.00 N ATOM 0 H GLN A 55 -13.561 -1.196 1.338 1.00 0.00 H new ATOM 0 HA GLN A 55 -11.615 -0.331 3.149 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -14.073 0.073 3.305 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -14.303 -1.607 3.747 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -12.792 -1.227 5.738 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -12.740 0.474 5.320 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -13.700 1.122 7.253 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -15.410 0.837 7.594 1.00 0.00 H new ATOM 487 N LEU A 56 -12.331 -3.551 3.266 1.00 0.00 N ATOM 488 CA LEU A 56 -11.871 -4.848 3.733 1.00 0.00 C ATOM 489 C LEU A 56 -10.469 -5.116 3.199 1.00 0.00 C ATOM 490 O LEU A 56 -9.586 -5.537 3.913 1.00 0.00 O ATOM 491 CB LEU A 56 -12.823 -5.940 3.274 1.00 0.00 C ATOM 492 CG LEU A 56 -14.285 -5.779 3.701 1.00 0.00 C ATOM 493 CD1 LEU A 56 -15.112 -6.903 3.148 1.00 0.00 C ATOM 494 CD2 LEU A 56 -14.419 -5.730 5.207 1.00 0.00 C ATOM 0 H LEU A 56 -13.129 -3.593 2.632 1.00 0.00 H new ATOM 0 HA LEU A 56 -11.845 -4.846 4.823 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -12.787 -5.992 2.186 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -12.458 -6.895 3.652 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.648 -4.833 3.300 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -16.149 -6.778 3.458 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -15.055 -6.895 2.060 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -14.733 -7.853 3.524 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -15.469 -5.615 5.475 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -14.034 -6.655 5.637 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -13.851 -4.885 5.596 1.00 0.00 H new ATOM 506 N GLN A 57 -10.272 -4.810 1.953 1.00 0.00 N ATOM 507 CA GLN A 57 -8.981 -4.972 1.326 1.00 0.00 C ATOM 508 C GLN A 57 -7.945 -4.022 1.957 1.00 0.00 C ATOM 509 O GLN A 57 -6.808 -4.389 2.133 1.00 0.00 O ATOM 510 CB GLN A 57 -9.095 -4.777 -0.175 1.00 0.00 C ATOM 511 CG GLN A 57 -10.021 -5.783 -0.844 1.00 0.00 C ATOM 512 CD GLN A 57 -10.224 -5.523 -2.323 1.00 0.00 C ATOM 513 OE1 GLN A 57 -10.183 -4.382 -2.787 1.00 0.00 O ATOM 514 NE2 GLN A 57 -10.455 -6.568 -3.074 1.00 0.00 N ATOM 0 H GLN A 57 -10.996 -4.441 1.337 1.00 0.00 H new ATOM 0 HA GLN A 57 -8.629 -5.989 1.498 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.458 -3.769 -0.377 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.103 -4.854 -0.621 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -9.613 -6.785 -0.711 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -10.989 -5.764 -0.343 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -10.482 -7.499 -2.658 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -10.608 -6.452 -4.076 1.00 0.00 H new ATOM 523 N ILE A 58 -8.372 -2.803 2.291 1.00 0.00 N ATOM 524 CA ILE A 58 -7.536 -1.799 2.968 1.00 0.00 C ATOM 525 C ILE A 58 -7.063 -2.317 4.317 1.00 0.00 C ATOM 526 O ILE A 58 -5.870 -2.230 4.630 1.00 0.00 O ATOM 527 CB ILE A 58 -8.310 -0.436 3.175 1.00 0.00 C ATOM 528 CG1 ILE A 58 -8.509 0.296 1.842 1.00 0.00 C ATOM 529 CG2 ILE A 58 -7.610 0.482 4.188 1.00 0.00 C ATOM 530 CD1 ILE A 58 -9.458 1.476 1.918 1.00 0.00 C ATOM 0 H ILE A 58 -9.319 -2.477 2.098 1.00 0.00 H new ATOM 0 HA ILE A 58 -6.676 -1.614 2.325 1.00 0.00 H new ATOM 0 HB ILE A 58 -9.288 -0.691 3.583 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -7.541 0.645 1.484 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -8.886 -0.412 1.104 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -8.179 1.405 4.296 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -7.548 -0.021 5.153 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -6.605 0.714 3.835 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -9.543 1.938 0.935 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -10.440 1.133 2.244 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -9.074 2.207 2.630 1.00 0.00 H new ATOM 542 N GLU A 59 -7.972 -2.878 5.100 1.00 0.00 N ATOM 543 CA GLU A 59 -7.601 -3.393 6.408 1.00 0.00 C ATOM 544 C GLU A 59 -6.690 -4.590 6.274 1.00 0.00 C ATOM 545 O GLU A 59 -5.696 -4.708 6.992 1.00 0.00 O ATOM 546 CB GLU A 59 -8.813 -3.715 7.289 1.00 0.00 C ATOM 547 CG GLU A 59 -9.832 -4.643 6.680 1.00 0.00 C ATOM 548 CD GLU A 59 -10.805 -5.159 7.679 1.00 0.00 C ATOM 549 OE1 GLU A 59 -11.598 -4.367 8.216 1.00 0.00 O ATOM 550 OE2 GLU A 59 -10.777 -6.371 7.984 1.00 0.00 O ATOM 0 H GLU A 59 -8.957 -2.987 4.858 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.057 -2.597 6.916 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -8.456 -4.156 8.220 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.309 -2.780 7.549 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -10.371 -4.118 5.891 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.319 -5.482 6.211 1.00 0.00 H new ATOM 557 N ASP A 60 -6.990 -5.432 5.313 1.00 0.00 N ATOM 558 CA ASP A 60 -6.201 -6.609 5.055 1.00 0.00 C ATOM 559 C ASP A 60 -4.844 -6.261 4.495 1.00 0.00 C ATOM 560 O ASP A 60 -3.845 -6.919 4.805 1.00 0.00 O ATOM 561 CB ASP A 60 -6.930 -7.592 4.166 1.00 0.00 C ATOM 562 CG ASP A 60 -8.023 -8.335 4.912 1.00 0.00 C ATOM 563 OD1 ASP A 60 -7.731 -8.896 6.006 1.00 0.00 O ATOM 564 OD2 ASP A 60 -9.154 -8.400 4.430 1.00 0.00 O ATOM 0 H ASP A 60 -7.789 -5.318 4.689 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.041 -7.099 6.015 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -7.366 -7.061 3.320 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -6.217 -8.309 3.759 1.00 0.00 H new ATOM 569 N LEU A 61 -4.795 -5.230 3.674 1.00 0.00 N ATOM 570 CA LEU A 61 -3.540 -4.710 3.193 1.00 0.00 C ATOM 571 C LEU A 61 -2.740 -4.170 4.332 1.00 0.00 C ATOM 572 O LEU A 61 -1.585 -4.487 4.459 1.00 0.00 O ATOM 573 CB LEU A 61 -3.724 -3.633 2.117 1.00 0.00 C ATOM 574 CG LEU A 61 -3.945 -4.132 0.689 1.00 0.00 C ATOM 575 CD1 LEU A 61 -4.434 -3.000 -0.176 1.00 0.00 C ATOM 576 CD2 LEU A 61 -2.635 -4.661 0.114 1.00 0.00 C ATOM 0 H LEU A 61 -5.618 -4.737 3.327 1.00 0.00 H new ATOM 0 HA LEU A 61 -3.004 -5.538 2.728 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -4.574 -3.011 2.397 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -2.844 -2.990 2.122 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.686 -4.931 0.708 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -4.590 -3.360 -1.193 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.374 -2.618 0.222 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.692 -2.201 -0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -2.801 -5.015 -0.904 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.893 -3.862 0.104 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -2.274 -5.484 0.730 1.00 0.00 H new ATOM 588 N THR A 62 -3.376 -3.413 5.204 1.00 0.00 N ATOM 589 CA THR A 62 -2.699 -2.812 6.304 1.00 0.00 C ATOM 590 C THR A 62 -2.204 -3.894 7.264 1.00 0.00 C ATOM 591 O THR A 62 -1.112 -3.801 7.777 1.00 0.00 O ATOM 592 CB THR A 62 -3.578 -1.755 7.013 1.00 0.00 C ATOM 593 OG1 THR A 62 -4.088 -0.847 6.025 1.00 0.00 O ATOM 594 CG2 THR A 62 -2.766 -0.952 8.020 1.00 0.00 C ATOM 0 H THR A 62 -4.374 -3.206 5.158 1.00 0.00 H new ATOM 0 HA THR A 62 -1.830 -2.273 5.925 1.00 0.00 H new ATOM 0 HB THR A 62 -4.384 -2.269 7.537 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.891 -1.229 5.613 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.410 -0.217 8.503 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.354 -1.624 8.773 1.00 0.00 H new ATOM 0 HG23 THR A 62 -1.953 -0.440 7.506 1.00 0.00 H new ATOM 602 N ARG A 63 -2.988 -4.961 7.405 1.00 0.00 N ATOM 603 CA ARG A 63 -2.637 -6.131 8.218 1.00 0.00 C ATOM 604 C ARG A 63 -1.299 -6.681 7.716 1.00 0.00 C ATOM 605 O ARG A 63 -0.394 -6.992 8.493 1.00 0.00 O ATOM 606 CB ARG A 63 -3.700 -7.203 7.984 1.00 0.00 C ATOM 607 CG ARG A 63 -3.559 -8.454 8.817 1.00 0.00 C ATOM 608 CD ARG A 63 -4.363 -9.596 8.212 1.00 0.00 C ATOM 609 NE ARG A 63 -3.682 -10.154 7.020 1.00 0.00 N ATOM 610 CZ ARG A 63 -4.274 -10.593 5.893 1.00 0.00 C ATOM 611 NH1 ARG A 63 -5.560 -10.375 5.671 1.00 0.00 N ATOM 612 NH2 ARG A 63 -3.547 -11.210 4.964 1.00 0.00 N ATOM 0 H ARG A 63 -3.899 -5.041 6.953 1.00 0.00 H new ATOM 0 HA ARG A 63 -2.575 -5.863 9.273 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -4.680 -6.767 8.179 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -3.681 -7.485 6.931 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -2.508 -8.737 8.882 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -3.901 -8.260 9.834 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.503 -10.381 8.956 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -5.355 -9.240 7.935 1.00 0.00 H new ATOM 0 HE ARG A 63 -2.664 -10.211 7.057 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -6.117 -9.868 6.358 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -5.994 -10.714 4.812 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -2.547 -11.348 5.108 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -3.990 -11.545 4.108 1.00 0.00 H new ATOM 626 N LYS A 64 -1.185 -6.717 6.412 1.00 0.00 N ATOM 627 CA LYS A 64 -0.028 -7.165 5.711 1.00 0.00 C ATOM 628 C LYS A 64 1.200 -6.311 6.019 1.00 0.00 C ATOM 629 O LYS A 64 2.242 -6.853 6.338 1.00 0.00 O ATOM 630 CB LYS A 64 -0.383 -7.207 4.240 1.00 0.00 C ATOM 631 CG LYS A 64 0.725 -7.056 3.263 1.00 0.00 C ATOM 632 CD LYS A 64 0.174 -7.070 1.844 1.00 0.00 C ATOM 633 CE LYS A 64 -0.629 -8.332 1.599 1.00 0.00 C ATOM 634 NZ LYS A 64 -1.084 -8.493 0.199 1.00 0.00 N ATOM 0 H LYS A 64 -1.936 -6.419 5.790 1.00 0.00 H new ATOM 0 HA LYS A 64 0.258 -8.164 6.040 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.880 -8.156 4.041 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -1.111 -6.419 4.047 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.257 -6.123 3.446 1.00 0.00 H new ATOM 0 HG3 LYS A 64 1.445 -7.864 3.390 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -0.455 -6.195 1.683 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.994 -7.009 1.128 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.023 -9.195 1.875 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.499 -8.330 2.255 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.625 -9.377 0.