USER MOD reduce.3.24.130724 H: found=0, std=0, add=801, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 801 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: B 14 LYS NZ :NH3+ 178:sc= -0.0659! (180deg=-0.431!) USER MOD Set 1.2: B 81 ASN : amide:sc= 1.51 K(o=1.5,f=-13!) USER MOD Set 1.3: B 83 SER OG : rot 180:sc= 0.0974 USER MOD Set 2.1: B 66 GLN : amide:sc= 1.01 K(o=-4.5,f=-1.7) USER MOD Set 2.2: B 76 ASN : amide:sc= -5.48! C(o=-4.5!,f=-1.7!) USER MOD Set 3.1: B 56 SER OG : rot 125:sc= 0.935 USER MOD Set 3.2: B 64 GLN : amide:sc= -1.89 K(o=-0.96,f=-2!) USER MOD Set 4.1: B 45 HIS : no HE2:sc= -2.47! C(o=-1.5!,f=-5.2!) USER MOD Set 4.2: B 75 THR OG1 : rot -131:sc= 0.989 USER MOD Set 5.1: A 414 LYS NZ :NH3+ 145:sc= 2.32 (180deg=-0.0953) USER MOD Set 5.2: B 97 GLN : amide:sc= -8.81! C(o=-6.5!,f=-17!) USER MOD Single : B 13 LYS NZ :NH3+ -108:sc= -1.52 (180deg=-4.03!) USER MOD Single : B 17 GLN : amide:sc= -1.4! K(o=-1.4!,f=-0.031) USER MOD Single : B 18 LYS NZ :NH3+ -175:sc= 1.27 (180deg=1.13) USER MOD Single : B 19 LYS NZ :NH3+ -171:sc= -0.658 (180deg=-0.744) USER MOD Single : B 20 GLN : amide:sc= 0.406 X(o=0.41,f=0) USER MOD Single : B 25 TYR OH : rot 180:sc= 0 USER MOD Single : B 27 MET CE :methyl -163:sc= -1.29 (180deg=-1.8) USER MOD Single : B 42 THR OG1 : rot -30:sc= 0.588 USER MOD Single : B 44 SER OG : rot -160:sc= 0.953 USER MOD Single : B 46 MET CE :methyl 132:sc= -0.328 (180deg=-1.55) USER MOD Single : B 47 TYR OH : rot 153:sc= 0.752 USER MOD Single : B 51 LYS NZ :NH3+ -175:sc= 1.84 (180deg=1.7) USER MOD Single : B 52 CYS SG : rot 125:sc= 1.23 USER MOD Single : B 53 GLN : amide:sc= -2.74! C(o=-2.7!,f=-8.7!) USER MOD Single : B 54 LYS NZ :NH3+ 165:sc= 0.399 (180deg=-1.29!) USER MOD Single : B 60 LYS NZ :NH3+ -162:sc= 1.23 (180deg=0.868) USER MOD Single : B 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 70 HIS : no HD1:sc= -0.131 K(o=-0.13,f=-2.2) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 HIS : no HD1:sc= -0.759 X(o=-0.76,f=-0.33) USER MOD Single : B 80 SER OG : rot 141:sc= -1.25! USER MOD Single : B 84 THR OG1 : rot 72:sc= 1.26 USER MOD Single : B 87 LYS NZ :NH3+ -166:sc= 1.25 (180deg=1.11) USER MOD Single : B 93 LYS NZ :NH3+ -156:sc= 2.31 (180deg=2.17) USER MOD Single : B 98 GLN : amide:sc= -2.2 K(o=-2.2,f=-7.8!) USER MOD ----------------------------------------------------------------- ATOM 229 N ASP A 405 10.355 8.721 11.951 1.00 0.00 N ATOM 230 CA ASP A 405 9.820 7.379 12.086 1.00 0.00 C ATOM 231 C ASP A 405 8.902 7.302 13.295 1.00 0.00 C ATOM 232 O ASP A 405 8.587 6.218 13.787 1.00 0.00 O ATOM 233 CB ASP A 405 10.965 6.366 12.214 1.00 0.00 C ATOM 234 CG ASP A 405 12.095 6.635 11.233 1.00 0.00 C ATOM 235 OD1 ASP A 405 11.975 6.249 10.054 1.00 0.00 O ATOM 236 OD2 ASP A 405 13.107 7.251 11.639 1.00 0.00 O ATOM 0 HA ASP A 405 9.241 7.136 11.195 1.00 0.00 H new ATOM 0 HB2 ASP A 405 11.357 6.393 13.231 1.00 0.00 H new ATOM 0 HB3 ASP A 405 10.577 5.361 12.049 1.00 0.00 H new ATOM 241 N GLU A 406 8.451 8.462 13.756 1.00 0.00 N ATOM 242 CA GLU A 406 7.580 8.532 14.916 1.00 0.00 C ATOM 243 C GLU A 406 6.285 9.262 14.611 1.00 0.00 C ATOM 244 O GLU A 406 6.157 9.910 13.574 1.00 0.00 O ATOM 245 CB GLU A 406 8.292 9.223 16.078 1.00 0.00 C ATOM 246 CG GLU A 406 8.936 10.546 15.697 1.00 0.00 C ATOM 247 CD GLU A 406 8.144 11.752 16.163 1.00 0.00 C ATOM 248 OE1 GLU A 406 7.711 11.763 17.331 1.00 0.00 O ATOM 249 OE2 GLU A 406 7.966 12.695 15.358 1.00 0.00 O ATOM 0 H GLU A 406 8.676 9.367 13.342 1.00 0.00 H new ATOM 0 HA GLU A 406 7.334 7.507 15.193 1.00 0.00 H new ATOM 0 HB2 GLU A 406 7.576 9.395 16.881 1.00 0.00 H new ATOM 0 HB3 GLU A 406 9.058 8.556 16.472 1.00 0.00 H new ATOM 0 HG2 GLU A 406 9.938 10.591 16.123 1.00 0.00 H new ATOM 0 HG3 GLU A 406 9.048 10.589 14.614 1.00 0.00 H new ATOM 256 N ASP A 407 5.342 9.143 15.541 1.00 0.00 N ATOM 257 CA ASP A 407 4.039 9.760 15.444 1.00 0.00 C ATOM 258 C ASP A 407 3.274 9.263 14.231 1.00 0.00 C ATOM 259 O ASP A 407 3.072 9.991 13.271 1.00 0.00 O ATOM 260 CB ASP A 407 4.124 11.280 15.468 1.00 0.00 C ATOM 261 CG ASP A 407 2.760 11.933 15.597 1.00 0.00 C ATOM 262 OD1 ASP A 407 1.839 11.283 16.138 1.00 0.00 O ATOM 263 OD2 ASP A 407 2.612 13.094 15.158 1.00 0.00 O ATOM 0 H ASP A 407 5.473 8.603 16.396 1.00 0.00 H new ATOM 0 HA ASP A 407 3.479 9.459 16.329 1.00 0.00 H new ATOM 0 HB2 ASP A 407 4.754 11.593 16.301 1.00 0.00 H new ATOM 0 HB3 ASP A 407 4.606 11.629 14.555 1.00 0.00 H new ATOM 268 N PHE A 408 2.930 7.978 14.253 1.00 0.00 N ATOM 269 CA PHE A 408 2.129 7.377 13.209 1.00 0.00 C ATOM 270 C PHE A 408 0.950 6.717 13.868 1.00 0.00 C ATOM 271 O PHE A 408 1.098 5.901 14.779 1.00 0.00 O ATOM 272 CB PHE A 408 2.902 6.339 12.381 1.00 0.00 C ATOM 273 CG PHE A 408 3.948 6.913 11.479 1.00 0.00 C ATOM 274 CD1 PHE A 408 5.080 7.507 11.998 1.00 0.00 C ATOM 275 CD2 PHE A 408 3.793 6.863 10.107 1.00 0.00 C ATOM 276 CE1 PHE A 408 6.033 8.048 11.166 1.00 0.00 C ATOM 277 CE2 PHE A 408 4.745 7.397 9.270 1.00 0.00 C ATOM 278 CZ PHE A 408 5.865 7.993 9.801 1.00 0.00 C ATOM 0 H PHE A 408 3.201 7.333 14.995 1.00 0.00 H new ATOM 0 HA PHE A 408 1.824 8.159 12.514 1.00 0.00 H new ATOM 0 HB2 PHE A 408 3.376 5.632 13.061 1.00 0.00 H new ATOM 0 HB3 PHE A 408 2.192 5.773 11.778 1.00 0.00 H new ATOM 0 HD1 PHE A 408 5.219 7.548 13.068 1.00 0.00 H new ATOM 0 HD2 PHE A 408 2.913 6.399 9.686 1.00 0.00 H new ATOM 0 HE1 PHE A 408 6.912 8.516 11.584 1.00 0.00 H new ATOM 0 HE2 PHE A 408 4.613 7.348 8.199 1.00 0.00 H new ATOM 0 HZ PHE A 408 6.612 8.418 9.147 1.00 0.00 H new ATOM 288 N VAL A 409 -0.213 7.076 13.401 1.00 0.00 N ATOM 289 CA VAL A 409 -1.433 6.558 13.925 1.00 0.00 C ATOM 290 C VAL A 409 -1.753 5.273 13.229 1.00 0.00 C ATOM 291 O VAL A 409 -1.867 5.226 12.011 1.00 0.00 O ATOM 292 CB VAL A 409 -2.522 7.621 13.796 1.00 0.00 C ATOM 293 CG1 VAL A 409 -2.182 8.673 14.785 1.00 0.00 C ATOM 294 CG2 VAL A 409 -2.562 8.252 12.439 1.00 0.00 C ATOM 0 H VAL A 409 -0.335 7.743 12.639 1.00 0.00 H new ATOM 0 HA VAL A 409 -1.351 6.326 14.987 1.00 0.00 H new ATOM 0 HB VAL A 409 -3.495 7.159 13.961 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -2.927 9.467 14.742 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -2.169 8.241 15.786 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -1.199 9.085 14.555 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -3.355 8.999 12.408 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -1.605 8.731 12.232 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -2.755 7.487 11.687 1.00 0.00 H new ATOM 304 N GLU A 410 -1.846 4.222 14.015 1.00 0.00 N ATOM 305 CA GLU A 410 -2.074 2.908 13.477 1.00 0.00 C ATOM 306 C GLU A 410 -3.311 2.864 12.597 1.00 0.00 C ATOM 307 O GLU A 410 -4.418 3.198 13.022 1.00 0.00 O ATOM 308 CB GLU A 410 -2.180 1.864 14.581 1.00 0.00 C ATOM 309 CG GLU A 410 -1.923 0.456 14.077 1.00 0.00 C ATOM 310 CD GLU A 410 -0.659 -0.145 14.657 1.00 0.00 C ATOM 311 OE1 GLU A 410 -0.386 0.067 15.858 1.00 0.00 O ATOM 312 OE2 GLU A 410 0.100 -0.795 13.907 1.00 0.00 O ATOM 0 H GLU A 410 -1.766 4.257 15.031 1.00 0.00 H new ATOM 0 HA GLU A 410 -1.209 2.670 12.858 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -1.465 2.100 15.369 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -3.174 1.911 15.027 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -2.773 -0.178 14.330 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -1.849 0.470 12.990 1.00 0.00 H new ATOM 319 N VAL A 411 -3.090 2.463 11.368 1.00 0.00 N ATOM 320 CA VAL A 411 -4.130 2.333 10.389 1.00 0.00 C ATOM 321 C VAL A 411 -4.646 0.896 10.417 1.00 0.00 C ATOM 322 O VAL A 411 -3.910 -0.053 10.100 1.00 0.00 O ATOM 323 CB VAL A 411 -3.627 2.702 8.981 1.00 0.00 C ATOM 324 CG1 VAL A 411 -4.793 2.962 8.059 1.00 0.00 C ATOM 325 CG2 VAL A 411 -2.748 3.904 9.036 1.00 0.00 C ATOM 0 H VAL A 411 -2.164 2.215 11.019 1.00 0.00 H new ATOM 0 HA VAL A 411 -4.938 3.024 10.630 1.00 0.00 H new ATOM 0 HB VAL A 411 -3.049 1.863 8.595 1.00 0.00 H new ATOM 0 HG11 VAL A 411 -4.422 3.222 7.068 1.00 0.00 H new ATOM 0 HG12 VAL A 411 -5.411 2.066 7.992 1.00 0.00 H new ATOM 0 HG13 VAL A 411 -5.390 3.786 8.450 1.00 0.00 H new ATOM 0 HG21 VAL A 411 -2.403 4.149 8.031 1.00 0.00 H new ATOM 0 HG22 VAL A 411 -3.308 4.746 9.442 1.00 0.00 H new ATOM 0 HG23 VAL A 411 -1.889 3.698 9.675 1.00 0.00 H new ATOM 335 N PRO A 412 -5.909 0.734 10.842 1.00 0.00 N ATOM 336 CA PRO A 412 -6.571 -0.572 10.965 1.00 0.00 C ATOM 337 C PRO A 412 -6.997 -1.167 9.628 1.00 0.00 C ATOM 338 O PRO A 412 -6.901 -0.518 8.589 1.00 0.00 O ATOM 339 CB PRO A 412 -7.807 -0.241 11.800 1.00 0.00 C ATOM 340 CG PRO A 412 -8.129 1.160 11.419 1.00 0.00 C ATOM 341 CD PRO A 412 -6.802 1.837 11.245 1.00 0.00 C ATOM 0 HA PRO A 412 -5.905 -1.319 11.398 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -8.633 -0.916 11.576 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -7.604 -0.328 12.867 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -8.711 1.193 10.498 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -8.723 1.651 12.190 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -6.845 2.618 10.486 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -6.467 2.309 12.169 1.00 0.00 H new ATOM 349 N GLU A 413 -7.478 -2.402 9.678 1.00 0.00 N ATOM 350 CA GLU A 413 -7.937 -3.113 8.492 1.00 0.00 C ATOM 351 C GLU A 413 -9.415 -2.823 8.238 1.00 0.00 C ATOM 352 O GLU A 413 -10.179 -2.604 9.179 1.00 0.00 O ATOM 353 CB GLU A 413 -7.740 -4.617 8.682 1.00 0.00 C ATOM 354 CG GLU A 413 -6.377 -4.994 9.236 1.00 0.00 C ATOM 355 CD GLU A 413 -5.282 -4.916 8.196 1.00 0.00 C ATOM 356 OE1 GLU A 413 -4.982 -5.955 7.575 1.00 0.00 O ATOM 357 OE2 GLU A 413 -4.717 -3.825 8.003 1.00 0.00 O ATOM 0 H GLU A 413 -7.561 -2.939 10.541 1.00 0.00 H new ATOM 0 HA GLU A 413 -7.356 -2.773 7.635 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -8.511 -4.992 9.355 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -7.882 -5.116 7.724 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -6.131 -4.332 10.067 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -6.420 -6.007 9.637 1.00 0.00 H new ATOM 364 N LYS A 414 -9.811 -2.803 6.971 1.00 0.00 N ATOM 365 CA LYS A 414 -11.203 -2.555 6.615 1.00 0.00 C ATOM 366 C LYS A 414 -11.793 -3.724 5.836 1.00 0.00 C ATOM 367 O LYS A 414 -12.907 -4.159 6.121 1.00 0.00 O ATOM 368 CB LYS A 414 -11.340 -1.247 5.846 1.00 0.00 C ATOM 369 CG LYS A 414 -11.517 -0.050 6.765 1.00 0.00 C ATOM 370 CD LYS A 414 -10.606 1.097 6.383 1.00 0.00 C ATOM 371 CE LYS A 414 -11.269 2.035 5.395 1.00 0.00 C ATOM 372 NZ LYS A 414 -10.669 3.397 5.418 1.00 0.00 N ATOM 0 H LYS A 414 -9.191 -2.955 6.176 1.00 0.00 H new ATOM 0 HA LYS A 414 -11.774 -2.461 7.538 1.00 0.00 H new ATOM 0 HB2 LYS A 414 -10.455 -1.098 5.227 1.00 0.00 H new ATOM 0 HB3 LYS A 414 -12.194 -1.313 5.171 1.00 0.00 H new ATOM 0 HG2 LYS A 414 -12.554 0.284 6.730 1.00 0.00 H new ATOM 0 HG3 LYS A 414 -11.312 -0.349 7.793 1.00 0.00 H new ATOM 0 HD2 LYS A 414 -10.324 1.651 7.278 1.00 0.00 H new ATOM 0 HD3 LYS A 414 -9.687 0.703 5.950 1.00 0.00 H new ATOM 0 HE2 LYS A 414 -11.184 1.620 4.391 1.00 0.00 H new ATOM 0 HE3 LYS A 414 -12.333 2.105 5.622 1.00 0.00 H new ATOM 0 HZ1 LYS A 414 -10.673 3.795 4.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 414 -11.224 4.010 6.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 414 -9.690 3.339 5.764 1.00 0.00 H new ATOM 786 N VAL B 8 -0.101 -2.752 -11.510 1.00 0.00 N ATOM 787 CA VAL B 8 -0.122 -1.726 -10.486 1.00 0.00 C ATOM 788 C VAL B 8 -1.548 -1.243 -10.268 1.00 0.00 C ATOM 789 O VAL B 8 -2.248 -0.898 -11.219 1.00 0.00 O ATOM 790 CB VAL B 8 0.771 -0.524 -10.864 1.00 0.00 C ATOM 791 CG1 VAL B 8 0.911 0.429 -9.689 1.00 0.00 C ATOM 792 CG2 VAL B 8 2.140 -0.994 -11.337 1.00 0.00 C ATOM 0 HA VAL B 8 0.269 -2.167 -9.569 1.00 0.00 H new ATOM 0 HB VAL B 8 0.292 0.009 -11.685 1.00 0.00 H new ATOM 0 HG11 VAL B 8 1.544 1.269 -9.975 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.073 0.798 -9.400 1.00 0.00 H new ATOM 0 HG13 VAL B 8 1.363 -0.095 -8.847 1.00 0.00 H new ATOM 0 HG21 VAL B 8 2.751 -0.130 -11.598 1.00 0.00 H new ATOM 0 HG22 VAL B 8 2.627 -1.556 -10.540 1.00 0.00 H new ATOM 0 HG23 VAL B 8 2.023 -1.633 -12.212 1.00 0.00 H new ATOM 802 N LEU B 9 -1.976 -1.232 -9.017 1.00 0.00 N ATOM 803 CA LEU B 9 -3.320 -0.801 -8.675 1.00 0.00 C ATOM 804 C LEU B 9 -3.333 0.671 -8.282 1.00 0.00 C ATOM 805 O LEU B 9 -4.308 1.377 -8.525 1.00 0.00 O ATOM 806 CB LEU B 9 -3.876 -1.648 -7.527 1.00 0.00 C ATOM 807 CG LEU B 9 -3.952 -3.153 -7.800 1.00 0.00 C ATOM 808 CD1 LEU B 9 -4.483 -3.888 -6.579 1.00 0.00 C ATOM 809 CD2 LEU B 9 -4.827 -3.435 -9.014 1.00 0.00 C ATOM 0 H LEU B 9 -1.409 -1.518 -8.219 1.00 0.00 H new ATOM 0 HA LEU B 9 -3.951 -0.933 -9.554 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -3.256 -1.486 -6.645 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -4.876 -1.289 -7.284 1.00 0.00 H new ATOM 0 HG LEU B 9 -2.946 -3.515 -8.012 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.531 -4.956 -6.790 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -3.819 -3.714 -5.732 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -5.481 -3.521 -6.339 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -4.868 -4.510 -9.191 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -5.834 -3.058 -8.832 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -4.406 -2.939 -9.889 1.00 0.00 H new ATOM 821 N LEU B 10 -2.247 1.134 -7.673 1.00 0.00 N ATOM 822 CA LEU B 10 -2.171 2.527 -7.245 1.00 0.00 C ATOM 823 C LEU B 10 -0.799 3.126 -7.519 1.00 0.00 C ATOM 824 O LEU B 10 0.223 2.489 -7.274 1.00 0.00 O ATOM 825 CB LEU B 10 -2.488 2.621 -5.757 1.00 0.00 C ATOM 826 CG LEU B 10 -2.934 4.001 -5.273 1.00 0.00 C ATOM 827 CD1 LEU B 10 -4.353 4.306 -5.725 1.00 0.00 C ATOM 828 CD2 LEU B 10 -2.833 4.088 -3.764 1.00 0.00 C ATOM 0 H LEU B 10 -1.419 0.576 -7.467 1.00 0.00 H new ATOM 0 HA LEU B 10 -2.902 3.096 -7.818 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.272 1.900 -5.522 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -1.603 2.324 -5.194 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.270 