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -1.688 -7.689 -0.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.258 -8.527 -0.433 1.00 0.00 H new ATOM 648 N LEU A 65 1.076 -4.994 5.964 1.00 0.00 N ATOM 649 CA LEU A 65 2.210 -4.135 6.329 1.00 0.00 C ATOM 650 C LEU A 65 2.481 -4.145 7.832 1.00 0.00 C ATOM 651 O LEU A 65 3.616 -3.986 8.261 1.00 0.00 O ATOM 652 CB LEU A 65 2.118 -2.682 5.778 1.00 0.00 C ATOM 653 CG LEU A 65 0.730 -2.042 5.691 1.00 0.00 C ATOM 654 CD1 LEU A 65 0.797 -0.572 6.003 1.00 0.00 C ATOM 655 CD2 LEU A 65 0.196 -2.193 4.284 1.00 0.00 C ATOM 0 H LEU A 65 0.230 -4.500 5.680 1.00 0.00 H new ATOM 0 HA LEU A 65 3.068 -4.584 5.828 1.00 0.00 H new ATOM 0 HB2 LEU A 65 2.743 -2.045 6.405 1.00 0.00 H new ATOM 0 HB3 LEU A 65 2.555 -2.673 4.779 1.00 0.00 H new ATOM 0 HG LEU A 65 0.082 -2.540 6.413 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -0.201 -0.140 5.935 1.00 0.00 H new ATOM 0 HD12 LEU A 65 1.185 -0.431 7.012 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.456 -0.078 5.289 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.792 -1.738 4.219 1.00 0.00 H new ATOM 0 HD22 LEU A 65 0.870 -1.699 3.584 1.00 0.00 H new ATOM 0 HD23 LEU A 65 0.125 -3.251 4.033 1.00 0.00 H new ATOM 667 N ARG A 66 1.443 -4.350 8.611 1.00 0.00 N ATOM 668 CA ARG A 66 1.541 -4.381 10.060 1.00 0.00 C ATOM 669 C ARG A 66 2.334 -5.584 10.577 1.00 0.00 C ATOM 670 O ARG A 66 3.228 -5.428 11.420 1.00 0.00 O ATOM 671 CB ARG A 66 0.149 -4.358 10.674 1.00 0.00 C ATOM 672 CG ARG A 66 -0.540 -3.001 10.585 1.00 0.00 C ATOM 673 CD ARG A 66 -2.038 -3.124 10.826 1.00 0.00 C ATOM 674 NE ARG A 66 -2.335 -3.811 12.080 1.00 0.00 N ATOM 675 CZ ARG A 66 -3.410 -4.573 12.317 1.00 0.00 C ATOM 676 NH1 ARG A 66 -4.446 -4.583 11.470 1.00 0.00 N ATOM 677 NH2 ARG A 66 -3.470 -5.264 13.439 1.00 0.00 N ATOM 0 H ARG A 66 0.498 -4.501 8.258 1.00 0.00 H new ATOM 0 HA ARG A 66 2.092 -3.491 10.364 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -0.471 -5.103 10.175 1.00 0.00 H new ATOM 0 HB3 ARG A 66 0.219 -4.652 11.721 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -0.106 -2.322 11.319 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.362 -2.564 9.602 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -2.486 -2.130 10.842 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -2.495 -3.666 9.998 1.00 0.00 H new ATOM 0 HE ARG A 66 -1.665 -3.701 12.841 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -4.424 -4.005 10.630 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -5.258 -5.169 11.664 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -2.704 -5.213 14.111 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -4.282 -5.849 13.635 1.00 0.00 H new ATOM 691 N THR A 67 2.036 -6.769 10.076 1.00 0.00 N ATOM 692 CA THR A 67 2.717 -7.957 10.564 1.00 0.00 C ATOM 693 C THR A 67 3.769 -8.492 9.572 1.00 0.00 C ATOM 694 O THR A 67 4.671 -9.249 9.957 1.00 0.00 O ATOM 695 CB THR A 67 1.712 -9.085 10.980 1.00 0.00 C ATOM 696 OG1 THR A 67 2.410 -10.209 11.530 1.00 0.00 O ATOM 697 CG2 THR A 67 0.864 -9.553 9.807 1.00 0.00 C ATOM 0 H THR A 67 1.342 -6.935 9.347 1.00 0.00 H new ATOM 0 HA THR A 67 3.253 -7.644 11.460 1.00 0.00 H new ATOM 0 HB THR A 67 1.052 -8.655 11.734 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.345 -10.189 11.236 1.00 0.00 H new ATOM 0 HG21 THR A 67 0.182 -10.335 10.140 1.00 0.00 H new ATOM 0 HG22 THR A 67 0.290 -8.713 9.415 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.512 -9.946 9.024 1.00 0.00 H new ATOM 705 N GLY A 68 3.687 -8.084 8.328 1.00 0.00 N ATOM 706 CA GLY A 68 4.613 -8.596 7.338 1.00 0.00 C ATOM 707 C GLY A 68 4.045 -9.807 6.625 1.00 0.00 C ATOM 708 O GLY A 68 4.791 -10.685 6.174 1.00 0.00 O ATOM 0 H GLY A 68 3.004 -7.412 7.979 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.839 -7.816 6.611 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.553 -8.863 7.821 1.00 0.00 H new ATOM 712 N ASP A 69 2.729 -9.846 6.521 1.00 0.00 N ATOM 713 CA ASP A 69 2.020 -10.958 5.882 1.00 0.00 C ATOM 714 C ASP A 69 2.009 -10.771 4.374 1.00 0.00 C ATOM 715 O ASP A 69 1.119 -10.138 3.816 1.00 0.00 O ATOM 716 CB ASP A 69 0.582 -11.088 6.427 1.00 0.00 C ATOM 717 CG ASP A 69 -0.214 -12.205 5.778 1.00 0.00 C ATOM 718 OD1 ASP A 69 -0.076 -13.371 6.187 1.00 0.00 O ATOM 719 OD2 ASP A 69 -1.026 -11.934 4.870 1.00 0.00 O ATOM 0 H ASP A 69 2.115 -9.112 6.874 1.00 0.00 H new ATOM 0 HA ASP A 69 2.548 -11.882 6.117 1.00 0.00 H new ATOM 0 HB2 ASP A 69 0.624 -11.260 7.502 1.00 0.00 H new ATOM 0 HB3 ASP A 69 0.058 -10.144 6.276 1.00 0.00 H new ATOM 724 N LEU A 70 3.046 -11.239 3.736 1.00 0.00 N ATOM 725 CA LEU A 70 3.185 -11.088 2.299 1.00 0.00 C ATOM 726 C LEU A 70 2.929 -12.374 1.555 1.00 0.00 C ATOM 727 O LEU A 70 2.242 -12.380 0.527 1.00 0.00 O ATOM 728 CB LEU A 70 4.584 -10.548 1.929 1.00 0.00 C ATOM 729 CG LEU A 70 4.758 -9.033 1.807 1.00 0.00 C ATOM 730 CD1 LEU A 70 3.933 -8.507 0.652 1.00 0.00 C ATOM 731 CD2 LEU A 70 4.392 -8.317 3.100 1.00 0.00 C ATOM 0 H LEU A 70 3.817 -11.733 4.185 1.00 0.00 H new ATOM 0 HA LEU A 70 2.426 -10.368 1.994 1.00 0.00 H new ATOM 0 HB2 LEU A 70 5.290 -10.906 2.679 1.00 0.00 H new ATOM 0 HB3 LEU A 70 4.874 -10.995 0.978 1.00 0.00 H new ATOM 0 HG LEU A 70 5.811 -8.831 1.613 1.00 0.00 H new ATOM 0 HD11 LEU A 70 4.064 -7.428 0.573 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.260 -8.980 -0.274 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.881 -8.734 0.824 1.00 0.00 H new ATOM 0 HD21 LEU A 70 4.529 -7.243 2.973 1.00 0.00 H new ATOM 0 HD22 LEU A 70 3.351 -8.523 3.348 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.034 -8.671 3.906 1.00 0.00 H new ATOM 743 N GLY A 71 3.477 -13.462 2.060 1.00 0.00 N ATOM 744 CA GLY A 71 3.357 -14.741 1.388 1.00 0.00 C ATOM 745 C GLY A 71 4.239 -14.791 0.144 1.00 0.00 C ATOM 746 O GLY A 71 4.141 -15.708 -0.669 1.00 0.00 O ATOM 0 H GLY A 71 4.008 -13.486 2.931 1.00 0.00 H new ATOM 0 HA2 GLY A 71 3.640 -15.542 2.071 1.00 0.00 H new ATOM 0 HA3 GLY A 71 2.318 -14.912 1.108 1.00 0.00 H new ATOM 750 N ILE A 72 5.105 -13.805 0.019 1.00 0.00 N ATOM 751 CA ILE A 72 5.967 -13.658 -1.128 1.00 0.00 C ATOM 752 C ILE A 72 7.409 -13.863 -0.696 1.00 0.00 C ATOM 753 O ILE A 72 7.985 -13.013 -0.003 1.00 0.00 O ATOM 754 CB ILE A 72 5.806 -12.256 -1.797 1.00 0.00 C ATOM 755 CG1 ILE A 72 4.343 -12.042 -2.245 1.00 0.00 C ATOM 756 CG2 ILE A 72 6.764 -12.108 -2.985 1.00 0.00 C ATOM 757 CD1 ILE A 72 4.070 -10.689 -2.879 1.00 0.00 C ATOM 0 H ILE A 72 5.228 -13.076 0.722 1.00 0.00 H new ATOM 0 HA ILE A 72 5.685 -14.408 -1.867 1.00 0.00 H new ATOM 0 HB ILE A 72 6.059 -11.491 -1.063 1.00 0.00 H new ATOM 0 HG12 ILE A 72 4.076 -12.823 -2.957 1.00 0.00 H new ATOM 0 HG13 ILE A 72 3.690 -12.162 -1.380 1.00 0.00 H new ATOM 0 HG21 ILE A 72 6.635 -11.124 -3.436 1.00 0.00 H new ATOM 0 HG22 ILE A 72 7.792 -12.217 -2.639 1.00 0.00 H new ATOM 0 HG23 ILE A 72 6.547 -12.878 -3.725 1.00 0.00 H new ATOM 0 HD11 ILE A 72 3.020 -10.626 -3.163 1.00 0.00 H new ATOM 0 HD12 ILE A 72 4.301 -9.899 -2.164 1.00 0.00 H new ATOM 0 HD13 ILE A 72 4.693 -10.570 -3.765 1.00 0.00 H new ATOM 769 N PRO A 73 7.998 -14.998 -1.052 1.00 0.00 N ATOM 770 CA PRO A 73 9.368 -15.313 -0.678 1.00 0.00 C ATOM 771 C PRO A 73 10.394 -14.533 -1.510 1.00 0.00 C ATOM 772 O PRO A 73 10.150 -14.220 -2.693 1.00 0.00 O ATOM 773 CB PRO A 73 9.476 -16.807 -0.973 1.00 0.00 C ATOM 774 CG PRO A 73 8.501 -17.048 -2.073 1.00 0.00 C ATOM 775 CD PRO A 73 7.379 -16.076 -1.861 1.00 0.00 C ATOM 0 HA PRO A 73 9.579 -15.048 0.358 1.00 0.00 H new ATOM 0 HB2 PRO A 73 10.488 -17.079 -1.274 1.00 0.00 H new ATOM 0 HB3 PRO A 73 9.235 -17.403 -0.093 1.00 0.00 H new ATOM 0 HG2 PRO A 73 8.968 -16.897 -3.046 1.00 0.00 H new ATOM 0 HG3 PRO A 73 8.136 -18.075 -2.051 1.00 0.00 H new ATOM 0 HD2 PRO A 73 6.994 -15.696 -2.807 1.00 0.00 H new ATOM 0 HD3 PRO A 73 6.542 -16.538 -1.339 1.00 0.00 H new ATOM 783 N PRO A 74 11.536 -14.180 -0.908 1.00 0.00 N ATOM 784 CA PRO A 74 12.612 -13.503 -1.618 1.00 0.00 C ATOM 785 C PRO A 74 13.334 -14.474 -2.557 1.00 0.00 C ATOM 786 O PRO A 74 13.259 -15.705 -2.376 1.00 0.00 O ATOM 787 CB PRO A 74 13.552 -13.047 -0.494 1.00 0.00 C ATOM 788 CG PRO A 74 13.318 -14.021 0.610 1.00 0.00 C ATOM 789 CD PRO A 74 11.868 -14.412 0.517 1.00 0.00 C ATOM 0 HA PRO A 74 12.258 -12.681 -2.240 1.00 0.00 H new ATOM 0 HB2 PRO A 74 14.593 -13.058 -0.818 1.00 0.00 H new ATOM 0 HB3 