4.745 -5.714 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -4.645 5.293 -5.367 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -4.400 4.286 -6.814 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.033 3.557 -5.319 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.154 5.076 -3.434 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.472 3.329 -3.312 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -1.800 3.921 -3.458 1.00 0.00 H new ATOM 840 N ILE B 11 -0.778 4.354 -8.023 1.00 0.00 N ATOM 841 CA ILE B 11 0.476 5.032 -8.319 1.00 0.00 C ATOM 842 C ILE B 11 0.560 6.369 -7.593 1.00 0.00 C ATOM 843 O ILE B 11 -0.136 7.327 -7.939 1.00 0.00 O ATOM 844 CB ILE B 11 0.665 5.276 -9.832 1.00 0.00 C ATOM 845 CG1 ILE B 11 0.622 3.950 -10.596 1.00 0.00 C ATOM 846 CG2 ILE B 11 1.983 6.005 -10.089 1.00 0.00 C ATOM 847 CD1 ILE B 11 0.769 4.100 -12.096 1.00 0.00 C ATOM 0 H ILE B 11 -1.614 4.899 -8.235 1.00 0.00 H new ATOM 0 HA ILE B 11 1.269 4.371 -7.971 1.00 0.00 H new ATOM 0 HB ILE B 11 -0.151 5.903 -10.190 1.00 0.00 H new ATOM 0 HG12 ILE B 11 1.417 3.303 -10.226 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -0.322 3.449 -10.382 1.00 0.00 H new ATOM 0 HG21 ILE B 11 2.104 6.171 -11.159 1.00 0.00 H new ATOM 0 HG22 ILE B 11 1.975 6.964 -9.572 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.811 5.400 -9.719 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.729 3.117 -12.566 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.041 4.720 -12.481 1.00 0.00 H new ATOM 0 HD13 ILE B 11 1.725 4.571 -12.323 1.00 0.00 H new ATOM 859 N VAL B 12 1.410 6.420 -6.585 1.00 0.00 N ATOM 860 CA VAL B 12 1.628 7.630 -5.813 1.00 0.00 C ATOM 861 C VAL B 12 3.005 8.178 -6.156 1.00 0.00 C ATOM 862 O VAL B 12 3.956 7.415 -6.306 1.00 0.00 O ATOM 863 CB VAL B 12 1.520 7.356 -4.299 1.00 0.00 C ATOM 864 CG1 VAL B 12 1.856 8.597 -3.491 1.00 0.00 C ATOM 865 CG2 VAL B 12 0.125 6.862 -3.959 1.00 0.00 C ATOM 0 H VAL B 12 1.969 5.624 -6.278 1.00 0.00 H new ATOM 0 HA VAL B 12 0.859 8.360 -6.065 1.00 0.00 H new ATOM 0 HB VAL B 12 2.244 6.584 -4.039 1.00 0.00 H new ATOM 0 HG11 VAL B 12 1.771 8.373 -2.428 1.00 0.00 H new ATOM 0 HG12 VAL B 12 2.875 8.912 -3.715 1.00 0.00 H new ATOM 0 HG13 VAL B 12 1.163 9.398 -3.749 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.058 6.671 -2.888 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.607 7.619 -4.239 1.00 0.00 H new ATOM 0 HG23 VAL B 12 -0.078 5.941 -4.505 1.00 0.00 H new ATOM 875 N LYS B 13 3.118 9.487 -6.285 1.00 0.00 N ATOM 876 CA LYS B 13 4.394 10.096 -6.651 1.00 0.00 C ATOM 877 C LYS B 13 4.904 10.991 -5.539 1.00 0.00 C ATOM 878 O LYS B 13 4.143 11.365 -4.647 1.00 0.00 O ATOM 879 CB LYS B 13 4.253 10.908 -7.941 1.00 0.00 C ATOM 880 CG LYS B 13 3.543 10.163 -9.057 1.00 0.00 C ATOM 881 CD LYS B 13 2.381 10.969 -9.618 1.00 0.00 C ATOM 882 CE LYS B 13 1.182 10.968 -8.676 1.00 0.00 C ATOM 883 NZ LYS B 13 1.321 11.969 -7.582 1.00 0.00 N ATOM 0 H LYS B 13 2.353 10.147 -6.145 1.00 0.00 H new ATOM 0 HA LYS B 13 5.112 9.292 -6.813 1.00 0.00 H new ATOM 0 HB2 LYS B 13 3.707 11.826 -7.724 1.00 0.00 H new ATOM 0 HB3 LYS B 13 5.245 11.201 -8.285 1.00 0.00 H new ATOM 0 HG2 LYS B 13 4.251 9.941 -9.855 1.00 0.00 H new ATOM 0 HG3 LYS B 13 3.176 9.208 -8.682 1.00 0.00 H new ATOM 0 HD2 LYS B 13 2.703 11.995 -9.795 1.00 0.00 H new ATOM 0 HD3 LYS B 13 2.085 10.557 -10.583 1.00 0.00 H new ATOM 0 HE2 LYS B 13 0.276 11.178 -9.245 1.00 0.00 H new ATOM 0 HE3 LYS B 13 1.064 9.975 -8.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 1.503 11.478 -6.683 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 2.114 12.608 -7.795 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 0.443 12.521 -7.503 1.00 0.00 H new ATOM 897 N LYS B 14 6.179 11.357 -5.636 1.00 0.00 N ATOM 898 CA LYS B 14 6.833 12.206 -4.651 1.00 0.00 C ATOM 899 C LYS B 14 6.638 11.668 -3.235 1.00 0.00 C ATOM 900 O LYS B 14 5.897 12.233 -2.428 1.00 0.00 O ATOM 901 CB LYS B 14 6.311 13.627 -4.783 1.00 0.00 C ATOM 902 CG LYS B 14 7.114 14.485 -5.746 1.00 0.00 C ATOM 903 CD LYS B 14 7.996 15.482 -5.008 1.00 0.00 C ATOM 904 CE LYS B 14 7.483 16.906 -5.162 1.00 0.00 C ATOM 905 NZ LYS B 14 6.157 17.096 -4.518 1.00 0.00 N ATOM 0 H LYS B 14 6.788 11.071 -6.403 1.00 0.00 H new ATOM 0 HA LYS B 14 7.906 12.206 -4.842 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.274 13.594 -5.117 1.00 0.00 H new ATOM 0 HB3 LYS B 14 6.314 14.099 -3.800 1.00 0.00 H new ATOM 0 HG2 LYS B 14 7.734 13.845 -6.374 1.00 0.00 H new ATOM 0 HG3 LYS B 14 6.435 15.021 -6.409 1.00 0.00 H new ATOM 0 HD2 LYS B 14 8.035 15.221 -3.950 1.00 0.00 H new ATOM 0 HD3 LYS B 14 9.015 15.419 -5.389 1.00 0.00 H new ATOM 0 HE2 LYS B 14 8.201 17.599 -4.723 1.00 0.00 H new ATOM 0 HE3 LYS B 14 7.409 17.152 -6.221 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 5.861 18.088 -4.618 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 5.457 16.478 -4.976 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 6.224 16.855 -3.509 1.00 0.00 H new ATOM 919 N VAL B 15 7.287 10.550 -2.969 1.00 0.00 N ATOM 920 CA VAL B 15 7.241 9.892 -1.677 1.00 0.00 C ATOM 921 C VAL B 15 8.663 9.623 -1.203 1.00 0.00 C ATOM 922 O VAL B 15 9.407 8.897 -1.854 1.00 0.00 O ATOM 923 CB VAL B 15 6.461 8.560 -1.742 1.00 0.00 C ATOM 924 CG1 VAL B 15 6.528 7.819 -0.414 1.00 0.00 C ATOM 925 CG2 VAL B 15 5.016 8.810 -2.135 1.00 0.00 C ATOM 0 H VAL B 15 7.869 10.067 -3.654 1.00 0.00 H new ATOM 0 HA VAL B 15 6.723 10.550 -0.979 1.00 0.00 H new ATOM 0 HB VAL B 15 6.928 7.934 -2.502 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.970 6.886 -0.490 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.568 7.602 -0.171 1.00 0.00 H new ATOM 0 HG13 VAL B 15 6.094 8.439 0.371 1.00 0.00 H new ATOM 0 HG21 VAL B 15 4.481 7.861 -2.176 1.00 0.00 H new ATOM 0 HG22 VAL B 15 4.546 9.460 -1.397 1.00 0.00 H new ATOM 0 HG23 VAL B 15 4.983 9.288 -3.114 1.00 0.00 H new ATOM 935 N ARG B 16 9.035 10.199 -0.075 1.00 0.00 N ATOM 936 CA ARG B 16 10.376 10.026 0.452 1.00 0.00 C ATOM 937 C ARG B 16 10.444 8.901 1.476 1.00 0.00 C ATOM 938 O ARG B 16 9.613 8.805 2.378 1.00 0.00 O ATOM 939 CB ARG B 16 10.880 11.324 1.087 1.00 0.00 C ATOM 940 CG ARG B 16 10.747 12.532 0.182 1.00 0.00 C ATOM 941 CD ARG B 16 11.839 13.557 0.430 1.00 0.00 C ATOM 942 NE ARG B 16 11.771 14.143 1.768 1.00 0.00 N ATOM 943 CZ ARG B 16 12.025 15.424 2.026 1.00 0.00 C ATOM 944 NH1 ARG B 16 12.286 16.263 1.031 1.00 0.00 N ATOM 945 NH2 ARG B 16 12.004 15.868 3.278 1.00 0.00 N ATOM 0 H ARG B 16 8.428 10.790 0.493 1.00 0.00 H new ATOM 0 HA ARG B 16 11.015 9.760 -0.390 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.326 11.507 2.008 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.927 11.201 1.364 1.00 0.00 H new ATOM 0 HG2 ARG B 16 10.783 12.210 -0.859 1.00 0.00 H new ATOM 0 HG3 ARG B 16 9.773 12.996 0.339 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.812 13.085 0.294 1.00 0.00 H new ATOM 0 HD3 ARG B 16 11.763 14.350 -0.314 1.00 0.00 H new ATOM 0 HE ARG B 16 11.515 13.536 2.547 1.00 0.00 H new ATOM 0 HH11 ARG B 16 12.292 15.926 0.068 1.00 0.00 H new ATOM 0 HH12 ARG B 16 12.481 17.244 1.229 1.00 0.00 H new ATOM 0 HH21 ARG B 16 11.793 15.227 4.043 1.00 0.00 H new ATOM 0 HH22 ARG B 16 12.199 16.850 3.474 1.00 0.00 H new ATOM 959 N GLN B 17 11.439 8.050 1.316 1.00 0.00 N ATOM 960 CA GLN B 17 11.672 6.949 2.226 1.00 0.00 C ATOM 961 C GLN B 17 12.988 7.197 2.951 1.00 0.00 C ATOM 962 O GLN B 17 14.055 6.982 2.381 1.00 0.00 O ATOM 963 CB GLN B 17 11.736 5.627 1.447 1.00 0.00 C ATOM 964 CG GLN B 17 11.210 4.418 2.209 1.00 0.00 C ATOM 965 CD GLN B 17 12.140 3.941 3.315 1.00 0.00 C ATOM 966 OE1 GLN B 17 11.691 3.430 4.339 1.00 0.00 O ATOM 967 NE2 GLN B 17 13.441 4.096 3.114 1.00 0.00 N ATOM 0 H GLN B 17 12.109 8.104 0.549 1.00 0.00 H new ATOM 0 HA GLN B 17 10.858 6.880 2.947 1.00 0.00 H new ATOM 0 HB2 GLN B 17 11.165 5.736 0.525 1.00 0.00 H new ATOM 0 HB3 GLN B 17 12.771 5.438 1.161 1.00 0.00 H new ATOM 0 HG2 GLN B 17 10.241 4.666 2.643 1.00 0.00 H new ATOM 0 HG3 GLN B 17 11.045 3.601 1.507 1.00 0.00 H new ATOM 0 HE21 GLN B 17 13.776 4.525 2.251 1.00 0.00 H new ATOM 0 HE22 GLN B 17 14.107 3.787 3.822 1.00 0.00 H new ATOM 976 N LYS B 18 12.889 7.642 4.205 1.00 0.00 N ATOM 977 CA LYS B 18 14.050 7.938 5.045 1.00 0.00 C ATOM 978 C LYS B 18 15.180 8.646 4.281 1.00 0.00 C ATOM 979 O LYS B 18 16.259 8.082 4.088 1.00 0.00 O ATOM 980 CB LYS B 18 14.544 6.659 5.711 1.00 0.00 C ATOM 981 CG LYS B 18 13.857 6.366 7.040 1.00 0.00 C ATOM 982 CD LYS B 18 14.838 6.372 8.207 1.00 0.00 C ATOM 983 CE LYS B 18 15.224 7.786 8.626 1.00 0.00 C ATOM 984 NZ LYS B 18 14.197 8.427 9.493 1.00 0.00 N ATOM 0 H LYS B 18 11.996 7.808 4.669 1.00 0.00 H new ATOM 0 HA LYS B 18 13.728 8.641 5.813 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.383 5.820 5.034 1.00 0.00 H new ATOM 0 HB3 LYS B 18 15.619 6.735 5.875 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.079 7.109 7.217 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.364 5.395 6.986 1.00 0.00 H new ATOM 0 HD2 LYS B 18 14.394 5.852 9.056 1.00 0.00 H new ATOM 0 HD3 LYS B 18 15.735 5.820 7.928 1.00 0.00 H new ATOM 0 HE2 LYS B 18 16.175 7.757 9.157 1.00 0.00 H new ATOM 0 HE3 LYS B 18 15.375 8.396 7.736 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 14.467 9.414 9.680 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 13.275 8.405 9.013 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 14.131 7.910 10.393 1.00 0.00 H new ATOM 998 N LYS B 19 14.894 9.875 3.843 1.00 0.00 N ATOM 999 CA LYS B 19 15.834 10.724 3.113 1.00 0.00 C ATOM 1000 C LYS B 19 16.091 10.276 1.669 1.00 0.00 C ATOM 1001 O LYS B 19 17.210 10.384 1.166 1.00 0.00 O ATOM 1002 CB LYS B 19 17.128 10.836 3.898 1.00 0.00 C ATOM 1003 CG LYS B 19 17.155 12.010 4.864 1.00 0.00 C ATOM 1004 CD LYS B 19 17.087 13.342 4.133 1.00 0.00 C ATOM 1005 CE LYS B 19 15.947 14.206 4.644 1.00 0.00 C ATOM 1006 NZ LYS B 19 14.624 13.747 4.136 1.00 0.00 N ATOM 0 H LYS B 19 13.985 10.314 3.990 1.00 0.00 H new ATOM 0 HA LYS B 19 15.370 11.706 3.021 1.00 0.00 H new ATOM 0 HB2 LYS B 19 17.285 9.913 4.456 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.960 10.932 3.200 1.00 0.00 H new ATOM 0 HG2 LYS B 19 16.316 11.931 5.556 1.00 0.00 H new ATOM 0 HG3 LYS B 19 18.066 11.969 5.461 1.00 0.00 H new ATOM 0 HD2 LYS B 19 18.030 13.874 4.257 1.00 0.00 H new ATOM 0 HD3 LYS B 19 16.959 13.165 3.065 1.00 0.00 H new ATOM 0 HE2 LYS B 19 15.941 14.190 5.734 1.00 0.00 H new ATOM 0 HE3 LYS B 19 16.112 15.240 4.341 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 13.896 14.448 4.381 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 14.667 13.640 3.102 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 14.384 12.832 4.569 1.00 0.00 H new ATOM 1020 N GLN B 20 15.054 9.779 1.008 1.00 0.00 N ATOM 1021 CA GLN B 20 15.147 9.374 -0.390 1.00 0.00 C ATOM 1022 C GLN B 20 13.805 9.622 -1.063 1.00 0.00 C ATOM 1023 O GLN B 20 12.818 9.002 -0.697 1.00 0.00 O ATOM 1024 CB GLN B 20 15.520 7.894 -0.519 1.00 0.00 C ATOM 1025 CG GLN B 20 17.016 7.637 -0.598 1.00 0.00 C ATOM 1026 CD GLN B 20 17.543 6.891 0.611 1.00 0.00 C ATOM 1027 OE1 GLN B 20 17.567 5.661 0.635 1.00 0.00 O ATOM 1028 NE2 GLN B 20 17.971 7.630 1.619 1.00 0.00 N ATOM 0 H GLN B 20 14.131 9.646 1.421 1.00 0.00 H new ATOM 0 HA GLN B 20 15.930 9.960 -0.872 1.00 0.00 H new ATOM 0 HB2 GLN B 20 15.113 7.352 0.335 1.00 0.00 H new ATOM 0 HB3 GLN B 20 15.044 7.487 -1.411 1.00 0.00 H new ATOM 0 HG2 GLN B 20 17.235 7.063 -1.498 1.00 0.00 H new ATOM 0 HG3 GLN B 20 17.540 8.588 -0.690 1.00 0.00 H new ATOM 0 HE21 GLN B 20 17.933 8.647 1.558 1.00 0.00 H new ATOM 0 HE22 GLN B 20 18.339 7.183 2.459 1.00 0.00 H new ATOM 1037 N ASP B 21 13.761 10.511 -2.046 1.00 0.00 N ATOM 1038 CA ASP B 21 12.503 10.812 -2.732 1.00 0.00 C ATOM 1039 C ASP B 21 12.225 9.783 -3.819 1.00 0.00 C ATOM 1040 O ASP B 21 13.156 9.203 -4.387 1.00 0.00 O ATOM 1041 CB ASP B 21 12.522 12.221 -3.332 1.00 0.00 C ATOM 1042 CG ASP B 21 11.188 12.932 -3.172 1.00 0.00 C ATOM 1043 OD1 ASP B 21 11.190 14.138 -2.842 1.00 0.00 O ATOM 1044 OD2 ASP B 21 10.137 12.284 -3.350 1.00 0.00 O ATOM 0 H ASP B 21 14.569 11.033 -2.386 1.00 0.00 H new ATOM 0 HA ASP B 21 11.703 10.767 -1.993 1.00 0.00 H new ATOM 0 HB2 ASP B 21 13.304 12.808 -2.851 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.774 12.160 -4.391 1.00 0.00 H new ATOM 1049 N GLY B 22 10.954 9.559 -4.111 1.00 0.00 N ATOM 1050 CA GLY B 22 10.593 8.586 -5.117 1.00 0.00 C ATOM 1051 C GLY B 22 9.102 8.469 -5.329 1.00 0.00 C ATOM 1052 O GLY B 22 8.352 9.380 -5.017 1.00 0.00 O ATOM 0 H GLY B 22 10.167 10.034 -3.669 1.00 0.00 H new ATOM 0 HA2 GLY B 22 11.067 8.857 -6.061 1.00 0.00 H new ATOM 0 HA3 GLY B 22 10.989 7.612 -4.829 1.00 0.00 H new ATOM 1056 N ALA B 23 8.681 7.335 -5.859 1.00 0.00 N ATOM 1057 CA ALA B 23 7.279 7.076 -6.120 1.00 0.00 C ATOM 1058 C ALA B 23 6.861 5.765 -5.466 1.00 0.00 C ATOM 1059 O ALA B 23 7.644 4.813 -5.404 1.00 0.00 O ATOM 1060 CB ALA B 23 7.021 7.031 -7.619 1.00 0.00 C ATOM 0 H ALA B 23 9.302 6.569 -6.120 1.00 0.00 H new ATOM 0 HA ALA B 23 6.685 7.884 -5.693 1.00 0.00 H new ATOM 0 HB1 ALA B 23 5.964 6.836 -7.801 1.00 0.00 H new ATOM 0 HB2 ALA B 23 7.295 7.987 -8.064 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.619 6.238 -8.067 1.00 0.00 H new ATOM 1066 N LEU B 24 5.634 5.717 -4.980 1.00 0.00 N ATOM 1067 CA LEU B 24 5.115 4.528 -4.327 1.00 0.00 C ATOM 1068 C LEU B 24 4.068 3.863 -5.210 1.00 0.00 C ATOM 1069 O LEU B 24 3.086 4.488 -5.607 1.00 0.00 O ATOM 1070 CB LEU B 24 4.514 4.882 -2.969 1.00 0.00 C ATOM 1071 CG LEU B 24 4.206 3.680 -2.082 1.00 0.00 C ATOM 1072 CD1 LEU B 24 5.478 3.126 -1.466 1.00 0.00 C ATOM 1073 CD2 LEU B 24 3.204 4.057 -1.003 1.00 0.00 C ATOM 0 H LEU B 24 4.974 6.493 -5.026 1.00 0.00 H new ATOM 0 HA LEU B 24 5.938 3.831 -4.168 1.00 0.00 H new ATOM 0 HB2 LEU B 24 5.204 5.540 -2.441 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.595 5.445 -3.128 1.00 0.00 H new ATOM 0 HG LEU B 24 3.764 2.900 -2.702 1.00 0.00 H new ATOM 0 HD11 LEU B 24 5.235 2.269 -0.837 1.00 0.00 H new ATOM 0 HD12 LEU B 24 