PRO A 74 13.327 -12.028 -0.178 1.00 0.00 H new ATOM 0 HG2 PRO A 74 13.965 -14.892 0.505 1.00 0.00 H new ATOM 0 HG3 PRO A 74 13.540 -13.574 1.579 1.00 0.00 H new ATOM 0 HD2 PRO A 74 11.714 -15.453 0.800 1.00 0.00 H new ATOM 0 HD3 PRO A 74 11.246 -13.807 1.177 1.00 0.00 H new ATOM 797 N ASN A 75 14.009 -13.941 -3.547 1.00 0.00 N ATOM 798 CA ASN A 75 14.741 -14.761 -4.492 1.00 0.00 C ATOM 799 C ASN A 75 15.965 -15.379 -3.828 1.00 0.00 C ATOM 800 O ASN A 75 16.628 -14.743 -3.001 1.00 0.00 O ATOM 801 CB ASN A 75 15.142 -13.984 -5.782 1.00 0.00 C ATOM 802 CG ASN A 75 15.982 -12.729 -5.555 1.00 0.00 C ATOM 803 OD1 ASN A 75 15.817 -12.017 -4.566 1.00 0.00 O ATOM 804 ND2 ASN A 75 16.877 -12.447 -6.474 1.00 0.00 N ATOM 0 H ASN A 75 14.069 -12.938 -3.723 1.00 0.00 H new ATOM 0 HA ASN A 75 14.068 -15.559 -4.807 1.00 0.00 H new ATOM 0 HB2 ASN A 75 15.696 -14.659 -6.435 1.00 0.00 H new ATOM 0 HB3 ASN A 75 14.233 -13.701 -6.313 1.00 0.00 H new ATOM 0 HD21 ASN A 75 17.461 -11.616 -6.379 1.00 0.00 H new ATOM 0 HD22 ASN A 75 16.988 -13.059 -7.282 1.00 0.00 H new ATOM 811 N PRO A 76 16.278 -16.640 -4.160 1.00 0.00 N ATOM 812 CA PRO A 76 17.423 -17.350 -3.576 1.00 0.00 C ATOM 813 C PRO A 76 18.751 -16.697 -3.954 1.00 0.00 C ATOM 814 O PRO A 76 19.736 -16.783 -3.238 1.00 0.00 O ATOM 815 CB PRO A 76 17.326 -18.754 -4.185 1.00 0.00 C ATOM 816 CG PRO A 76 16.496 -18.591 -5.410 1.00 0.00 C ATOM 817 CD PRO A 76 15.525 -17.498 -5.103 1.00 0.00 C ATOM 0 HA PRO A 76 17.395 -17.345 -2.486 1.00 0.00 H new ATOM 0 HB2 PRO A 76 18.313 -19.147 -4.428 1.00 0.00 H new ATOM 0 HB3 PRO A 76 16.866 -19.455 -3.488 1.00 0.00 H new ATOM 0 HG2 PRO A 76 17.115 -18.334 -6.270 1.00 0.00 H new ATOM 0 HG3 PRO A 76 15.977 -19.517 -5.656 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.234 -16.953 -6.001 1.00 0.00 H new ATOM 0 HD3 PRO A 76 14.610 -17.885 -4.654 1.00 0.00 H new ATOM 825 N GLU A 77 18.731 -15.998 -5.059 1.00 0.00 N ATOM 826 CA GLU A 77 19.898 -15.338 -5.611 1.00 0.00 C ATOM 827 C GLU A 77 20.326 -14.154 -4.749 1.00 0.00 C ATOM 828 O GLU A 77 21.493 -13.749 -4.760 1.00 0.00 O ATOM 829 CB GLU A 77 19.557 -14.845 -7.012 1.00 0.00 C ATOM 830 CG GLU A 77 19.084 -15.947 -7.949 1.00 0.00 C ATOM 831 CD GLU A 77 20.119 -17.022 -8.162 1.00 0.00 C ATOM 832 OE1 GLU A 77 20.192 -17.979 -7.360 1.00 0.00 O ATOM 833 OE2 GLU A 77 20.868 -16.944 -9.149 1.00 0.00 O ATOM 0 H GLU A 77 17.887 -15.865 -5.617 1.00 0.00 H new ATOM 0 HA GLU A 77 20.724 -16.049 -5.640 1.00 0.00 H new ATOM 0 HB2 GLU A 77 18.781 -14.083 -6.941 1.00 0.00 H new ATOM 0 HB3 GLU A 77 20.436 -14.366 -7.443 1.00 0.00 H new ATOM 0 HG2 GLU A 77 18.178 -16.398 -7.543 1.00 0.00 H new ATOM 0 HG3 GLU A 77 18.819 -15.509 -8.911 1.00 0.00 H new ATOM 840 N ASP A 78 19.395 -13.669 -3.950 1.00 0.00 N ATOM 841 CA ASP A 78 19.572 -12.448 -3.168 1.00 0.00 C ATOM 842 C ASP A 78 20.596 -12.592 -2.049 1.00 0.00 C ATOM 843 O ASP A 78 21.127 -11.599 -1.554 1.00 0.00 O ATOM 844 CB ASP A 78 18.237 -11.990 -2.614 1.00 0.00 C ATOM 845 CG ASP A 78 18.339 -10.746 -1.781 1.00 0.00 C ATOM 846 OD1 ASP A 78 18.349 -9.629 -2.347 1.00 0.00 O ATOM 847 OD2 ASP A 78 18.397 -10.858 -0.544 1.00 0.00 O ATOM 0 H ASP A 78 18.485 -14.111 -3.820 1.00 0.00 H new ATOM 0 HA ASP A 78 19.968 -11.693 -3.847 1.00 0.00 H new ATOM 0 HB2 ASP A 78 17.550 -11.811 -3.441 1.00 0.00 H new ATOM 0 HB3 ASP A 78 17.808 -12.790 -2.010 1.00 0.00 H new ATOM 852 N ARG A 79 20.903 -13.822 -1.662 1.00 0.00 N ATOM 853 CA ARG A 79 21.908 -14.042 -0.624 1.00 0.00 C ATOM 854 C ARG A 79 23.312 -13.596 -1.045 1.00 0.00 C ATOM 855 O ARG A 79 24.211 -13.480 -0.210 1.00 0.00 O ATOM 856 CB ARG A 79 21.876 -15.468 -0.006 1.00 0.00 C ATOM 857 CG ARG A 79 21.799 -16.655 -0.969 1.00 0.00 C ATOM 858 CD ARG A 79 22.949 -16.733 -1.955 1.00 0.00 C ATOM 859 NE ARG A 79 24.265 -16.776 -1.310 1.00 0.00 N ATOM 860 CZ ARG A 79 25.424 -16.630 -1.965 1.00 0.00 C ATOM 861 NH1 ARG A 79 25.430 -16.471 -3.287 1.00 0.00 N ATOM 862 NH2 ARG A 79 26.572 -16.629 -1.299 1.00 0.00 N ATOM 0 H ARG A 79 20.482 -14.670 -2.041 1.00 0.00 H new ATOM 0 HA ARG A 79 21.619 -13.381 0.193 1.00 0.00 H new ATOM 0 HB2 ARG A 79 22.770 -15.589 0.606 1.00 0.00 H new ATOM 0 HB3 ARG A 79 21.019 -15.524 0.666 1.00 0.00 H new ATOM 0 HG2 ARG A 79 21.770 -17.577 -0.389 1.00 0.00 H new ATOM 0 HG3 ARG A 79 20.863 -16.598 -1.524 1.00 0.00 H new ATOM 0 HD2 ARG A 79 22.827 -17.621 -2.575 1.00 0.00 H new ATOM 0 HD3 ARG A 79 22.907 -15.871 -2.621 1.00 0.00 H new ATOM 0 HE ARG A 79 24.300 -16.926 -0.302 1.00 0.00 H new ATOM 0 HH11 ARG A 79 24.550 -16.460 -3.803 1.00 0.00 H new ATOM 0 HH12 ARG A 79 26.314 -16.360 -3.783 1.00 0.00 H new ATOM 0 HH21 ARG A 79 26.573 -16.740 -0.285 1.00 0.00 H new ATOM 0 HH22 ARG A 79 27.453 -16.518 -1.801 1.00 0.00 H new ATOM 876 N SER A 80 23.491 -13.364 -2.334 1.00 0.00 N ATOM 877 CA SER A 80 24.715 -12.811 -2.845 1.00 0.00 C ATOM 878 C SER A 80 24.827 -11.380 -2.292 1.00 0.00 C ATOM 879 O SER A 80 23.805 -10.676 -2.224 1.00 0.00 O ATOM 880 CB SER A 80 24.644 -12.790 -4.370 1.00 0.00 C ATOM 881 OG SER A 80 24.353 -14.093 -4.880 1.00 0.00 O ATOM 0 H SER A 80 22.788 -13.556 -3.048 1.00 0.00 H new ATOM 0 HA SER A 80 25.583 -13.399 -2.547 1.00 0.00 H new ATOM 0 HB2 SER A 80 23.876 -12.087 -4.694 1.00 0.00 H new ATOM 0 HB3 SER A 80 25.591 -12.437 -4.778 1.00 0.00 H new ATOM 0 HG SER A 80 23.382 -14.215 -4.931 1.00 0.00 H new ATOM 887 N PRO A 81 26.030 -10.925 -1.852 1.00 0.00 N ATOM 888 CA PRO A 81 26.161 -9.614 -1.220 1.00 0.00 C ATOM 889 C PRO A 81 25.583 -8.512 -2.096 1.00 0.00 C ATOM 890 O PRO A 81 25.833 -8.453 -3.313 1.00 0.00 O ATOM 891 CB PRO A 81 27.675 -9.439 -1.072 1.00 0.00 C ATOM 892 CG PRO A 81 28.210 -10.827 -1.038 1.00 0.00 C ATOM 893 CD PRO A 81 27.317 -11.635 -1.935 1.00 0.00 C ATOM 0 HA PRO A 81 25.622 -9.553 -0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 81 28.092 -8.873 -1.905 1.00 0.00 H new ATOM 0 HB3 PRO A 81 27.924 -8.895 -0.161 1.00 0.00 H new ATOM 0 HG2 PRO A 81 29.243 -10.856 -1.386 1.00 0.00 H new ATOM 0 HG3 PRO A 81 28.205 -11.223 -0.022 1.00 0.00 H new ATOM 0 HD2 PRO A 81 27.695 -11.667 -2.957 1.00 0.00 H new ATOM 0 HD3 PRO A 81 27.231 -12.667 -1.595 1.00 0.00 H new ATOM 901 N SER A 82 24.844 -7.652 -1.477 1.00 0.00 N ATOM 902 CA SER A 82 24.174 -6.591 -2.142 1.00 0.00 C ATOM 903 C SER A 82 24.703 -5.248 -1.629 1.00 0.00 C ATOM 904 O SER A 82 25.346 -5.210 -0.567 1.00 0.00 O ATOM 905 CB SER A 82 22.674 -6.749 -1.896 1.00 0.00 C ATOM 906 OG SER A 82 22.220 -8.030 -2.362 1.00 0.00 O ATOM 0 H SER A 82 24.687 -7.671 -0.469 1.00 0.00 H new ATOM 0 HA SER A 82 24.357 -6.620 -3.216 1.00 0.00 H new ATOM 0 HB2 SER A 82 22.461 -6.646 -0.832 1.00 0.00 H new ATOM 0 HB3 SER A 82 22.130 -5.955 -2.408 1.00 0.00 H new ATOM 0 HG SER A 82 21.258 -8.116 -2.196 1.00 0.00 H new ATOM 912 N PRO A 83 24.512 -4.151 -2.378 1.00 0.00 N ATOM 913 CA PRO A 83 24.920 -2.823 -1.929 1.00 0.00 C ATOM 914 C PRO A 83 24.057 -2.352 -0.756 1.00 0.00 C ATOM 915 O PRO A 83 22.906 -2.801 -0.588 1.00 0.00 O ATOM 916 CB PRO A 83 24.688 -1.926 -3.158 1.00 0.00 C ATOM 917 CG PRO A 83 24.517 -2.864 -4.299 1.00 0.00 C ATOM 918 CD PRO A 83 23.910 -4.100 -3.721 1.00 0.00 C ATOM 0 HA PRO A 83 25.951 -2.803 -1.577 1.00 0.00 H new ATOM 0 HB2 PRO A 83 23.805 -1.300 -3.027 1.00 0.00 H new ATOM 0 HB3 PRO A 83 25.532 -1.257 -3.322 1.00 0.00 H new ATOM 0 HG2 PRO A 83 23.873 -2.434 -5.066 1.00 0.00 H new ATOM 0 HG3 PRO A 83 25.474 -3.083 -4.772 1.00 0.00 H new ATOM 0 HD2 PRO A 83 22.823 -4.036 -3.676 1.00 0.00 H new ATOM 0 HD3 PRO A 83 24.153 -4.985 -4.309 1.00 0.00 H new ATOM 926 N GLU A 84 24.604 -1.480 0.047 1.00 0.00 N ATOM 927 CA GLU A 84 23.908 -0.967 1.199 1.00 0.00 C ATOM 928 C GLU A 84 23.012 0.200 0.807 1.00 0.00 C ATOM 929 O GLU A 84 23.331 0.925 -0.142 1.00 0.00 O ATOM 930 CB GLU A 84 24.885 -0.560 2.294 1.00 0.00 C ATOM 931 CG GLU A 84 25.714 -1.709 2.819 1.00 0.00 C ATOM 932 CD GLU A 84 26.529 -1.313 4.005 1.00 0.00 C ATOM 933 OE1 GLU A 84 27.647 -0.758 3.823 1.00 0.00 O ATOM 934 OE2 GLU A 84 26.070 -1.539 5.152 1.00 0.00 O ATOM 0 H GLU A 84 25.544 -1.104 -0.078 1.00 0.00 H new ATOM 0 HA GLU A 84 23.278 -1.763 1.596 1.00 0.00 H new ATOM 0 HB2 GLU A 84 25.551 0.211 1.907 1.00 0.00 H new ATOM 0 HB3 GLU A 84 24.329 -0.116 3.120 1.00 0.00 H new ATOM 0 HG2 GLU A 84 25.058 -2.536 3.090 1.00 0.00 H new ATOM 0 HG3 GLU A 84 26.373 -2.071 2.030 1.00 0.00 H new ATOM 941 N PRO A 85 21.868 0.361 1.526 1.00 0.00 N ATOM 942 CA PRO A 85 20.854 1.400 1.282 1.00 0.00 C ATOM 943 C PRO A 85 21.388 2.770 0.854 1.00 0.00 C ATOM 944 O PRO A 85 22.375 3.293 1.408 1.00 0.00 O ATOM 945 CB PRO A 85 20.185 1.519 2.627 1.00 0.00 C ATOM 946 CG PRO A 85 20.193 0.144 3.167 1.00 0.00 C ATOM 947 CD PRO A 85 21.456 -0.502 2.663 1.00 0.00 C ATOM 0 HA PRO A 85 20.217 1.112 0.446 1.00 0.00 H new ATOM 0 HB2 PRO A 85 20.725 2.205 3.280 1.00 0.00 H new ATOM 0 HB3 PRO A 85 19.169 1.902 2.532 1.00 0.00 H new ATOM 0 HG2 PRO A 85 20.170 0.154 4.257 1.00 0.00 H new ATOM 0 HG3 PRO A 85 19.314 -0.409 2.835 1.00 0.00 H new ATOM 0 HD2 PRO A 85 22.223 -0.537 3.437 1.00 0.00 H new ATOM 0 HD3 PRO A 85 21.279 -1.529 2.342 1.00 0.00 H new ATOM 955 N ILE A 86 20.711 3.338 -0.112 1.00 0.00 N ATOM 956 CA ILE A 86 21.035 4.635 -0.654 1.00 0.00 C ATOM 957 C ILE A 86 20.475 5.736 0.277 1.00 0.00 C ATOM 958 O ILE A 86 19.527 5.498 1.054 1.00 