6.159 2.813 -2.257 1.00 0.00 H new ATOM 0 HD13 LEU B 24 5.955 3.897 -0.860 1.00 0.00 H new ATOM 0 HD21 LEU B 24 2.996 3.187 -0.380 1.00 0.00 H new ATOM 0 HD22 LEU B 24 3.617 4.855 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU B 24 2.280 4.399 -1.468 1.00 0.00 H new ATOM 1085 N TYR B 25 4.283 2.597 -5.514 1.00 0.00 N ATOM 1086 CA TYR B 25 3.372 1.854 -6.365 1.00 0.00 C ATOM 1087 C TYR B 25 2.697 0.730 -5.592 1.00 0.00 C ATOM 1088 O TYR B 25 3.367 -0.131 -5.017 1.00 0.00 O ATOM 1089 CB TYR B 25 4.124 1.266 -7.566 1.00 0.00 C ATOM 1090 CG TYR B 25 4.599 2.291 -8.574 1.00 0.00 C ATOM 1091 CD1 TYR B 25 5.657 3.146 -8.287 1.00 0.00 C ATOM 1092 CD2 TYR B 25 3.996 2.395 -9.821 1.00 0.00 C ATOM 1093 CE1 TYR B 25 6.097 4.072 -9.212 1.00 0.00 C ATOM 1094 CE2 TYR B 25 4.431 3.320 -10.749 1.00 0.00 C ATOM 1095 CZ TYR B 25 5.481 4.156 -10.440 1.00 0.00 C ATOM 1096 OH TYR B 25 5.916 5.077 -11.364 1.00 0.00 O ATOM 0 H TYR B 25 5.084 2.059 -5.183 1.00 0.00 H new ATOM 0 HA TYR B 25 2.607 2.546 -6.718 1.00 0.00 H new ATOM 0 HB2 TYR B 25 4.986 0.708 -7.201 1.00 0.00 H new ATOM 0 HB3 TYR B 25 3.473 0.552 -8.072 1.00 0.00 H new ATOM 0 HD1 TYR B 25 6.143 3.085 -7.324 1.00 0.00 H new ATOM 0 HD2 TYR B 25 3.173 1.741 -10.069 1.00 0.00 H new ATOM 0 HE1 TYR B 25 6.921 4.728 -8.973 1.00 0.00 H new ATOM 0 HE2 TYR B 25 3.950 3.388 -11.713 1.00 0.00 H new ATOM 0 HH TYR B 25 5.375 5.004 -12.178 1.00 0.00 H new ATOM 1106 N LEU B 26 1.374 0.754 -5.557 1.00 0.00 N ATOM 1107 CA LEU B 26 0.622 -0.295 -4.891 1.00 0.00 C ATOM 1108 C LEU B 26 0.289 -1.344 -5.923 1.00 0.00 C ATOM 1109 O LEU B 26 -0.402 -1.061 -6.898 1.00 0.00 O ATOM 1110 CB LEU B 26 -0.657 0.227 -4.237 1.00 0.00 C ATOM 1111 CG LEU B 26 -0.457 1.248 -3.119 1.00 0.00 C ATOM 1112 CD1 LEU B 26 -1.634 1.228 -2.160 1.00 0.00 C ATOM 1113 CD2 LEU B 26 0.832 0.987 -2.368 1.00 0.00 C ATOM 0 H LEU B 26 0.802 1.485 -5.980 1.00 0.00 H new ATOM 0 HA LEU B 26 1.230 -0.710 -4.087 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -1.281 0.678 -5.009 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -1.211 -0.622 -3.835 1.00 0.00 H new ATOM 0 HG LEU B 26 -0.393 2.235 -3.576 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.473 1.962 -1.371 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.548 1.472 -2.701 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -1.727 0.236 -1.719 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.949 1.729 -1.578 1.00 0.00 H new ATOM 0 HD22 LEU B 26 0.802 -0.010 -1.928 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.674 1.054 -3.057 1.00 0.00 H new ATOM 1125 N MET B 27 0.777 -2.544 -5.716 1.00 0.00 N ATOM 1126 CA MET B 27 0.576 -3.610 -6.670 1.00 0.00 C ATOM 1127 C MET B 27 -0.472 -4.590 -6.179 1.00 0.00 C ATOM 1128 O MET B 27 -0.846 -4.575 -5.006 1.00 0.00 O ATOM 1129 CB MET B 27 1.887 -4.339 -6.908 1.00 0.00 C ATOM 1130 CG MET B 27 3.118 -3.467 -6.708 1.00 0.00 C ATOM 1131 SD MET B 27 3.237 -2.138 -7.910 1.00 0.00 S ATOM 1132 CE MET B 27 4.168 -2.976 -9.175 1.00 0.00 C ATOM 0 H MET B 27 1.318 -2.808 -4.893 1.00 0.00 H new ATOM 0 HA MET B 27 0.225 -3.172 -7.604 1.00 0.00 H new ATOM 0 HB2 MET B 27 1.945 -5.193 -6.234 1.00 0.00 H new ATOM 0 HB3 MET B 27 1.894 -4.734 -7.924 1.00 0.00 H new ATOM 0 HG2 MET B 27 3.096 -3.042 -5.705 1.00 0.00 H new ATOM 0 HG3 MET B 27 4.011 -4.088 -6.772 1.00 0.00 H new ATOM 0 HE1 MET B 27 4.596 -2.242 -9.858 1.00 0.00 H new ATOM 0 HE2 MET B 27 4.969 -3.554 -8.714 1.00 0.00 H new ATOM 0 HE3 MET B 27 3.509 -3.646 -9.728 1.00 0.00 H new ATOM 1142 N ALA B 28 -0.905 -5.460 -7.085 1.00 0.00 N ATOM 1143 CA ALA B 28 -1.927 -6.464 -6.805 1.00 0.00 C ATOM 1144 C ALA B 28 -1.714 -7.194 -5.478 1.00 0.00 C ATOM 1145 O ALA B 28 -2.633 -7.283 -4.670 1.00 0.00 O ATOM 1146 CB ALA B 28 -1.988 -7.467 -7.946 1.00 0.00 C ATOM 0 H ALA B 28 -0.554 -5.489 -8.042 1.00 0.00 H new ATOM 0 HA ALA B 28 -2.874 -5.932 -6.717 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -2.752 -8.215 -7.733 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.235 -6.949 -8.873 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -1.020 -7.957 -8.052 1.00 0.00 H new ATOM 1152 N GLU B 29 -0.509 -7.701 -5.242 1.00 0.00 N ATOM 1153 CA GLU B 29 -0.240 -8.444 -4.013 1.00 0.00 C ATOM 1154 C GLU B 29 0.910 -7.853 -3.198 1.00 0.00 C ATOM 1155 O GLU B 29 1.423 -8.503 -2.285 1.00 0.00 O ATOM 1156 CB GLU B 29 0.076 -9.900 -4.350 1.00 0.00 C ATOM 1157 CG GLU B 29 -1.145 -10.799 -4.387 1.00 0.00 C ATOM 1158 CD GLU B 29 -1.173 -11.780 -3.232 1.00 0.00 C ATOM 1159 OE1 GLU B 29 -0.792 -11.395 -2.105 1.00 0.00 O ATOM 1160 OE2 GLU B 29 -1.581 -12.941 -3.442 1.00 0.00 O ATOM 0 H GLU B 29 0.287 -7.614 -5.874 1.00 0.00 H new ATOM 0 HA GLU B 29 -1.139 -8.377 -3.400 1.00 0.00 H new ATOM 0 HB2 GLU B 29 0.574 -9.939 -5.319 1.00 0.00 H new ATOM 0 HB3 GLU B 29 0.780 -10.289 -3.614 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -2.046 -10.186 -4.362 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -1.160 -11.349 -5.328 1.00 0.00 H new ATOM 1167 N ARG B 30 1.302 -6.616 -3.478 1.00 0.00 N ATOM 1168 CA ARG B 30 2.411 -6.022 -2.737 1.00 0.00 C ATOM 1169 C ARG B 30 2.487 -4.519 -2.927 1.00 0.00 C ATOM 1170 O ARG B 30 1.778 -3.946 -3.738 1.00 0.00 O ATOM 1171 CB ARG B 30 3.744 -6.645 -3.174 1.00 0.00 C ATOM 1172 CG ARG B 30 4.191 -6.209 -4.559 1.00 0.00 C ATOM 1173 CD ARG B 30 5.604 -6.669 -4.877 1.00 0.00 C ATOM 1174 NE ARG B 30 5.861 -6.600 -6.311 1.00 0.00 N ATOM 1175 CZ ARG B 30 7.038 -6.324 -6.866 1.00 0.00 C ATOM 1176 NH1 ARG B 30 8.117 -6.124 -6.113 1.00 0.00 N ATOM 1177 NH2 ARG B 30 7.126 -6.250 -8.187 1.00 0.00 N ATOM 0 H ARG B 30 0.884 -6.018 -4.191 1.00 0.00 H new ATOM 0 HA ARG B 30 2.228 -6.227 -1.682 1.00 0.00 H new ATOM 0 HB2 ARG B 30 4.515 -6.378 -2.451 1.00 0.00 H new ATOM 0 HB3 ARG B 30 3.652 -7.731 -3.156 1.00 0.00 H new ATOM 0 HG2 ARG B 30 3.504 -6.610 -5.304 1.00 0.00 H new ATOM 0 HG3 ARG B 30 4.140 -5.123 -4.630 1.00 0.00 H new ATOM 0 HD2 ARG B 30 6.323 -6.046 -4.344 1.00 0.00 H new ATOM 0 HD3 ARG B 30 5.746 -7.691 -4.526 1.00 0.00 H new ATOM 0 HE ARG B 30 5.076 -6.777 -6.938 1.00 0.00 H new ATOM 0 HH11 ARG B 30 8.048 -6.182 -5.097 1.00 0.00 H new ATOM 0 HH12 ARG B 30 9.013 -5.913 -6.552 1.00 0.00 H new ATOM 0 HH21 ARG B 30 6.298 -6.404 -8.763 1.00 0.00 H new ATOM 0 HH22 ARG B 30 8.022 -6.039 -8.627 1.00 0.00 H new ATOM 1191 N ILE B 31 3.353 -3.899 -2.153 1.00 0.00 N ATOM 1192 CA ILE B 31 3.593 -2.473 -2.233 1.00 0.00 C ATOM 1193 C ILE B 31 5.077 -2.262 -2.481 1.00 0.00 C ATOM 1194 O ILE B 31 5.919 -2.857 -1.801 1.00 0.00 O ATOM 1195 CB ILE B 31 3.148 -1.736 -0.944 1.00 0.00 C ATOM 1196 CG1 ILE B 31 3.693 -0.304 -0.915 1.00 0.00 C ATOM 1197 CG2 ILE B 31 3.592 -2.499 0.295 1.00 0.00 C ATOM 1198 CD1 ILE B 31 3.219 0.502 0.277 1.00 0.00 C ATOM 0 H ILE B 31 3.914 -4.374 -1.446 1.00 0.00 H new ATOM 0 HA ILE B 31 3.002 -2.056 -3.049 1.00 0.00 H new ATOM 0 HB ILE B 31 2.059 -1.686 -0.946 1.00 0.00 H new ATOM 0 HG12 ILE B 31 4.782 -0.339 -0.909 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.395 0.208 -1.830 1.00 0.00 H new ATOM 0 HG21 ILE B 31 3.269 -1.963 1.188 1.00 0.00 H new ATOM 0 HG22 ILE B 31 3.147 -3.494 0.288 1.00 0.00 H new ATOM 0 HG23 ILE B 31 4.678 -2.587 0.298 1.00 0.00 H new ATOM 0 HD11 ILE B 31 3.645 1.504 0.231 1.00 0.00 H new ATOM 0 HD12 ILE B 31 2.131 0.569 0.262 1.00 0.00 H new ATOM 0 HD13 ILE B 31 3.540 0.014 1.197 1.00 0.00 H new ATOM 1210 N ALA B 32 5.404 -1.457 -3.470 1.00 0.00 N ATOM 1211 CA ALA B 32 6.792 -1.221 -3.800 1.00 0.00 C ATOM 1212 C ALA B 32 7.095 0.260 -3.948 1.00 0.00 C ATOM 1213 O ALA B 32 6.253 1.043 -4.385 1.00 0.00 O ATOM 1214 CB ALA B 32 7.150 -1.973 -5.068 1.00 0.00 C ATOM 0 H ALA B 32 4.733 -0.959 -4.055 1.00 0.00 H new ATOM 0 HA ALA B 32 7.404 -1.590 -2.977 1.00 0.00 H new ATOM 0 HB1 ALA B 32 8.196 -1.793 -5.314 1.00 0.00 H new ATOM 0 HB2 ALA B 32 6.991 -3.040 -4.915 1.00 0.00 H new ATOM 0 HB3 ALA B 32 6.520 -1.626 -5.887 1.00 0.00 H new ATOM 1220 N TRP B 33 8.306 0.635 -3.573 1.00 0.00 N ATOM 1221 CA TRP B 33 8.744 2.014 -3.660 1.00 0.00 C ATOM 1222 C TRP B 33 10.024 2.105 -4.476 1.00 0.00 C ATOM 1223 O TRP B 33 10.950 1.313 -4.286 1.00 0.00 O ATOM 1224 CB TRP B 33 8.971 2.596 -2.259 1.00 0.00 C ATOM 1225 CG TRP B 33 9.473 4.010 -2.270 1.00 0.00 C ATOM 1226 CD1 TRP B 33 8.719 5.146 -2.246 1.00 0.00 C ATOM 1227 CD2 TRP B 33 10.843 4.441 -2.320 1.00 0.00 C ATOM 1228 NE1 TRP B 33 9.531 6.252 -2.279 1.00 0.00 N ATOM 1229 CE2 TRP B 33 10.836 5.846 -2.326 1.00 0.00 C ATOM 1230 CE3 TRP B 33 12.073 3.777 -2.362 1.00 0.00 C ATOM 1231 CZ2 TRP B 33 12.005 6.597 -2.371 1.00 0.00 C ATOM 1232 CZ3 TRP B 33 13.234 4.525 -2.408 1.00 0.00 C ATOM 1233 CH2 TRP B 33 13.192 5.924 -2.414 1.00 0.00 C ATOM 0 H TRP B 33 9.008 -0.005 -3.202 1.00 0.00 H new ATOM 0 HA TRP B 33 7.965 2.594 -4.155 1.00 0.00 H new ATOM 0 HB2 TRP B 33 8.035 2.556 -1.702 1.00 0.00 H new ATOM 0 HB3 TRP B 33 9.686 1.970 -1.726 1.00 0.00 H new ATOM 0 HD1 TRP B 33 7.640 5.172 -2.207 1.00 0.00 H new ATOM 0 HE1 TRP B 33 9.212 7.221 -2.270 1.00 0.00 H new ATOM 0 HE3 TRP B 33 12.115 2.698 -2.359 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 11.975 7.677 -2.372 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 14.189 4.022 -2.440 1.00 0.00 H new ATOM 0 HH2 TRP B 33 14.116 6.482 -2.453 1.00 0.00 H new ATOM 1244 N ALA B 34 10.063 3.068 -5.379 1.00 0.00 N ATOM 1245 CA ALA B 34 11.219 3.289 -6.228 1.00 0.00 C ATOM 1246 C ALA B 34 11.534 4.772 -6.273 1.00 0.00 C ATOM 1247 O ALA B 34 10.621 5.587 -6.217 1.00 0.00 O ATOM 1248 CB ALA B 34 10.950 2.771 -7.631 1.00 0.00 C ATOM 0 H ALA B 34 9.295 3.718 -5.544 1.00 0.00 H new ATOM 0 HA ALA B 34 12.072 2.749 -5.818 1.00 0.00 H new ATOM 0 HB1 ALA B 34 11.826 2.944 -8.257 1.00 0.00 H new ATOM 0 HB2 ALA B 34 10.738 1.703 -7.590 1.00 0.00 H new ATOM 0 HB3 ALA B 34 10.093 3.295 -8.054 1.00 0.00 H new ATOM 1254 N PRO B 35 12.818 5.150 -6.350 1.00 0.00 N ATOM 1255 CA PRO B 35 13.203 6.560 -6.418 1.00 0.00 C ATOM 1256 C PRO B 35 12.591 7.223 -7.652 1.00 0.00 C ATOM 1257 O PRO B 35 12.455 6.585 -8.699 1.00 0.00 O ATOM 1258 CB PRO B 35 14.733 6.525 -6.502 1.00 0.00 C ATOM 1259 CG PRO B 35 15.122 5.163 -6.030 1.00 0.00 C ATOM 1260 CD PRO B 35 13.981 4.253 -6.383 1.00 0.00 C ATOM 0 HA PRO B 35 12.852 7.139 -5.564 1.00 0.00 H new ATOM 0 HB2 PRO B 35 15.075 6.700 -7.522 1.00 0.00 H new ATOM 0 HB3 PRO B 35 15.179 7.300 -5.878 1.00 0.00 H new ATOM 0 HG2 PRO B 35 16.044 4.834 -6.509 1.00 0.00 H new ATOM 0 HG3 PRO B 35 15.303 5.161 -4.955 1.00 0.00 H new ATOM 0 HD2 PRO B 35 14.114 3.802 -7.366 1.00 0.00 H new ATOM 0 HD3 PRO B 35 13.881 3.436 -5.668 1.00 0.00 H new ATOM 1368 N THR B 42 13.168 -0.378 -5.074 1.00 0.00 N ATOM 1369 CA THR B 42 14.167 -0.870 -4.141 1.00 0.00 C ATOM 1370 C THR B 42 13.483 -1.462 -2.913 1.00 0.00 C ATOM 1371 O THR B 42 14.016 -2.348 -2.247 1.00 0.00 O ATOM 1372 CB THR B 42 15.117 0.261 -3.707 1.00 0.00 C ATOM 1373 OG1 THR B 42 14.422 1.517 -3.736 1.00 0.00 O ATOM 1374 CG2 THR B 42 16.333 0.328 -4.620 1.00 0.00 C ATOM 0 HA THR B 42 14.752 -1.642 -4.642 1.00 0.00 H new ATOM 0 HB THR B 42 15.457 0.054 -2.692 1.00 0.00 H new ATOM 0 HG1 THR B 42 13.730 1.492 -4.430 1.00 0.00 H new ATOM 0 HG21 THR B 42 16.989 1.135 -4.293 1.00 0.00 H new ATOM 0 HG22 THR B 42 16.872 -0.618 -4.578 1.00 0.00 H new ATOM 0 HG23 THR B 42 16.009 0.516 -5.644 1.00 0.00 H new ATOM 1382 N ILE B 43 12.291 -0.956 -2.629 1.00 0.00 N ATOM 1383 CA ILE B 43 11.502 -1.422 -1.500 1.00 0.00 C ATOM 1384 C ILE B 43 10.346 -2.274 -2.006 1.00 0.00 C ATOM 1385 O ILE B 43 9.590 -1.838 -2.872 1.00 0.00 O ATOM 1386 CB ILE B 43 10.946 -0.237 -0.676 1.00 0.00 C ATOM 1387 CG1 ILE B 43 12.090 0.616 -0.118 1.00 0.00 C ATOM 1388 CG2 ILE B 43 10.047 -0.733 0.451 1.00 0.00 C ATOM 1389 CD1 ILE B 43 12.950 -0.104 0.899 1.00 0.00 C ATOM 0 H ILE B 43 11.847 -0.215 -3.172 1.00 0.00 H new ATOM 0 HA ILE B 43 12.149 -2.014 -0.853 1.00 0.00 H new ATOM 0 HB ILE B 43 10.345 0.385 -1.340 1.00 0.00 H new ATOM 0 HG12 ILE B 43 12.720 0.947 -0.944 1.00 0.00 H new ATOM 0 HG13 ILE B 43 11.672 1.511 0.342 1.00 0.00 H new ATOM 0 HG21 ILE B 43 9.668 0.119 1.016 1.00 0.00 H new ATOM 0 HG22 ILE B 43 9.210 -1.290 0.030 1.00 0.00 H new ATOM 0 HG23 ILE B 43 10.619 -1.383 1.114 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.738 0.564 1.248 1.00 0.00 H new ATOM 0 HD12 ILE B 43 12.334 -0.411 1.744 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.398 -0.984 0.438 1.00 0.00 H new ATOM 1401 N SER B 44 10.218 -3.483 -1.484 1.00 0.00 N ATOM 1402 CA SER B 44 9.152 -4.377 -1.904 1.00 0.00 C ATOM 1403 C SER B 44 8.606 -5.163 -0.719 1.00 0.00 C ATOM 1404 O SER B 44 9.310 -5.979 -0.128 1.00 0.00 O ATOM 1405 CB SER B 44 9.664 -5.335 -2.986 1.00 0.00 C ATOM 1406 OG SER B 44 8.652 -6.244 -3.398 1.00 0.00 O ATOM 0 H SER B 44 10.838 -3.867 -0.770 1.00 0.00 H new ATOM 0 HA SER B 44 8.342 -3.776 -2.317 1.00 0.00 H new ATOM 0 HB2 SER B 44 10.012 -4.762 -3.846 1.00 0.00 H new ATOM 0 HB3 SER B 44 10.521 -5.891 -2.605 1.00 0.00 H new ATOM 0 HG SER B 44 9.066 -7.020 -3.830 1.00 0.00 H new ATOM 1412 N HIS B 45 7.355 -4.904 -0.376 1.00 0.00 N ATOM 1413 CA HIS B 45 6.700 -5.592 0.727 1.00 0.00 C ATOM 1414 C HIS B 45 5.382 -6.167 0.267 1.00 0.00 C ATOM 1415 O HIS B 45 4.578 -5.470 -0.347 1.00 0.00 O ATOM 1416 CB HIS B 45 6.452 -4.635 1.899 1.00 0.00 C ATOM 1417 CG HIS B 45 7.687 -4.247 2.648 1.00 0.00 C ATOM 1418 ND1 HIS B 45 8.378 -5.091 3.483 1.00 0.00 N ATOM 1419 CD2 HIS B 45 8.346 -3.063 2.686 1.00 0.00 C ATOM 1420 CE1 HIS B 45 9.409 -4.411 3.997 1.00 0.00 C ATOM 1421 NE2 HIS B 45 9.437 -3.174 3.543 1.00 0.00 N ATOM 0 H HIS B 45 6.768 -4.217 -0.849 1.00 0.00 H new ATOM 0 HA HIS B 45 7.356 -6.395 1.061 1.00 0.00 H new ATOM 0 HB2 HIS B 45 5.972 -3.733 1.521 1.00 0.00 H new ATOM 0 HB3 HIS B 45 5.752 -5.102 2.592 1.00 0.00 H new ATOM 0 HD1 HIS B 45 8.146 -6.065 3.677 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.068 -2.175 2.138 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.125 -4.822 4.693 1.00 0.00 H new ATOM 1429 N MET B 46 5.165 -7.438 0.536 1.00 0.00 N ATOM 1430 CA MET B 46 3.923 -8.066 0.156 1.00 0.00 C ATOM 