0.00 O ATOM 959 CB ILE A 86 20.447 4.781 -2.100 1.00 0.00 C ATOM 960 CG1 ILE A 86 21.000 6.019 -2.826 1.00 0.00 C ATOM 961 CG2 ILE A 86 18.929 4.847 -2.045 1.00 0.00 C ATOM 962 CD1 ILE A 86 20.543 6.138 -4.270 1.00 0.00 C ATOM 0 H ILE A 86 19.901 2.903 -0.554 1.00 0.00 H new ATOM 0 HA ILE A 86 22.118 4.741 -0.716 1.00 0.00 H new ATOM 0 HB ILE A 86 20.754 3.902 -2.666 1.00 0.00 H new ATOM 0 HG12 ILE A 86 20.695 6.914 -2.283 1.00 0.00 H new ATOM 0 HG13 ILE A 86 22.089 5.987 -2.801 1.00 0.00 H new ATOM 0 HG21 ILE A 86 18.532 4.948 -3.055 1.00 0.00 H new ATOM 0 HG22 ILE A 86 18.541 3.934 -1.593 1.00 0.00 H new ATOM 0 HG23 ILE A 86 18.624 5.706 -1.447 1.00 0.00 H new ATOM 0 HD11 ILE A 86 20.974 7.035 -4.715 1.00 0.00 H new ATOM 0 HD12 ILE A 86 20.872 5.262 -4.829 1.00 0.00 H new ATOM 0 HD13 ILE A 86 19.455 6.203 -4.303 1.00 0.00 H new ATOM 974 N TYR A 87 21.092 6.886 0.244 1.00 0.00 N ATOM 975 CA TYR A 87 20.680 8.013 1.044 1.00 0.00 C ATOM 976 C TYR A 87 19.795 8.916 0.217 1.00 0.00 C ATOM 977 O TYR A 87 19.875 8.916 -1.015 1.00 0.00 O ATOM 978 CB TYR A 87 21.903 8.818 1.525 1.00 0.00 C ATOM 979 CG TYR A 87 22.819 8.086 2.486 1.00 0.00 C ATOM 980 CD1 TYR A 87 23.480 6.920 2.111 1.00 0.00 C ATOM 981 CD2 TYR A 87 23.029 8.570 3.767 1.00 0.00 C ATOM 982 CE1 TYR A 87 24.309 6.258 2.984 1.00 0.00 C ATOM 983 CE2 TYR A 87 23.863 7.913 4.646 1.00 0.00 C ATOM 984 CZ TYR A 87 24.498 6.758 4.250 1.00 0.00 C ATOM 985 OH TYR A 87 25.301 6.083 5.136 1.00 0.00 O ATOM 0 H TYR A 87 21.904 7.071 -0.345 1.00 0.00 H new ATOM 0 HA TYR A 87 20.137 7.641 1.913 1.00 0.00 H new ATOM 0 HB2 TYR A 87 22.484 9.121 0.654 1.00 0.00 H new ATOM 0 HB3 TYR A 87 21.551 9.730 2.007 1.00 0.00 H new ATOM 0 HD1 TYR A 87 23.339 6.528 1.115 1.00 0.00 H new ATOM 0 HD2 TYR A 87 22.532 9.476 4.082 1.00 0.00 H new ATOM 0 HE1 TYR A 87 24.809 5.351 2.677 1.00 0.00 H new ATOM 0 HE2 TYR A 87 24.018 8.303 5.641 1.00 0.00 H new ATOM 0 HH TYR A 87 25.331 6.569 5.986 1.00 0.00 H new ATOM 995 N ASN A 88 18.949 9.662 0.878 1.00 0.00 N ATOM 996 CA ASN A 88 18.121 10.652 0.212 1.00 0.00 C ATOM 997 C ASN A 88 18.946 11.918 0.035 1.00 0.00 C ATOM 998 O ASN A 88 20.048 12.031 0.606 1.00 0.00 O ATOM 999 CB ASN A 88 16.847 10.987 1.023 1.00 0.00 C ATOM 1000 CG ASN A 88 15.864 9.838 1.182 1.00 0.00 C ATOM 1001 OD1 ASN A 88 15.781 8.943 0.352 1.00 0.00 O ATOM 1002 ND2 ASN A 88 15.074 9.883 2.234 1.00 0.00 N ATOM 0 H ASN A 88 18.810 9.607 1.887 1.00 0.00 H new ATOM 0 HA ASN A 88 17.801 10.246 -0.748 1.00 0.00 H new ATOM 0 HB2 ASN A 88 17.145 11.330 2.014 1.00 0.00 H new ATOM 0 HB3 ASN A 88 16.335 11.819 0.539 1.00 0.00 H new ATOM 0 HD21 ASN A 88 14.369 9.159 2.374 1.00 0.00 H new ATOM 0 HD22 ASN A 88 15.167 10.642 2.909 1.00 0.00 H new ATOM 1009 N SER A 89 18.419 12.887 -0.687 1.00 0.00 N ATOM 1010 CA SER A 89 19.127 14.137 -0.960 1.00 0.00 C ATOM 1011 C SER A 89 19.271 14.972 0.324 1.00 0.00 C ATOM 1012 O SER A 89 20.170 15.820 0.452 1.00 0.00 O ATOM 1013 CB SER A 89 18.357 14.909 -2.021 1.00 0.00 C ATOM 1014 OG SER A 89 18.068 14.053 -3.126 1.00 0.00 O ATOM 0 H SER A 89 17.489 12.837 -1.104 1.00 0.00 H new ATOM 0 HA SER A 89 20.131 13.918 -1.323 1.00 0.00 H new ATOM 0 HB2 SER A 89 17.431 15.299 -1.599 1.00 0.00 H new ATOM 0 HB3 SER A 89 18.941 15.766 -2.356 1.00 0.00 H new ATOM 0 HG SER A 89 17.571 14.553 -3.806 1.00 0.00 H new ATOM 1020 N GLU A 90 18.412 14.683 1.286 1.00 0.00 N ATOM 1021 CA GLU A 90 18.411 15.358 2.570 1.00 0.00 C ATOM 1022 C GLU A 90 19.482 14.772 3.507 1.00 0.00 C ATOM 1023 O GLU A 90 19.727 15.308 4.578 1.00 0.00 O ATOM 1024 CB GLU A 90 17.017 15.260 3.202 1.00 0.00 C ATOM 1025 CG GLU A 90 16.546 13.837 3.438 1.00 0.00 C ATOM 1026 CD GLU A 90 15.095 13.753 3.834 1.00 0.00 C ATOM 1027 OE1 GLU A 90 14.763 13.913 5.028 1.00 0.00 O ATOM 1028 OE2 GLU A 90 14.259 13.503 2.961 1.00 0.00 O ATOM 0 H GLU A 90 17.690 13.968 1.196 1.00 0.00 H new ATOM 0 HA GLU A 90 18.656 16.408 2.413 1.00 0.00 H new ATOM 0 HB2 GLU A 90 17.022 15.793 4.153 1.00 0.00 H new ATOM 0 HB3 GLU A 90 16.300 15.767 2.556 1.00 0.00 H new ATOM 0 HG2 GLU A 90 16.703 13.253 2.531 1.00 0.00 H new ATOM 0 HG3 GLU A 90 17.156 13.383 4.219 1.00 0.00 H new ATOM 1035 N GLY A 91 20.127 13.679 3.080 1.00 0.00 N ATOM 1036 CA GLY A 91 21.183 13.057 3.884 1.00 0.00 C ATOM 1037 C GLY A 91 20.658 11.961 4.779 1.00 0.00 C ATOM 1038 O GLY A 91 21.405 11.339 5.541 1.00 0.00 O ATOM 0 H GLY A 91 19.938 13.213 2.193 1.00 0.00 H new ATOM 0 HA2 GLY A 91 21.946 12.647 3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 91 21.667 13.819 4.494 1.00 0.00 H new ATOM 1042 N LYS A 92 19.383 11.731 4.683 1.00 0.00 N ATOM 1043 CA LYS A 92 18.703 10.723 5.464 1.00 0.00 C ATOM 1044 C LYS A 92 18.816 9.396 4.742 1.00 0.00 C ATOM 1045 O LYS A 92 18.516 9.317 3.547 1.00 0.00 O ATOM 1046 CB LYS A 92 17.226 11.102 5.558 1.00 0.00 C ATOM 1047 CG LYS A 92 16.361 10.233 6.460 1.00 0.00 C ATOM 1048 CD LYS A 92 14.889 10.523 6.190 1.00 0.00 C ATOM 1049 CE LYS A 92 13.960 9.899 7.225 1.00 0.00 C ATOM 1050 NZ LYS A 92 14.084 10.545 8.553 1.00 0.00 N ATOM 0 H LYS A 92 18.769 12.244 4.050 1.00 0.00 H new ATOM 0 HA LYS A 92 19.142 10.650 6.459 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.159 12.132 5.909 1.00 0.00 H new ATOM 0 HB3 LYS A 92 16.803 11.080 4.554 1.00 0.00 H new ATOM 0 HG2 LYS A 92 16.574 9.179 6.279 1.00 0.00 H new ATOM 0 HG3 LYS A 92 16.595 10.431 7.506 1.00 0.00 H new ATOM 0 HD2 LYS A 92 14.734 11.602 6.174 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.626 10.148 5.201 1.00 0.00 H new ATOM 0 HE2 LYS A 92 12.929 9.978 6.880 1.00 0.00 H new ATOM 0 HE3 LYS A 92 14.184 8.836 7.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.312 10.221 9.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.998 10.291 8.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 14.029 11.578 8.443 1.00 0.00 H new ATOM 1064 N ARG A 93 19.254 8.381 5.422 1.00 0.00 N ATOM 1065 CA ARG A 93 19.289 7.071 4.830 1.00 0.00 C ATOM 1066 C ARG A 93 18.136 6.297 5.416 1.00 0.00 C ATOM 1067 O ARG A 93 17.625 6.654 6.484 1.00 0.00 O ATOM 1068 CB ARG A 93 20.605 6.347 5.130 1.00 0.00 C ATOM 1069 CG ARG A 93 20.820 5.072 4.308 1.00 0.00 C ATOM 1070 CD ARG A 93 22.033 4.305 4.783 1.00 0.00 C ATOM 1071 NE ARG A 93 21.841 3.790 6.135 1.00 0.00 N ATOM 1072 CZ ARG A 93 22.744 3.833 7.123 1.00 0.00 C ATOM 1073 NH1 ARG A 93 23.934 4.416 6.946 1.00 0.00 N ATOM 1074 NH2 ARG A 93 22.441 3.291 8.292 1.00 0.00 N ATOM 0 H ARG A 93 19.592 8.430 6.383 1.00 0.00 H new ATOM 0 HA ARG A 93 19.213 7.153 3.746 1.00 0.00 H new ATOM 0 HB2 ARG A 93 21.434 7.030 4.944 1.00 0.00 H new ATOM 0 HB3 ARG A 93 20.634 6.092 6.189 1.00 0.00 H new ATOM 0 HG2 ARG A 93 19.936 4.438 4.380 1.00 0.00 H new ATOM 0 HG3 ARG A 93 20.941 5.332 3.256 1.00 0.00 H new ATOM 0 HD2 ARG A 93 22.232 3.478 4.102 1.00 0.00 H new ATOM 0 HD3 ARG A 93 22.908 4.954 4.760 1.00 0.00 H new ATOM 0 HE ARG A 93 20.940 3.360 6.346 1.00 0.00 H new ATOM 0 HH11 ARG A 93 24.167 4.838 6.047 1.00 0.00 H new ATOM 0 HH12 ARG A 93 24.609 4.439 7.710 1.00 0.00 H new ATOM 0 HH21 ARG A 93 21.532 2.850 8.429 1.00 0.00 H new ATOM 0 HH22 ARG A 93 23.117 3.315 9.056 1.00 0.00 H new ATOM 1088 N LEU A 94 17.709 5.294 4.742 1.00 0.00 N ATOM 1089 CA LEU A 94 16.642 4.472 5.209 1.00 0.00 C ATOM 1090 C LEU A 94 16.909 3.083 4.715 1.00 0.00 C ATOM 1091 O LEU A 94 17.957 2.836 4.141 1.00 0.00 O ATOM 1092 CB LEU A 94 15.261 4.990 4.708 1.00 0.00 C ATOM 1093 CG LEU A 94 14.866 4.750 3.228 1.00 0.00 C ATOM 1094 CD1 LEU A 94 13.517 5.363 2.957 1.00 0.00 C ATOM 1095 CD2 LEU A 94 15.883 5.304 2.245 1.00 0.00 C ATOM 0 H LEU A 94 18.091 5.013 3.839 1.00 0.00 H new ATOM 0 HA LEU A 94 16.597 4.492 6.298 1.00 0.00 H new ATOM 0 HB2 LEU A 94 14.492 4.536 5.333 1.00 0.00 H new ATOM 0 HB3 LEU A 94 15.226 6.064 4.889 1.00 0.00 H new ATOM 0 HG LEU A 94 14.833 3.671 3.079 1.00 0.00 H new ATOM 0 HD11 LEU A 94 13.242 5.193 1.916 1.00 0.00 H new ATOM 0 HD12 LEU A 94 12.772 4.906 3.608 1.00 0.00 H new ATOM 0 HD13 LEU A 94 13.559 6.435 3.150 1.00 0.00 H new ATOM 0 HD21 LEU A 94 15.550 5.105 1.226 1.00 0.00 H new ATOM 0 HD22 LEU A 94 15.981 6.380 2.391 1.00 0.00 H new ATOM 0 HD23 LEU A 94 16.848 4.825 2.412 1.00 0.00 H new ATOM 1107 N ASN A 95 16.010 2.200 4.945 1.00 0.00 N ATOM 1108 CA ASN A 95 16.124 0.846 4.463 1.00 0.00 C ATOM 1109 C ASN A 95 15.685 0.783 3.026 1.00 0.00 C ATOM 1110 O ASN A 95 14.839 1.557 2.613 1.00 0.00 O ATOM 1111 CB ASN A 95 15.325 -0.106 5.334 1.00 0.00 C ATOM 1112 CG ASN A 95 16.033 -0.489 6.633 1.00 0.00 C ATOM 1113 OD1 ASN A 95 15.790 -1.557 7.200 1.00 0.00 O ATOM 1114 ND2 ASN A 95 16.917 0.346 7.104 1.00 0.00 N ATOM 0 H ASN A 95 15.160 2.384 5.477 1.00 0.00 H new ATOM 0 HA ASN A 95 17.166 0.532 4.518 1.00 0.00 H new ATOM 0 HB2 ASN A 95 14.366 0.353 5.575 1.00 0.00 H new ATOM 0 HB3 ASN A 95 15.111 -1.012 4.766 1.00 0.00 H new ATOM 0 HD21 ASN A 95 17.425 0.122 7.960 1.00 0.00 H new ATOM 0 HD22 ASN A 95 17.100 1.223 6.617 1.00 0.00 H new ATOM 1121 N THR A 96 16.282 -0.075 2.243 1.00 0.00 N ATOM 1122 CA THR A 96 15.934 -0.104 0.858 1.00 0.00 C ATOM 1123 C THR A 96 14.955 -1.244 0.508 1.00 0.00 C ATOM 1124 O THR A 96 13.907 -0.991 -0.074 1.00 0.00 O ATOM 1125 CB THR A 96 17.188 -0.062 -0.081 1.00 0.00 C ATOM 1126 OG1 THR A 96 16.793 0.075 -1.441 1.00 0.00 O ATOM 1127 CG2 THR A 96 18.072 -1.291 0.061 1.00 0.00 C ATOM 0 H THR A 96 16.993 -0.745 2.535 1.00 0.00 H new ATOM 0 HA THR A 96 15.388 0.819 0.666 1.00 0.00 H new ATOM 0 HB THR A 96 17.771 0.806 0.228 1.00 0.00 H new ATOM 0 HG1 THR A 96 17.589 0.101 -2.012 1.00 0.00 H new ATOM 0 HG21 THR A 96 18.924 -1.206 -0.613 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.428 -1.366 1.088 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.498 -2.183 -0.190 1.00 0.00 H new ATOM 1135 N ARG A 97 15.239 -2.470 0.928 1.00 0.00 N ATOM 1136 CA ARG A 97 14.380 -3.593 0.551 1.00 0.00 C ATOM 1137 C ARG A 97 13.131 -3.638 1.415 1.00 0.00 C ATOM 1138 O ARG A 97 12.028 -3.881 0.920 1.00 0.00 O ATOM 1139 CB ARG A 97 15.132 -4.926 0.608 1.00 0.00 C ATOM 1140 CG ARG A 97 15.670 -5.278 1.971 1.00 0.00 C ATOM 1141 CD ARG A 97 16.314 -6.616 1.972 1.00 0.00 C ATOM 1142 NE ARG A 97 17.457 -6.660 1.080 1.00 0.00 N ATOM 1143 CZ ARG A 97 17.830 -7.729 0.423 1.00 0.00 C ATOM 1144 NH1 ARG A 97 17.290 -8.897 0.713 1.00 0.00 N ATOM 1145 NH2 ARG A 97 18.782 -7.654 -0.483 1.00 0.00 N ATOM 0 H ARG A 97 16.037 -2.713 1.516 1.00 0.00 H new ATOM 0 HA ARG A 97 14.073 -3.434 -0.483 1.00 0.00 H new ATOM 0 HB2 ARG A 97 14.463 -5.721 0.278 1.00 0.00 H new ATOM 0 HB3 ARG A 97 15.961 -4.892 -0.099 1.00 0.00 H new ATOM 0 HG2 ARG A 97 16.393 -4.525 2.284 1.00 0.00 H new ATOM 0 HG3 ARG A 97 14.859 -5.263 2.699 1.00 0.00 H new ATOM 0 HD2 ARG A 97 16.632 -6.866 2.984 1.00 0.00 H new ATOM 0 HD3 ARG A 97 15.587 -7.370 1.670 1.00 0.00 H new ATOM 0 HE ARG A 97 18.003 -5.807 0.957 1.00 0.00 H new ATOM 0 HH11 ARG A 97 16.585 -8.965 1.447 1.00 0.00 H new ATOM 0 HH12 ARG A 97 17.578 -9.732 0.204 1.00 0.00 H new ATOM 0 HH21 ARG A 97 19.233 -6.760 -0.676 1.00 0.00 H new ATOM 0 HH22 ARG A 97 19.069 -8.490 -0.992 1.00 0.00 H new ATOM 1159 N GLU A 98 13.319 -3.348 2.686 1.00 0.00 N ATOM 1160 CA GLU A 98 12.277 -3.350 3.689 1.00 0.00 C ATOM 1161 C GLU A 98 11.257 -2.312 3.327 1.00 0.00 C ATOM 1162 O GLU A 98 10.049 -2.573 3.258 1.00 0.00 O ATOM 1163 CB GLU A 98 12.867 -2.967 5.065 1.00 0.00 C ATOM 1164 CG GLU A 98 13.963 -3.892 5.633 1.00 0.00 C ATOM 1165 CD GLU A 98 15.302 -3.814 4.892 1.00 0.00 C ATOM 1166 OE1 GLU A 98 15.509 -2.889 4.078 1.00 0.00 O ATOM 1167 OE2 GLU A 98 16.177 -4.675 5.111 1.00 0.00 O ATOM 0 H GLU A 98 14.234 -3.096 3.061 1.00 0.00 H new ATOM 0 HA GLU A 98 11.831 -4.344 3.736 1.00 0.00 H new ATOM 0 HB2 GLU A 98 13.277 -1.960 4.990 1.00 0.00 H new ATOM 0 HB3 GLU A 98 12.050 -2.926 5.785 1.00 0.00 H new ATOM 0 HG2 GLU A 98 14.126 -3.641 6.681 1.00 0.00 H new ATOM 0 HG3 GLU A 98 13.604 -4.921 5.604 1.00 0.00 H new ATOM 1174 N PHE A 99 11.773 -1.143 3.057 1.00 0.00 N ATOM 1175 CA PHE A 99 10.990 0.005 2.743 1.00 0.00 C ATOM 1176 C PHE A 99 10.292 -0.180 1.421 1.00 0.00 C ATOM 1177 O PHE A 99 9.151 0.196 1.286 1.00 0.00 O ATOM 1178 CB PHE A 99 11.881 1.221 2.704 1.00 0.00 C ATOM 1179 CG PHE A 99 11.170 2.519 2.565 1.00 0.00 C ATOM 1180 CD1 PHE A 99 10.661 3.140 3.680 1.00 0.00 C ATOM 1181 CD2 PHE A 99 11.037 3.134 1.330 1.00 0.00 C ATOM 1182 CE1 PHE A 99 10.028 4.362 3.578 1.00 0.00 C ATOM 1183 CE2 PHE A 99 10.403 4.348 1.215 1.00 0.00 C ATOM 1184 CZ PHE A 99 9.899 4.965 2.339 1.00 0.00 C ATOM 0 H PHE A 99 12.778 -0.966 3.051 1.00 0.00 H new ATOM 0 HA PHE A 99 10.229 0.142 3.511 1.00 0.00 H new ATOM 0 HB2 PHE A 99 12.476 1.246 3.617 1.00 0.00 H new ATOM 0 HB3 PHE A 99 12.578 1.115 1.873 1.00 0.00 H new ATOM 0 HD1 PHE A 99 10.757 2.667 4.646 1.00 0.00 H new ATOM 0 HD2 PHE A 99 11.436 2.654 0.449 1.00 0.00 H new ATOM 0 HE1 PHE A 99 9.635 4.845 4.460 1.00 0.00 H new ATOM 0 HE2 PHE A 99 10.300 4.816 0.247 1.00 0.00 H new ATOM 0 HZ PHE A 99 9.403 5.920 2.253 1.00 0.00 H new ATOM 1194 N ARG A 100 10.974 -0.791 0.460 1.00 0.00 N ATOM 1195 CA ARG A 100 10.394 -1.027 -0.849 1.00 0.00 C ATOM 1196 C ARG A 100 9.155 -1.885 -0.731 1.00 0.00 C ATOM 1197 O ARG A 100 8.137 -1.577 -1.337 1.00 0.00 O ATOM 1198 CB ARG A 100 11.403 -1.684 -1.790 1.00 0.00 C ATOM 1199 CG ARG A 100 10.843 -2.052 -3.160 1.00 0.00 C ATOM 1200 CD ARG A 100 11.917 -2.650 -4.042 1.00 0.00 C ATOM 1201 NE ARG A 100 12.544 -3.832 -3.432 1.00 0.00 N ATOM 1202 CZ ARG A 100 13.866 -4.052 -3.387 1.00 0.00 C ATOM 1203 NH1 ARG A 100 14.720 -3.129 -3.826 1.00 0.00 N ATOM 1204 NH2 ARG A 100 14.328 -5.178 -2.861 1.00 0.00 N ATOM 0 H ARG A 100 11.930 -1.131 0.566 1.00 0.00 H new ATOM 0 HA ARG A 100 10.116 -0.061 -1.271 1.00 0.00 H new ATOM 0 HB2 ARG A 100 12.247 -1.008 -1.926 1.00 0.00 H new ATOM 0 HB3 ARG A 100 11.790 -2.586 -1.315 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.025 -2.763 -3.043 1.00 0.00 H new ATOM 0 HG3 ARG A 100 10.428 -1.164 -3.637 1.00 0.00 H new ATOM 0 HD2 ARG A 100 11.483 -2.927 -5.003 1.00 0.00 H new ATOM 0 HD3 ARG A 100 12.681 -1.898 -4.242 1.00 0.00 H new ATOM 0 HE ARG A 100 11.931 -4.533 -3.015 1.00 0.00 H new ATOM 0 HH11 ARG A 100 14.370 -2.247 -4.200 1.00 0.00 H new ATOM 0 HH12 ARG A 100 15.724 -3.304 -3.788 1.00 0.00 H new ATOM 0 HH21 ARG A 100 13.679 -5.873 -2.493 1.00 0.00 H new ATOM 0 HH22 ARG A 100 15.333 -5.349 -2.825 1.00 0.00 H new ATOM 1218 N THR A 101 9.228 -2.932 0.065 1.00 0.00 N ATOM 1219 CA THR A 101 8.094 -3.776 0.247 1.00 0.00 C ATOM 1220 C THR A 101 6.993 -3.039 1.026 1.00 0.00 C ATOM 1221 O THR A 101 5.863 -2.958 0.563 1.00 0.00 O ATOM 1222 CB THR A 101 8.473 -5.074 0.982 1.00 0.00 C ATOM 1223 OG1 THR A 101 9.636 -5.648 0.360 1.00 0.00 O ATOM 1224 CG2 THR A 101 7.319 -6.071 0.907 1.00 0.00 C ATOM 0 H THR A 101 10.060 -3.207 0.587 1.00 0.00 H new ATOM 0 HA THR A 101 7.718 -4.039 -0.742 1.00 0.00 H new ATOM 0 HB THR A 101 8.684 -4.847 2.027 1.00 0.00 H new ATOM 0 HG1 THR A 101 10.428 -5.124 0.602 1.00 0.00 H new ATOM 0 HG21 THR A 101 7.595 -6.987 1.429 1.00 0.00 H new ATOM 0 HG22 THR A 101 6.434 -5.639 1.375 1.00 0.00 H new ATOM 0 HG23 THR A 101 7.103 -6.300 -0.137 1.00 0.00 H new ATOM 1232 N ARG A 102 7.355 -2.435 2.160 1.00 0.00 N ATOM 1233 CA ARG A 102 6.371 -1.788 3.028 1.00 0.00 C ATOM 1234 C ARG A 102 5.713 -0.581 2.362 1.00 0.00 C ATOM 1235 O ARG A 102 4.506 -0.403 2.464 1.00 0.00 O ATOM 1236 CB ARG A 102 6.960 -1.435 4.404 1.00 0.00 C ATOM 1237 CG ARG A 102 7.465 -2.654 5.178 1.00 0.00 C ATOM 1238 CD ARG A 102 7.945 -2.304 6.586 1.00 0.00 C ATOM 1239 NE ARG A 102 9.000 -1.277 6.598 1.00 0.00 N ATOM 1240 CZ ARG A 102 10.136 -1.330 7.319 1.00 0.00 C ATOM 1241 NH1 ARG A 102 10.503 -2.461 7.933 1.00 0.00 N ATOM 1242 NH2 ARG A 102 10.926 -0.256 7.389 1.00 0.00 N ATOM 0 H ARG A 102 8.316 -2.381 2.496 1.00 0.00 H new ATOM 0 HA ARG A 102 5.580 -2.519 3.198 1.00 0.00 H new ATOM 0 HB2 ARG A 102 7.783 -0.732 4.270 1.00 0.00 H new ATOM 0 HB3 ARG A 102 6.200 -0.926 4.997 1.00 0.00 H new ATOM 0 HG2 ARG A 102 6.666 -3.393 5.244 1.00 0.00 H new ATOM 0 HG3 ARG A 102 8.282 -3.117 4.625 1.00 0.00 H new ATOM 0 HD2 ARG A 102 7.098 -1.953 7.175 1.00 0.00 H new ATOM 0 HD3 ARG A 102 8.319 -3.206 7.071 1.00 0.00 H new ATOM 0 HE ARG A 102 8.858 -0.456 6.010 1.00 0.00 H new ATOM 0 HH11 ARG A 102 9.920 -3.295 7.857 1.00 0.00 H new ATOM 0 HH12 ARG A 102 11.366 -2.489 8.476 1.00 0.00 H new ATOM 0 HH21 ARG A 102 10.668 0.600 6.898 1.00 0.00 H new ATOM 0 HH22 ARG A 102 11.788 -0.291 7.934 1.00 0.00 H new ATOM 1256 N LYS A 103 6.494 0.220 1.663 1.00 0.00 N ATOM 1257 CA LYS A 103 5.971 1.371 0.947 1.00 0.00 C ATOM 1258 C LYS A 103 5.050 0.927 -0.181 1.00 0.00 C ATOM 1259 O LYS A 103 4.006 1.540 -0.419 1.00 0.00 O ATOM 1260 CB LYS A 103 7.095 2.280 0.408 1.00 0.00 C ATOM 1261 CG LYS A 103 6.597 3.542 -0.308 1.00 0.00 C ATOM 1262 CD LYS A 103 5.713 4.400 0.599 1.00 0.00 C ATOM 1263 CE LYS A 103 6.467 4.956 1.796 1.00 0.00 C ATOM 1264 NZ LYS A 103 5.564 5.611 2.755 1.00 0.00 N ATOM 0 H LYS A 103 7.502 0.094 1.575 1.00 0.00 H new ATOM 0 HA LYS A 103 5.394 1.961 1.660 1.00 0.00 H new ATOM 0 HB2 LYS A 103 7.736 2.576 1.238 1.00 0.00 H new ATOM 0 HB3 LYS A 103 7.712 1.705 -0.282 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.451 4.130 -0.644 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.036 3.257 -1.198 1.00 0.00 H new ATOM 0 HD2 LYS A 103 5.299 5.225 0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 103 4.872 3.803 0.950 1.00 0.00 H new ATOM 0 HE2 LYS A 103 7.003 4.149 2.295 1.00 0.00 H new ATOM 0 HE3 LYS A 103 7.215 5.671 1.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 6.119 6.007 3.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 5.046 6.376 2.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 4.887 4.914 3.126 1.00 0.00 H new ATOM 1278 N LYS A 104 5.434 -0.154 -0.862 1.00 0.00 N ATOM 1279 CA LYS A 104 4.646 -0.688 -1.968 1.00 0.00 C ATOM 1280 C LYS A 104 3.268 -1.082 -1.432 1.00 0.00 C ATOM 1281 O LYS A 104 2.248 -0.808 -2.048 1.00 0.00 O ATOM 1282 CB LYS A 104 5.369 -1.908 -2.595 1.00 0.00 C ATOM 1283 CG LYS A 104 5.107 -2.121 -4.094 1.00 0.00 C ATOM 1284 CD LYS A 104 3.660 -2.442 -4.425 1.00 0.00 C ATOM 1285 CE LYS A 104 3.442 -2.415 -5.922 1.00 0.00 C ATOM 1286 NZ LYS A 104 2.069 -2.764 -6.299 1.00 0.00 N ATOM 0 H LYS A 104 6.288 -0.676 -0.665 1.00 0.00 H new ATOM 0 HA LYS A 104 4.529 0.064 -2.748 1.00 0.00 H new ATOM 0 HB2 LYS A 104 6.442 -1.793 -2.442 1.00 0.00 H new ATOM 0 HB3 LYS A 104 5.065 -2.806 -2.058 1.00 0.00 H new ATOM 0 HG2 LYS A 104 5.403 -1.223 -4.636 1.00 0.00 H new ATOM 0 HG3 LYS A 104 5.740 -2.933 -4.452 1.00 0.00 H new ATOM 0 HD2 LYS A 104 3.400 -3.424 -4.031 1.00 0.00 H new ATOM 0 HD3 LYS A 104 3.001 -1.720 -3.942 1.00 0.00 H new ATOM 0 HE2 LYS A 104 3.677 -1.421 -6.302 1.00 0.00 H new ATOM 0 HE3 LYS A 104 4.133 -3.110 -6.399 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 1.987 -2.780 -7.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 1.832 -3.703 -5.918 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 1.412 -2.057 -5.911 1.00 0.00 H new ATOM 1300 N LEU A 105 3.268 -1.654 -0.241 1.00 0.00 N ATOM 1301 CA LEU A 105 2.052 -2.071 0.442 1.00 0.00 C ATOM 1302 C LEU A 105 1.187 -0.875 0.767 1.00 0.00 C ATOM 1303 O LEU A 105 -0.046 -0.919 0.632 1.00 0.00 O ATOM 1304 CB LEU A 105 2.396 -2.773 1.734 1.00 0.00 C ATOM 1305 CG LEU A 105 3.325 -3.950 1.637 1.00 0.00 C ATOM 1306 CD1 LEU A 105 3.563 -4.529 3.004 1.00 0.00 C ATOM 1307 CD2 LEU A 105 2.778 -4.977 0.679 1.00 0.00 C ATOM 0 H LEU A 105 4.120 -1.845 0.286 1.00 0.00 H new ATOM 0 HA LEU A 105 1.511 -2.746 -0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 105 2.842 -2.043 2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 105 1.468 -3.110 2.196 1.00 0.00 H new ATOM 0 HG LEU A 105 4.286 -3.619 1.242 1.00 0.00 H new ATOM 0 HD11 LEU A 105 4.237 -5.382 2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.010 -3.771 3.647 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.615 -4.855 3.431 1.00 0.00 H new ATOM 0 HD21 LEU A 105 3.464 -5.822 0.621 1.00 0.00 H new ATOM 0 HD22 LEU A 105 1.806 -5.322 1.031 1.00 0.00 H new ATOM 0 HD23 LEU A 105 2.668 -4.531 -0.309 1.00 0.00 H new ATOM 1319 N GLU A 106 1.828 0.195 1.200 1.00 0.00 N ATOM 1320 CA GLU A 106 1.126 1.407 1.516 1.00 0.00 C ATOM 1321 C GLU A 106 0.505 1.983 0.266 1.00 0.00 C ATOM 1322 O GLU A 106 -0.554 2.560 0.320 1.00 0.00 O ATOM 1323 CB GLU A 106 2.026 2.444 2.164 1.00 0.00 C ATOM 1324 CG GLU A 106 2.692 1.998 3.440 1.00 0.00 C ATOM 1325 CD GLU A 106 3.251 3.172 4.191 1.00 0.00 C ATOM 1326 OE1 GLU A 106 2.517 3.784 4.989 1.00 0.00 O ATOM 1327 OE2 GLU A 106 4.430 3.528 3.984 1.00 0.00 O ATOM 0 H GLU A 106 2.838 0.241 1.338 1.00 0.00 H new ATOM 0 HA GLU A 106 0.349 1.152 2.236 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.798 2.731 1.450 1.00 0.00 H new ATOM 0 HB3 GLU A 106 1.436 3.337 2.372 1.00 0.00 H new ATOM 0 HG2 GLU A 106 1.972 1.470 4.066 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.492 1.294 3.211 1.00 0.00 H new ATOM 1334 N GLU A 107 1.179 1.826 -0.851 1.00 0.00 N ATOM 1335 CA GLU A 107 0.673 2.278 -2.135 1.00 0.00 C ATOM 1336 C GLU A 107 -0.522 1.472 -2.604 1.00 0.00 C ATOM 1337 O GLU A 107 -1.432 2.029 -3.226 1.00 0.00 O ATOM 1338 CB GLU A 107 1.772 2.318 -3.177 1.00 0.00 C ATOM 1339 CG GLU A 107 2.632 3.576 -3.092 1.00 0.00 C ATOM 1340 CD GLU A 107 1.879 4.833 -3.534 1.00 0.00 C ATOM 1341 OE1 GLU A 107 0.951 5.304 -2.817 1.00 0.00 O ATOM 1342 OE2 GLU A 107 2.205 5.386 -4.605 1.00 0.00 O ATOM 0 H GLU A 107 2.096 1.381 -0.899 1.00 0.00 H new ATOM 0 HA GLU A 107 0.316 3.298 -1.994 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.409 1.441 -3.059 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.326 2.256 -4.170 1.00 0.00 H new ATOM 0 HG2 GLU A 107 2.979 3.706 -2.067 1.00 0.00 H new ATOM 0 HG3 GLU A 107 3.518 3.449 -3.715 1.00 0.00 H new ATOM 1349 N GLU A 108 -0.536 0.177 -2.298 1.00 0.00 N ATOM 1350 CA GLU A 108 -1.678 -0.673 -2.609 1.00 0.00 C ATOM 1351 C GLU A 108 -2.867 -0.159 -1.811 1.00 0.00 C ATOM 1352 O GLU A 108 -3.956 0.080 -2.350 1.00 0.00 O ATOM 1353 CB GLU A 108 -1.401 -2.118 -2.185 1.00 0.00 C ATOM 1354 CG GLU A 108 -0.125 -2.722 -2.731 1.00 0.00 C ATOM 1355 CD GLU A 108 -0.117 -2.913 -4.224 1.00 0.00 C ATOM 1356 OE1 GLU A 108 -0.057 -1.911 -4.971 1.00 0.00 O ATOM 1357 OE2 GLU A 108 -0.073 -4.070 -4.687 1.00 0.00 O ATOM 0 H GLU A 108 0.233 -0.306 -1.834 1.00 0.00 H new ATOM 0 HA GLU A 108 -1.871 -0.649 -3.681 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -1.365 -2.159 -1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -2.240 -2.738 -2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 108 0.713 -2.082 -2.454 1.00 0.00 H new ATOM 0 HG3 GLU A 108 0.039 -3.687 -2.252 1.00 0.00 H new ATOM 1364 N ARG A 109 -2.619 0.054 -0.520 1.00 0.00 N ATOM 1365 CA ARG A 109 -3.621 0.562 0.394 1.00 0.00 C ATOM 1366 C ARG A 109 -4.081 1.941 -0.040 1.00 0.00 C ATOM 1367 O ARG A 109 -5.261 2.211 -0.088 1.00 0.00 O ATOM 1368 CB ARG A 109 -3.044 0.659 1.804 1.00 0.00 C ATOM 1369 CG ARG A 109 -4.015 1.234 2.818 1.00 0.00 C ATOM 1370 CD ARG A 109 -3.351 1.489 4.150 1.00 0.00 C ATOM 1371 NE ARG A 109 -2.260 2.477 4.065 1.00 0.00 N ATOM 1372 CZ ARG A 109 -1.373 2.693 5.052 1.00 0.00 C ATOM 1373 NH1 ARG A 109 -1.528 2.093 6.228 1.00 0.00 N ATOM 1374 NH2 ARG A 109 -0.361 3.523 4.864 1.00 0.00 N ATOM 0 H ARG A 109 -1.714 -0.123 -0.085 1.00 0.00 H new ATOM 0 HA ARG A 109 -4.468 -0.125 0.387 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -2.736 -0.334 2.131 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -2.148 1.279 1.779 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -4.431 2.166 2.435 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -4.849 0.545 2.954 1.00 0.00 H new ATOM 0 HD2 ARG A 109 -4.098 1.840 4.862 1.00 0.00 H new ATOM 0 HD3 ARG A 109 -2.956 0.551 4.539 1.00 0.00 H new ATOM 0 HE ARG A 109 -2.173 3.027 3.210 1.00 0.00 H new ATOM 0 HH11 ARG A 109 -2.320 1.469 6.382 1.00 0.00 H new ATOM 0 HH12 ARG A 109 -0.855 2.257 6.977 1.00 0.00 H new ATOM 0 HH21 ARG A 109 -0.252 4.000 3.969 1.00 0.00 H new ATOM 0 HH22 ARG A 109 0.311 3.686 5.614 1.00 0.00 H new ATOM 1388 N HIS A 110 -3.126 2.782 -0.384 1.00 0.00 N ATOM 1389 CA HIS A 110 -3.362 4.158 -0.805 1.00 0.00 C ATOM 1390 C HIS A 110 -4.192 4.202 -2.066 1.00 0.00 C ATOM 1391 O HIS A 110 -5.048 5.069 -2.219 1.00 0.00 O ATOM 1392 CB HIS A 110 -2.048 4.921 -0.973 1.00 0.00 C ATOM 1393 CG HIS A 110 -2.213 6.376 -1.274 1.00 0.00 C ATOM 1394 ND1 HIS A 110 -1.353 7.102 -2.046 1.00 0.00 N ATOM 1395 CD2 HIS A 110 -3.157 7.237 -0.854 1.00 0.00 C ATOM 1396 CE1 HIS A 110 -1.789 8.362 -2.075 1.00 0.00 C ATOM 1397 NE2 HIS A 110 -2.893 8.498 -1.360 1.00 0.00 N ATOM 0 H HIS A 110 -2.139 2.526 -0.380 1.00 0.00 H new ATOM 0 HA HIS A 110 -3.928 4.656 -0.018 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -1.461 4.815 -0.060 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -1.474 4.459 -1.776 1.00 0.00 H new ATOM 0 HD1 HIS A 110 -0.523 6.744 -2.518 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -3.993 6.983 -0.219 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -1.305 9.165 -2.611 1.00 0.00 H new ATOM 1405 N ASN A 111 -3.937 3.267 -2.955 1.00 0.00 N ATOM 1406 CA ASN A 111 -4.686 3.156 -4.187 1.00 0.00 C ATOM 1407 C ASN A 111 -6.154 2.978 -3.850 1.00 0.00 C ATOM 1408 O ASN A 111 -7.023 3.636 -4.430 1.00 0.00 O ATOM 1409 CB ASN A 111 -4.173 1.954 -4.995 1.00 0.00 C ATOM 1410 CG ASN A 111 -4.985 1.663 -6.240 1.00 0.00 C ATOM 1411 OD1 ASN A 111 -4.716 2.195 -7.300 1.00 0.00 O ATOM 1412 ND2 ASN A 111 -5.947 0.787 -6.126 1.00 0.00 N ATOM 0 H ASN A 111 -3.206 2.564 -2.844 1.00 0.00 H new ATOM 0 HA ASN A 111 -4.559 4.057 -4.787 1.00 0.00 H new ATOM 0 HB2 ASN A 111 -3.138 2.137 -5.282 1.00 0.00 H new ATOM 0 HB3 ASN A 111 -4.176 1.071 -4.356 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -6.501 0.529 -6.943 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -6.144 0.361 -5.220 1.00 0.00 H new ATOM 1419 N LEU A 112 -6.410 2.133 -2.870 1.00 0.00 N ATOM 1420 CA LEU A 112 -7.749 1.908 -2.390 1.00 0.00 C ATOM 1421 C LEU A 112 -8.261 3.117 -1.597 1.00 0.00 C ATOM 1422 O LEU A 112 -9.414 3.470 -1.710 1.00 0.00 O ATOM 1423 CB LEU A 112 -7.822 0.651 -1.538 1.00 0.00 C ATOM 1424 CG LEU A 112 -7.364 -0.655 -2.187 1.00 0.00 C ATOM 1425 CD1 LEU A 112 -7.597 -1.810 -1.241 1.00 0.00 C ATOM 1426 CD2 LEU A 112 -8.071 -0.898 -3.512 1.00 0.00 C ATOM 0 H LEU A 112 -5.695 1.588 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.390 1.770 -3.261 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -7.222 0.813 -0.643 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -8.854 0.523 -1.211 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.297 -0.574 -2.396 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.268 -2.737 -1.711 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -7.032 -1.648 -0.323 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.659 -1.879 -1.006 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.721 -1.835 -3.945 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -9.147 -0.955 -3.345 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.853 -0.078 -4.197 1.00 0.00 H new ATOM 1438 N ILE A 113 -7.382 3.746 -0.793 1.00 0.00 N ATOM 1439 CA ILE A 113 -7.756 4.935 -0.001 1.00 0.00 C ATOM 1440 C ILE A 113 -8.275 6.039 -0.904 1.00 0.00 C ATOM 1441 O ILE A 113 -9.366 6.542 -0.694 1.00 0.00 O ATOM 1442 CB ILE A 113 -6.564 5.519 0.826 1.00 0.00 C ATOM 1443 CG1 ILE A 113 -6.008 4.500 1.831 1.00 0.00 C ATOM 1444 CG2 ILE A 113 -7.007 6.783 1.560 1.00 0.00 C ATOM 1445 CD1 ILE A 113 -6.996 4.045 2.878 1.00 0.00 C ATOM 0 H ILE A 113 -6.412 3.453 -0.675 1.00 0.00 H new ATOM 0 HA ILE A 113 -8.528 4.596 0.690 1.00 0.00 H new ATOM 0 HB ILE A 113 -5.766 5.761 0.125 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -5.651 3.627 1.284 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -5.144 4.937 2.331 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -6.171 7.183 2.133 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -7.339 7.527 0.836 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -7.828 6.543 2.236 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -6.516 3.327 3.543 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -7.336 4.905 3.456 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -7.850 3.574 2.392 1.00 0.00 H new ATOM 1457 N THR A 114 -7.521 6.351 -1.944 1.00 0.00 N ATOM 1458 CA THR A 114 -7.893 7.391 -2.881 1.00 0.00 C ATOM 1459 C THR A 114 -9.219 7.050 -3.563 1.00 0.00 C ATOM 1460 O THR A 114 -10.089 7.911 -3.736 1.00 0.00 O ATOM 1461 CB THR A 114 -6.769 7.592 -3.926 1.00 0.00 C ATOM 1462 OG1 THR A 114 -5.560 7.980 -3.247 1.00 0.00 O ATOM 1463 CG2 THR A 114 -7.130 8.650 -4.962 1.00 0.00 C ATOM 0 H THR A 114 -6.637 5.891 -2.160 1.00 0.00 H new ATOM 0 HA THR A 114 -8.027 8.325 -2.335 1.00 0.00 H new ATOM 0 HB THR A 114 -6.629 6.649 -4.454 1.00 0.00 H new ATOM 0 HG1 THR A 114 -5.176 7.201 -2.792 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.312 8.756 -5.674 1.00 0.00 H new ATOM 0 HG22 THR A 114 -8.034 8.348 -5.491 1.00 0.00 H new ATOM 0 HG23 THR A 114 -7.303 9.604 -4.463 1.00 0.00 H new ATOM 1471 N GLU A 115 -9.384 5.786 -3.879 1.00 0.00 N ATOM 1472 CA GLU A 115 -10.578 5.316 -4.514 1.00 0.00 C ATOM 1473 C GLU A 115 -11.763 5.418 -3.540 1.00 0.00 C ATOM 1474 O GLU A 115 -12.780 6.018 -3.861 1.00 0.00 O ATOM 1475 CB GLU A 115 -10.364 3.882 -5.009 1.00 0.00 C ATOM 1476 CG GLU A 115 -11.516 3.301 -5.802 1.00 0.00 C ATOM 1477 CD GLU A 115 -11.185 1.946 -6.373 1.00 0.00 C ATOM 1478 OE1 GLU A 115 -11.426 0.941 -5.721 1.00 0.00 O ATOM 1479 OE2 GLU A 115 -10.665 1.877 -7.520 1.00 0.00 O ATOM 0 H GLU A 115 -8.690 5.060 -3.700 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.811 5.937 -5.379 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -9.467 3.857 -5.628 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.175 3.241 -4.148 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.393 3.219 -5.160 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -11.777 3.981 -6.612 1.00 0.00 H new ATOM 1486 N MET A 116 -11.586 4.909 -2.329 1.00 0.00 N ATOM 1487 CA MET A 116 -12.646 4.895 -1.335 1.00 0.00 C ATOM 1488 C MET A 116 -13.024 6.298 -0.879 1.00 0.00 C ATOM 1489 O MET A 116 -14.189 6.569 -0.663 1.00 0.00 O ATOM 1490 CB MET A 116 -12.309 4.004 -0.139 1.00 0.00 C ATOM 1491 CG MET A 116 -13.493 3.794 0.801 1.00 0.00 C ATOM 1492 SD MET A 116 -13.148 2.645 2.143 1.00 0.00 S ATOM 1493 CE MET A 116 -14.727 2.664 3.000 1.00 0.00 C ATOM 0 H MET A 116 -10.709 4.497 -2.011 1.00 0.00 H new ATOM 0 HA MET A 116 -13.517 4.463 -1.828 1.00 0.00 H new ATOM 0 HB2 MET A 116 -11.963 3.036 -0.501 1.00 0.00 H new ATOM 0 HB3 MET A 116 -11.485 4.449 0.418 1.00 0.00 H new ATOM 0 HG2 MET A 116 -13.787 4.755 1.223 1.00 0.00 H new ATOM 0 HG3 MET A 116 -14.342 3.425 0.226 1.00 0.00 H new ATOM 0 HE1 MET A 116 -14.605 2.240 3.997 1.00 0.00 H new ATOM 0 HE2 MET A 116 -15.083 3.691 3.083 1.00 0.00 H new ATOM 0 HE3 MET A 116 -15.452 2.073 2.440 1.00 0.00 H new ATOM 1503 N VAL A 117 -12.045 7.188 -0.754 1.00 0.00 N ATOM 1504 CA VAL A 117 -12.313 8.576 -0.393 1.00 0.00 C ATOM 1505 C VAL A 117 -13.117 9.262 -1.512 1.00 0.00 C ATOM 1506 O VAL A 117 -14.019 10.057 -1.252 1.00 0.00 O ATOM 1507 CB VAL A 117 -10.993 9.367 -0.083 1.00 0.00 C ATOM 1508 CG1 VAL A 117 -11.260 10.843 0.098 1.00 0.00 C ATOM 1509 CG2 VAL A 117 -10.338 8.842 1.178 1.00 0.00 C ATOM 0 H VAL A 117 -11.058 6.973 -0.897 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.905 8.578 0.522 1.00 0.00 H new ATOM 0 HB VAL A 117 -10.331 9.224 -0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -10.324 11.359 0.311 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -11.698 11.248 -0.814 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -11.951 10.989 0.928 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -9.425 9.404 1.375 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.023 8.956 2.018 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -10.094 7.787 1.050 1.00 0.00 H new ATOM 1519 N ALA A 118 -12.811 8.919 -2.752 1.00 0.00 N ATOM 1520 CA ALA A 118 -13.537 9.460 -3.889 1.00 0.00 C ATOM 1521 C ALA A 118 -14.968 8.921 -3.910 1.00 0.00 C ATOM 1522 O ALA A 118 -15.923 9.655 -4.181 1.00 0.00 O ATOM 1523 CB ALA A 118 -12.823 9.122 -5.188 1.00 0.00 C ATOM 0 H ALA A 118 -12.065 8.268 -2.997 1.00 0.00 H new ATOM 0 HA ALA A 118 -13.575 10.545 -3.791 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -13.381 9.535 -6.028 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -11.820 9.549 -5.174 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -12.755 8.039 -5.295 1.00 0.00 H new ATOM 1529 N LEU A 119 -15.107 7.649 -3.608 1.00 0.00 N ATOM 1530 CA LEU A 119 -16.405 6.987 -3.581 1.00 0.00 C ATOM 1531 C LEU A 119 -17.233 7.454 -2.381 1.00 0.00 C ATOM 1532 O LEU A 119 -18.442 7.666 -2.492 1.00 0.00 O ATOM 1533 CB LEU A 119 -16.214 5.470 -3.523 1.00 0.00 C ATOM 1534 CG LEU A 119 -15.385 4.849 -4.654 1.00 0.00 C ATOM 1535 CD1 LEU A 119 -15.129 3.391 -4.378 1.00 0.00 C ATOM 1536 CD2 LEU A 119 -16.060 5.023 -6.007 1.00 0.00 C ATOM 0 H LEU A 119 -14.325 7.038 -3.373 1.00 0.00 H new ATOM 0 HA LEU A 119 -16.943 7.250 -4.492 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -15.740 5.220 -2.574 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -17.198 5.000 -3.521 1.00 0.00 H new ATOM 0 HG LEU A 119 -14.431 5.375 -4.691 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -14.540 2.965 -5.190 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -14.583 3.289 -3.440 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -16.079 2.862 -4.304 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -15.442 4.570 -6.783 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -17.036 4.539 -5.992 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -16.185 6.085 -6.217 1.00 0.00 H new ATOM 1548 N ASN A 120 -16.589 7.606 -1.248 1.00 0.00 N ATOM 1549 CA ASN A 120 -17.246 8.050 -0.030 1.00 0.00 C ATOM 1550 C ASN A 120 -16.424 9.134 0.641 1.00 0.00 C ATOM 1551 O ASN A 120 -15.353 8.864 1.171 1.00 0.00 O ATOM 1552 CB ASN A 120 -17.448 6.891 0.954 1.00 0.00 C ATOM 1553 CG ASN A 120 -18.159 7.310 2.234 1.00 0.00 C ATOM 1554 OD1 ASN A 120 -18.936 8.266 2.256 1.00 0.00 O ATOM 1555 ND2 ASN A 120 -17.932 6.580 3.291 1.00 0.00 N ATOM 0 H ASN A 120 -15.591 7.426 -1.139 1.00 0.00 H new ATOM 0 HA ASN A 120 -18.224 8.443 -0.309 1.00 0.00 H new ATOM 0 HB2 ASN A 120 -18.024 6.105 0.466 1.00 0.00 H new ATOM 0 HB3 ASN A 120 -16.478 6.464 1.208 1.00 0.00 H new ATOM 0 HD21 ASN A 120 -18.404 6.794 4.170 1.00 0.00 H new ATOM 0 HD22 ASN A 120 -17.283 5.795 3.239 1.00 0.00 H new ATOM 1562 N PRO A 121 -16.927 10.367 0.651 1.00 0.00 N ATOM 1563 CA PRO A 121 -16.217 11.516 1.243 1.00 0.00 C ATOM 1564 C PRO A 121 -16.126 11.420 2.775 1.00 0.00 C ATOM 1565 O PRO A 121 -15.232 11.990 3.400 1.00 0.00 O ATOM 1566 CB PRO A 121 -17.103 12.701 0.842 1.00 0.00 C ATOM 1567 CG PRO A 121 -18.456 12.103 0.691 1.00 0.00 C ATOM 1568 CD PRO A 121 -18.231 10.765 0.088 1.00 0.00 C ATOM 0 HA PRO A 121 -15.185 11.587 0.899 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -17.094 13.482 1.603 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -16.762 13.158 -0.087 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -18.959 12.020 1.655 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -19.089 12.720 0.053 1.00 0.00 H new ATOM 0 HD2 PRO A 121 -19.019 10.062 0.358 1.00 0.00 H new ATOM 0 HD3 PRO A 121 -18.204 10.811 -1.001 1.00 0.00 H new ATOM 1576 N ASP A 122 -17.030 10.654 3.362 1.00 0.00 N ATOM 1577 CA ASP A 122 -17.120 10.516 4.817 1.00 0.00 C ATOM 1578 C ASP A 122 -16.203 9.394 5.318 1.00 0.00 C ATOM 1579 O ASP A 122 -16.085 9.152 6.516 1.00 0.00 O ATOM 1580 CB ASP A 122 -18.584 10.248 5.223 1.00 0.00 C ATOM 1581 CG ASP A 122 -18.818 10.159 6.727 1.00 0.00 C ATOM 1582 OD1 ASP A 122 -19.003 11.210 7.379 1.00 0.00 O ATOM 1583 OD2 ASP A 122 -18.853 9.036 7.276 1.00 0.00 O ATOM 0 H ASP A 122 -17.724 10.109 2.850 1.00 0.00 H new ATOM 0 HA ASP A 122 -16.788 11.446 5.280 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -19.211 11.042 4.817 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -18.911 9.316 4.762 1.00 0.00 H new ATOM 1588 N PHE A 123 -15.506 8.762 4.401 1.00 0.00 N ATOM 1589 CA PHE A 123 -14.634 7.652 4.727 1.00 0.00 C ATOM 1590 C PHE A 123 -13.458 8.100 5.611 1.00 0.00 C ATOM 1591 O PHE A 123 -12.845 9.148 5.366 1.00 0.00 O ATOM 1592 CB PHE A 123 -14.131 6.980 3.426 1.00 0.00 C ATOM 1593 CG PHE A 123 -12.914 6.121 3.595 1.00 0.00 C ATOM 1594 CD1 PHE A 123 -12.841 5.160 4.579 1.00 0.00 C ATOM 1595 CD2 PHE A 123 -11.833 6.312 2.782 1.00 0.00 C ATOM 1596 CE1 PHE A 123 -11.713 4.414 4.745 1.00 0.00 C ATOM 1597 CE2 PHE A 123 -10.697 5.570 2.924 1.00 0.00 C ATOM 1598 CZ PHE A 123 -10.625 4.611 3.914 1.00 0.00 C ATOM 0 H PHE A 123 -15.526 9.001 3.410 1.00 0.00 H new ATOM 0 HA PHE A 123 -15.205 6.922 5.301 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -14.935 6.370 3.014 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.912 7.757 2.693 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -13.689 4.996 5.227 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -11.879 7.066 2.010 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -11.668 3.669 5.525 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.857 5.732 2.264 1.00 0.00 H new ATOM 0 HZ PHE A 123 -9.729 4.021 4.038 1.00 0.00 H new ATOM 1608 N LYS A 124 -13.187 7.321 6.658 1.00 0.00 N ATOM 1609 CA LYS A 124 -12.083 7.584 7.551 1.00 0.00 C ATOM 1610 C LYS A 124 -10.955 6.618 7.295 1.00 0.00 C ATOM 1611 O LYS A 124 -11.074 5.429 7.593 1.00 0.00 O ATOM 1612 CB LYS A 124 -12.499 7.482 9.012 1.00 0.00 C ATOM 1613 CG LYS A 124 -13.655 8.372 9.379 1.00 0.00 C ATOM 1614 CD LYS A 124 -13.444 9.743 8.809 1.00 0.00 C ATOM 1615 CE LYS A 124 -14.494 10.727 9.284 1.00 0.00 C ATOM 1616 NZ LYS A 124 -15.871 10.282 8.969 1.00 0.00 N ATOM 0 H LYS A 124 -13.732 6.494 6.902 1.00 0.00 H new ATOM 0 HA LYS A 124 -11.752 8.604 7.355 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -12.764 6.448 9.233 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -11.645 7.733 9.641 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -14.585 7.950 8.999 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -13.751 8.430 10.463 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -12.455 10.104 9.092 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -13.464 9.689 7.721 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -14.397 10.865 10.361 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -14.314 11.697 8.821 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -16.517 11.096 9.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -15.893 9.871 8.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -16.171 9.566 9.661 1.00 0.00 H new ATOM 1630 N PRO A 125 -9.859 7.099 6.723 1.00 0.00 N ATOM 1631 CA PRO A 125 -8.696 6.271 6.450 1.00 0.00 C ATOM 1632 C PRO A 125 -8.000 5.825 7.753 1.00 0.00 C ATOM 1633 O PRO A 125 -8.188 6.455 8.800 1.00 0.00 O ATOM 1634 CB PRO A 125 -7.771 7.190 5.638 1.00 0.00 C ATOM 1635 CG PRO A 125 -8.567 8.406 5.306 1.00 0.00 C ATOM 1636 CD PRO A 125 -9.663 8.491 6.305 1.00 0.00 C ATOM 0 HA PRO A 125 -8.960 5.353 5.924 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -6.883 7.453 6.213 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -7.428 6.692 4.731 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -7.942 9.298 5.342 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -8.970 8.340 4.295 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -9.390 9.127 7.147 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -10.570 8.910 5.870 1.00 0.00 H new ATOM 1644 N PRO A 126 -7.215 4.717 7.709 1.00 0.00 N ATOM 1645 CA PRO A 126 -6.459 4.207 8.871 1.00 0.00 C ATOM 1646 C PRO A 126 -5.527 5.272 9.463 1.00 0.00 C ATOM 1647 O PRO A 126 -5.075 6.189 8.755 1.00 0.00 O ATOM 1648 CB PRO A 126 -5.648 3.043 8.286 1.00 0.00 C ATOM 1649 CG PRO A 126 -5.662 3.283 6.830 1.00 0.00 C ATOM 1650 CD PRO A 126 -7.005 3.866 6.543 1.00 0.00 C ATOM 0 HA PRO A 126 -7.114 3.912 9.691 1.00 0.00 H new ATOM 0 HB2 PRO A 126 -4.631 3.031 8.677 1.00 0.00 H new ATOM 0 HB3 PRO A 126 -6.097 2.081 8.535 1.00 0.00 H new ATOM 0 HG2 PRO A 126 -4.865 3.966 6.536 1.00 0.00 H new ATOM 0 HG3 PRO A 126 -5.508 2.357 6.277 1.00 0.00 H new ATOM 0 HD2 PRO A 126 -7.013 4.436 5.614 1.00 0.00 H new ATOM 0 HD3 PRO A 126 -7.774 3.098 6.453 1.00 0.00 H new ATOM 1658 N ALA A 127 -5.218 5.134 10.728 1.00 0.00 N ATOM 1659 CA ALA A 127 -4.472 6.144 11.455 1.00 0.00 C ATOM 1660 C ALA A 127 -3.020 6.292 11.004 1.00 0.00 C ATOM 1661 O ALA A 127 -2.464 7.390 11.053 1.00 0.00 O ATOM 1662 CB ALA A 127 -4.559 5.907 12.943 1.00 0.00 C ATOM 0 H ALA A 127 -5.474 4.320 11.287 1.00 0.00 H new ATOM 0 HA ALA A 127 -4.948 7.095 11.217 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -3.992 6.676 13.468 1.00 0.00 H new ATOM 0 HB2 ALA A 127 -5.602 5.947 13.257 1.00 0.00 H new ATOM 0 HB3 ALA A 127 -4.146 4.927 13.180 1.00 0.00 H new ATOM 1668 N ASP A 128 -2.404 5.221 10.527 1.00 0.00 N ATOM 1669 CA ASP A 128 -0.997 5.330 10.108 1.00 0.00 C ATOM 1670 C ASP A 128 -0.916 5.909 8.707 1.00 0.00 C ATOM 1671 O ASP A 128 0.134 6.357 8.263 1.00 0.00 O ATOM 1672 CB ASP A 128 -0.211 3.999 10.208 1.00 0.00 C ATOM 1673 CG ASP A 128 -0.564 2.972 9.156 1.00 0.00 C ATOM 1674 OD1 ASP A 128 -1.515 2.189 9.359 1.00 0.00 O ATOM 1675 OD2 ASP A 128 0.134 2.903 8.115 1.00 0.00 O ATOM 0 H ASP A 128 -2.826 4.299 10.419 1.00 0.00 H new ATOM 0 HA ASP A 128 -0.513 6.007 10.812 1.00 0.00 H new ATOM 0 HB2 ASP A 128 0.855 4.217 10.139 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -0.385 3.564 11.192 1.00 0.00 H new ATOM 1680 N TYR A 129 -2.052 5.955 8.045 1.00 0.00 N ATOM 1681 CA TYR A 129 -2.150 6.551 6.745 1.00 0.00 C ATOM 1682 C TYR A 129 -2.175 8.056 6.877 1.00 0.00 C ATOM 1683 O TYR A 129 -2.759 8.599 7.815 1.00 0.00 O ATOM 1684 CB TYR A 129 -3.420 6.078 6.001 1.00 0.00 C ATOM 1685 CG TYR A 129 -3.735 6.894 4.753 1.00 0.00 C ATOM 1686 CD1 TYR A 129 -3.153 6.600 3.546 1.00 0.00 C ATOM 1687 CD2 TYR A 129 -4.596 7.990 4.812 1.00 0.00 C ATOM 1688 CE1 TYR A 129 -3.412 7.366 2.430 1.00 0.00 C ATOM 1689 CE2 TYR A 129 -4.864 8.752 3.703 1.00 0.00 C ATOM 1690 CZ TYR A 129 -4.270 8.443 2.516 1.00 0.00 C ATOM 1691 OH TYR A 129 -4.531 9.219 1.403 1.00 0.00 O ATOM 0 H TYR A 129 -2.931 5.578 8.400 1.00 0.00 H new ATOM 0 HA TYR A 129 -1.280 6.241 6.165 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -3.298 5.032 5.720 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -4.270 6.128 6.682 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -2.483 5.757 3.469 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -5.062 8.245 5.752 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -2.943 7.123 1.488 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -5.541 9.591 3.770 1.00 0.00 H new ATOM 0 HH TYR A 129 -5.157 9.934 1.642 1.00 0.00 H new ATOM 1701 N LYS A 130 -1.504 8.707 5.976 1.00 0.00 N ATOM 1702 CA LYS A 130 -1.540 10.123 5.860 1.00 0.00 C ATOM 1703 C LYS A 130 -1.793 10.452 4.403 1.00 0.00 C ATOM 1704 O LYS A 130 -1.243 9.778 3.525 1.00 0.00 O ATOM 1705 CB LYS A 130 -0.215 10.701 6.258 1.00 0.00 C ATOM 1706 CG LYS A 130 0.213 10.386 7.682 1.00 0.00 C ATOM 1707 CD LYS A 130 -0.715 11.025 8.711 1.00 0.00 C ATOM 1708 CE LYS A 130 -0.327 10.648 10.135 1.00 0.00 C ATOM 1709 NZ LYS A 130 -0.406 9.188 10.377 1.00 0.00 N ATOM 0 H LYS A 130 -0.904 8.253 5.288 1.00 0.00 H new ATOM 0 HA LYS A 130 -2.317 10.535 6.504 1.00 0.00 H new ATOM 0 HB2 LYS A 130 0.548 10.331 5.573 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -0.255 11.783 6.136 1.00 0.00 H new ATOM 0 HG2 LYS A 130 0.226 9.306 7.826 1.00 0.00 H new ATOM 0 HG3 LYS A 130 1.231 10.741 7.842 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -0.687 12.109 8.602 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -1.741 10.712 8.519 1.00 0.00 H new ATOM 0 HE2 LYS A 130 0.688 10.992 10.335 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -0.982 11.165 10.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.133 8.984 11.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -1.380 8.861 10.214 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 0.239 8.693 9.728 1.00 0.00 H new ATOM 1723 N PRO A 131 -2.647 11.429 4.113 1.00 0.00 N ATOM 1724 CA PRO A 131 -2.930 11.846 2.737 1.00 0.00 C ATOM 1725 C PRO A 131 -1.659 12.341 2.015 1.00 0.00 C ATOM 1726 O PRO A 131 -0.692 12.791 2.669 1.00 0.00 O ATOM 1727 CB PRO A 131 -3.953 12.989 2.898 1.00 0.00 C ATOM 1728 CG PRO A 131 -3.863 13.401 4.328 1.00 0.00 C ATOM 1729 CD PRO A 131 -3.440 12.185 5.091 1.00 0.00 C ATOM 0 HA PRO A 131 -3.304 11.023 2.128 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -3.720 13.821 2.234 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -4.960 12.654 2.648 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -3.143 14.209 4.455 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -4.824 13.770 4.687 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -2.851 12.447 5.970 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -4.298 11.612 5.442 1.00 0.00 H new ATOM 1737 N PRO A 132 -1.619 12.229 0.680 1.00 0.00 N ATOM 1738 CA PRO A 132 -0.474 12.661 -0.119 1.00 0.00 C ATOM 1739 C PRO A 132 -0.343 14.180 -0.140 1.00 0.00 C ATOM 1740 O PRO A 132 -1.348 14.910 -0.213 1.00 0.00 O ATOM 1741 CB PRO A 132 -0.791 12.134 -1.523 1.00 0.00 C ATOM 1742 CG PRO A 132 -2.275 12.028 -1.558 1.00 0.00 C ATOM 1743 CD PRO A 132 -2.693 11.666 -0.161 1.00 0.00 C ATOM 0 HA PRO A 132 0.469 12.289 0.281 1.00 0.00 H new ATOM 0 HB2 PRO A 132 -0.424 12.812 -2.293 1.00 0.00 H new ATOM 0 HB3 PRO A 132 -0.320 11.167 -1.699 1.00 0.00 H new ATOM 0 HG2 PRO A 132 -2.727 12.970 -1.870 1.00 0.00 H new ATOM 0 HG3 PRO A 132 -2.596 11.269 -2.271 1.00 0.00 H new ATOM 0 HD2 PRO A 132 -3.664 12.093 0.090 1.00 0.00 H new ATOM 0 HD3 PRO A 132 -2.777 10.587 -0.035 1.00 0.00 H new ATOM 1751 N ALA A 133 0.862 14.646 -0.067 1.00 0.00 N ATOM 1752 CA ALA A 133 1.132 16.053 -0.066 1.00 0.00 C ATOM 1753 C ALA A 133 2.291 16.334 -0.978 1.00 0.00 C ATOM 1754 O ALA A 133 3.129 15.458 -1.213 1.00 0.00 O ATOM 1755 CB ALA A 133 1.405 16.534 1.353 1.00 0.00 C ATOM 0 H ALA A 133 1.694 14.059 -0.006 1.00 0.00 H new ATOM 0 HA ALA A 133 0.263 16.599 -0.434 1.00 0.00 H new ATOM 0 HB1 ALA A 133 1.609 17.605 1.341 1.00 0.00 H new ATOM 0 HB2 ALA A 133 0.534 16.337 1.978 1.00 0.00 H new ATOM 0 HB3 ALA A 133 2.268 16.005 1.757 1.00 0.00 H new