1431 C MET B 46 2.911 -7.832 1.257 1.00 0.00 C ATOM 1432 O MET B 46 3.274 -7.710 2.425 1.00 0.00 O ATOM 1433 CB MET B 46 4.103 -9.567 -0.097 1.00 0.00 C ATOM 1434 CG MET B 46 4.795 -9.884 -1.413 1.00 0.00 C ATOM 1435 SD MET B 46 4.662 -11.622 -1.878 1.00 0.00 S ATOM 1436 CE MET B 46 2.887 -11.789 -2.067 1.00 0.00 C ATOM 0 H MET B 46 5.828 -8.049 1.012 1.00 0.00 H new ATOM 0 HA MET B 46 3.573 -7.626 -0.778 1.00 0.00 H new ATOM 0 HB2 MET B 46 4.681 -9.998 0.721 1.00 0.00 H new ATOM 0 HB3 MET B 46 3.125 -10.049 -0.085 1.00 0.00 H new ATOM 0 HG2 MET B 46 4.363 -9.268 -2.202 1.00 0.00 H new ATOM 0 HG3 MET B 46 5.848 -9.613 -1.338 1.00 0.00 H new ATOM 0 HE1 MET B 46 2.667 -12.293 -3.008 1.00 0.00 H new ATOM 0 HE2 MET B 46 2.487 -12.375 -1.240 1.00 0.00 H new ATOM 0 HE3 MET B 46 2.427 -10.801 -2.068 1.00 0.00 H new ATOM 1446 N TYR B 47 1.650 -7.742 0.885 1.00 0.00 N ATOM 1447 CA TYR B 47 0.589 -7.520 1.864 1.00 0.00 C ATOM 1448 C TYR B 47 0.545 -8.670 2.865 1.00 0.00 C ATOM 1449 O TYR B 47 0.099 -8.508 3.999 1.00 0.00 O ATOM 1450 CB TYR B 47 -0.770 -7.375 1.172 1.00 0.00 C ATOM 1451 CG TYR B 47 -0.834 -6.231 0.185 1.00 0.00 C ATOM 1452 CD1 TYR B 47 -0.381 -4.965 0.529 1.00 0.00 C ATOM 1453 CD2 TYR B 47 -1.344 -6.420 -1.093 1.00 0.00 C ATOM 1454 CE1 TYR B 47 -0.434 -3.919 -0.373 1.00 0.00 C ATOM 1455 CE2 TYR B 47 -1.400 -5.379 -1.999 1.00 0.00 C ATOM 1456 CZ TYR B 47 -0.944 -4.132 -1.634 1.00 0.00 C ATOM 1457 OH TYR B 47 -0.992 -3.097 -2.538 1.00 0.00 O ATOM 0 H TYR B 47 1.330 -7.818 -0.080 1.00 0.00 H new ATOM 0 HA TYR B 47 0.805 -6.594 2.396 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -1.003 -8.304 0.652 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -1.540 -7.232 1.930 1.00 0.00 H new ATOM 0 HD1 TYR B 47 0.019 -4.794 1.517 1.00 0.00 H new ATOM 0 HD2 TYR B 47 -1.703 -7.397 -1.383 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -0.077 -2.940 -0.090 1.00 0.00 H new ATOM 0 HE2 TYR B 47 -1.800 -5.542 -2.989 1.00 0.00 H new ATOM 0 HH TYR B 47 -0.949 -3.456 -3.449 1.00 0.00 H new ATOM 1467 N ALA B 48 1.062 -9.817 2.439 1.00 0.00 N ATOM 1468 CA ALA B 48 1.087 -11.015 3.262 1.00 0.00 C ATOM 1469 C ALA B 48 2.094 -10.916 4.403 1.00 0.00 C ATOM 1470 O ALA B 48 2.024 -11.693 5.348 1.00 0.00 O ATOM 1471 CB ALA B 48 1.398 -12.230 2.402 1.00 0.00 C ATOM 0 H ALA B 48 1.474 -9.940 1.514 1.00 0.00 H new ATOM 0 HA ALA B 48 0.099 -11.120 3.709 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.415 -13.123 3.027 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.632 -12.338 1.634 1.00 0.00 H new ATOM 0 HB3 ALA B 48 2.371 -12.101 1.928 1.00 0.00 H new ATOM 1477 N ASP B 49 3.021 -9.967 4.319 1.00 0.00 N ATOM 1478 CA ASP B 49 4.033 -9.812 5.362 1.00 0.00 C ATOM 1479 C ASP B 49 3.702 -8.640 6.273 1.00 0.00 C ATOM 1480 O ASP B 49 4.350 -8.441 7.305 1.00 0.00 O ATOM 1481 CB ASP B 49 5.429 -9.565 4.764 1.00 0.00 C ATOM 1482 CG ASP B 49 5.644 -10.196 3.401 1.00 0.00 C ATOM 1483 OD1 ASP B 49 5.907 -9.438 2.437 1.00 0.00 O ATOM 1484 OD2 ASP B 49 5.562 -11.435 3.290 1.00 0.00 O ATOM 0 H ASP B 49 3.094 -9.301 3.550 1.00 0.00 H new ATOM 0 HA ASP B 49 4.036 -10.743 5.930 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.592 -8.490 4.684 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.180 -9.951 5.453 1.00 0.00 H new ATOM 1489 N ILE B 50 2.691 -7.868 5.907 1.00 0.00 N ATOM 1490 CA ILE B 50 2.331 -6.698 6.688 1.00 0.00 C ATOM 1491 C ILE B 50 1.295 -7.029 7.767 1.00 0.00 C ATOM 1492 O ILE B 50 0.209 -7.534 7.478 1.00 0.00 O ATOM 1493 CB ILE B 50 1.798 -5.565 5.790 1.00 0.00 C ATOM 1494 CG1 ILE B 50 2.762 -5.312 4.624 1.00 0.00 C ATOM 1495 CG2 ILE B 50 1.601 -4.298 6.606 1.00 0.00 C ATOM 1496 CD1 ILE B 50 2.223 -4.359 3.579 1.00 0.00 C ATOM 0 H ILE B 50 2.111 -8.029 5.083 1.00 0.00 H new ATOM 0 HA ILE B 50 3.244 -6.360 7.179 1.00 0.00 H new ATOM 0 HB ILE B 50 0.834 -5.865 5.380 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.697 -4.913 5.018 1.00 0.00 H new ATOM 0 HG13 ILE B 50 2.998 -6.263 4.147 1.00 0.00 H new ATOM 0 HG21 ILE B 50 1.224 -3.505 5.961 1.00 0.00 H new ATOM 0 HG22 ILE B 50 0.884 -4.487 7.405 1.00 0.00 H new ATOM 0 HG23 ILE B 50 2.554 -3.992 7.039 1.00 0.00 H new ATOM 0 HD11 ILE B 50 2.962 -4.231 2.788 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.304 -4.765 3.156 1.00 0.00 H new ATOM 0 HD13 ILE B 50 2.014 -3.394 4.040 1.00 0.00 H new ATOM 1508 N LYS B 51 1.645 -6.725 9.011 1.00 0.00 N ATOM 1509 CA LYS B 51 0.773 -6.976 10.155 1.00 0.00 C ATOM 1510 C LYS B 51 -0.315 -5.910 10.235 1.00 0.00 C ATOM 1511 O LYS B 51 -1.498 -6.218 10.330 1.00 0.00 O ATOM 1512 CB LYS B 51 1.599 -6.985 11.446 1.00 0.00 C ATOM 1513 CG LYS B 51 0.780 -7.191 12.712 1.00 0.00 C ATOM 1514 CD LYS B 51 1.569 -6.808 13.958 1.00 0.00 C ATOM 1515 CE LYS B 51 2.707 -7.780 14.226 1.00 0.00 C ATOM 1516 NZ LYS B 51 4.043 -7.136 14.080 1.00 0.00 N ATOM 0 H LYS B 51 2.539 -6.299 9.256 1.00 0.00 H new ATOM 0 HA LYS B 51 0.297 -7.949 10.030 1.00 0.00 H new ATOM 0 HB2 LYS B 51 2.348 -7.774 11.379 1.00 0.00 H new ATOM 0 HB3 LYS B 51 2.138 -6.041 11.525 1.00 0.00 H new ATOM 0 HG2 LYS B 51 -0.130 -6.593 12.659 1.00 0.00 H new ATOM 0 HG3 LYS B 51 0.473 -8.234 12.782 1.00 0.00 H new ATOM 0 HD2 LYS B 51 1.971 -5.802 13.839 1.00 0.00 H new ATOM 0 HD3 LYS B 51 0.901 -6.785 14.819 1.00 0.00 H new ATOM 0 HE2 LYS B 51 2.608 -8.184 15.234 1.00 0.00 H new ATOM 0 HE3 LYS B 51 2.634 -8.621 13.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 4.788 -7.854 14.188 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 4.117 -6.699 13.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 4.158 -6.405 14.811 1.00 0.00 H new ATOM 1530 N CYS B 52 0.106 -4.661 10.191 1.00 0.00 N ATOM 1531 CA CYS B 52 -0.800 -3.524 10.246 1.00 0.00 C ATOM 1532 C CYS B 52 -0.077 -2.321 9.677 1.00 0.00 C ATOM 1533 O CYS B 52 1.103 -2.425 9.332 1.00 0.00 O ATOM 1534 CB CYS B 52 -1.246 -3.254 11.683 1.00 0.00 C ATOM 1535 SG CYS B 52 0.056 -3.497 12.915 1.00 0.00 S ATOM 0 H CYS B 52 1.090 -4.402 10.116 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.696 -3.734 9.662 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -1.611 -2.229 11.753 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -2.084 -3.908 11.921 1.00 0.00 H new ATOM 0 HG CYS B 52 0.195 -2.413 13.619 1.00 0.00 H new ATOM 1541 N GLN B 53 -0.738 -1.184 9.573 1.00 0.00 N ATOM 1542 CA GLN B 53 -0.089 -0.032 9.030 1.00 0.00 C ATOM 1543 C GLN B 53 -0.348 1.134 9.960 1.00 0.00 C ATOM 1544 O GLN B 53 -1.152 1.011 10.863 1.00 0.00 O ATOM 1545 CB GLN B 53 -0.632 0.204 7.616 1.00 0.00 C ATOM 1546 CG GLN B 53 -2.140 0.096 7.539 1.00 0.00 C ATOM 1547 CD GLN B 53 -2.733 0.927 6.427 1.00 0.00 C ATOM 1548 OE1 GLN B 53 -2.137 1.898 5.969 1.00 0.00 O ATOM 1549 NE2 GLN B 53 -3.931 0.568 6.008 1.00 0.00 N ATOM 0 H GLN B 53 -1.708 -1.045 9.855 1.00 0.00 H new ATOM 0 HA GLN B 53 0.990 -0.162 8.951 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -0.326 1.193 7.275 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.186 -0.521 6.935 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -2.417 -0.948 7.393 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -2.571 0.410 8.490 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -4.391 -0.246 6.416 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -4.397 1.104 5.276 1.00 0.00 H new ATOM 1558 N LYS B 54 0.395 2.208 9.812 1.00 0.00 N ATOM 1559 CA LYS B 54 0.200 3.409 10.615 1.00 0.00 C ATOM 1560 C LYS B 54 0.435 4.594 9.715 1.00 0.00 C ATOM 1561 O LYS B 54 0.979 4.445 8.624 1.00 0.00 O ATOM 1562 CB LYS B 54 1.160 3.498 11.807 1.00 0.00 C ATOM 1563 CG LYS B 54 1.272 2.239 12.636 1.00 0.00 C ATOM 1564 CD LYS B 54 1.187 2.576 14.110 1.00 0.00 C ATOM 1565 CE LYS B 54 2.320 1.958 14.891 1.00 0.00 C ATOM 1566 NZ LYS B 54 2.123 0.501 15.112 1.00 0.00 N ATOM 0 H LYS B 54 1.153 2.280 9.133 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.810 3.386 11.024 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.151 3.760 11.437 1.00 0.00 H new ATOM 0 HB3 LYS B 54 0.836 4.313 12.454 1.00 0.00 H new ATOM 0 HG2 LYS B 54 0.475 1.545 12.367 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.216 1.737 12.424 1.00 0.00 H new ATOM 0 HD2 LYS B 54 1.205 3.658 14.237 1.00 0.00 H new ATOM 0 HD3 LYS B 54 0.236 2.224 14.509 1.00 0.00 H new ATOM 0 HE2 LYS B 54 3.257 2.119 14.357 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.411 2.460 15.854 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 3.019 0.072 15.419 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 1.400 0.356 15.846 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.811 0.055 14.226 1.00 0.00 H new ATOM 1580 N ILE B 55 0.021 5.753 10.146 1.00 0.00 N ATOM 1581 CA ILE B 55 0.202 6.954 9.340 1.00 0.00 C ATOM 1582 C ILE B 55 0.619 8.119 10.196 1.00 0.00 C ATOM 1583 O ILE B 55 0.025 8.319 11.224 1.00 0.00 O ATOM 1584 CB ILE B 55 -1.131 7.349 8.669 1.00 0.00 C ATOM 1585 CG1 ILE B 55 -2.250 7.137 9.679 1.00 0.00 C ATOM 1586 CG2 ILE B 55 -1.375 6.545 7.406 1.00 0.00 C ATOM 1587 CD1 ILE B 55 -3.637 7.504 9.227 1.00 0.00 C ATOM 0 H ILE B 55 -0.442 5.904 11.042 1.00 0.00 H new ATOM 0 HA ILE B 55 0.969 6.731 8.598 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.094 8.396 8.368 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -2.252 6.087 9.971 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -2.018 7.716 10.573 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.322 6.848 6.959 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.566 6.724 6.698 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.413 5.484 7.652 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.346 7.309 10.032 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.667 8.562 8.966 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -3.905 6.908 8.355 1.00 0.00 H new ATOM 1599 N SER B 56 1.639 8.876 9.820 1.00 0.00 N ATOM 1600 CA SER B 56 1.966 10.035 10.620 1.00 0.00 C ATOM 1601 C SER B 56 0.810 10.982 10.398 1.00 0.00 C ATOM 1602 O SER B 56 0.638 11.507 9.276 1.00 0.00 O ATOM 1603 CB SER B 56 3.326 10.652 10.278 1.00 0.00 C ATOM 1604 OG SER B 56 3.377 11.121 8.958 1.00 0.00 O ATOM 0 H SER B 56 2.228 8.716 9.003 1.00 0.00 H new ATOM 0 HA SER B 56 2.084 9.775 11.672 1.00 0.00 H new ATOM 0 HB2 SER B 56 3.532 11.475 10.962 1.00 0.00 H new ATOM 0 HB3 SER B 56 4.109 9.908 10.428 1.00 0.00 H new ATOM 0 HG SER B 56 3.634 12.067 8.957 1.00 0.00 H new ATOM 1610 N PRO B 57 -0.006 11.130 11.473 1.00 0.00 N ATOM 1611 CA PRO B 57 -1.267 11.878 11.496 1.00 0.00 C ATOM 1612 C PRO B 57 -1.177 13.306 10.984 1.00 0.00 C ATOM 1613 O PRO B 57 -0.090 13.876 10.833 1.00 0.00 O ATOM 1614 CB PRO B 57 -1.651 11.913 12.983 1.00 0.00 C ATOM 1615 CG PRO B 57 -0.413 11.546 13.714 1.00 0.00 C ATOM 1616 CD PRO B 57 0.306 10.609 12.812 1.00 0.00 C ATOM 0 HA PRO B 57 -1.985 11.392 10.835 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -2.002 12.902 13.276 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -2.458 11.212 13.198 1.00 0.00 H new ATOM 0 HG2 PRO B 57 0.192 12.426 13.931 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -0.644 11.074 14.669 1.00 0.00 H new ATOM 0 HD2 PRO B 57 1.379 10.608 13.004 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -0.041 9.583 12.936 1.00 0.00 H new ATOM 1624 N GLU B 58 -2.345 13.876 10.728 1.00 0.00 N ATOM 1625 CA GLU B 58 -2.446 15.246 10.283 1.00 0.00 C ATOM 1626 C GLU B 58 -1.887 16.140 11.385 1.00 0.00 C ATOM 1627 O GLU B 58 -2.114 15.890 12.570 1.00 0.00 O ATOM 1628 CB GLU B 58 -3.904 15.619 9.971 1.00 0.00 C ATOM 1629 CG GLU B 58 -4.834 14.426 9.760 1.00 0.00 C ATOM 1630 CD GLU B 58 -4.419 13.527 8.606 1.00 0.00 C ATOM 1631 OE1 GLU B 58 -4.693 13.875 7.441 1.00 0.00 O ATOM 1632 OE2 GLU B 58 -3.824 12.459 8.866 1.00 0.00 O ATOM 0 H GLU B 58 -3.242 13.400 10.824 1.00 0.00 H new ATOM 0 HA GLU B 58 -1.877 15.379 9.363 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -4.293 16.226 10.789 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -3.923 16.240 9.076 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -4.867 13.836 10.676 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -5.845 14.792 9.579 1.00 0.00 H new ATOM 1639 N GLY B 59 -1.180 17.178 11.001 1.00 0.00 N ATOM 1640 CA GLY B 59 -0.564 18.054 11.975 1.00 0.00 C ATOM 1641 C GLY B 59 0.941 17.970 11.877 1.00 0.00 C ATOM 1642 O GLY B 59 1.641 18.952 12.121 1.00 0.00 O ATOM 0 H GLY B 59 -1.017 17.437 10.028 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -0.889 19.081 11.808 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -0.886 17.777 12.979 1.00 0.00 H new ATOM 1646 N LYS B 60 1.446 16.790 11.522 1.00 0.00 N ATOM 1647 CA LYS B 60 2.874 16.621 11.311 1.00 0.00 C ATOM 1648 C LYS B 60 3.244 17.390 10.052 1.00 0.00 C ATOM 1649 O LYS B 60 2.426 17.508 9.139 1.00 0.00 O ATOM 1650 CB LYS B 60 3.272 15.143 11.129 1.00 0.00 C ATOM 1651 CG LYS B 60 3.667 14.390 12.401 1.00 0.00 C ATOM 1652 CD LYS B 60 4.591 13.227 12.055 1.00 0.00 C ATOM 1653 CE LYS B 60 5.489 12.826 13.213 1.00 0.00 C ATOM 1654 NZ LYS B 60 6.516 13.848 13.533 1.00 0.00 N ATOM 0 H LYS B 60 0.890 15.947 11.377 1.00 0.00 H new ATOM 0 HA LYS B 60 3.402 16.991 12.190 1.00 0.00 H new ATOM 0 HB2 LYS B 60 2.437 14.618 10.665 1.00 0.00 H new ATOM 0 HB3 LYS B 60 4.107 15.096 10.430 1.00 0.00 H new ATOM 0 HG2 LYS B 60 4.166 15.067 13.094 1.00 0.00 H new ATOM 0 HG3 LYS B 60 2.775 14.018 12.905 1.00 0.00 H new ATOM 0 HD2 LYS B 60 3.991 12.369 11.752 1.00 0.00 H new ATOM 0 HD3 LYS B 60 5.209 13.501 11.200 1.00 0.00 H new ATOM 0 HE2 LYS B 60 4.875 12.647 14.096 1.00 0.00 H new ATOM 0 HE3 LYS B 60 5.984 11.885 12.973 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 7.272 13.415 14.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 6.918 14.225 12.651 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 6.079 14.622 14.073 1.00 0.00 H new ATOM 1668 N ALA B 61 4.459 17.906 9.990 1.00 0.00 N ATOM 1669 CA ALA B 61 4.902 18.649 8.815 1.00 0.00 C ATOM 1670 C ALA B 61 5.140 17.699 7.647 1.00 0.00 C ATOM 1671 O ALA B 61 5.516 18.114 6.554 1.00 0.00 O ATOM 1672 CB ALA B 61 6.160 19.445 9.129 1.00 0.00 C ATOM 0 H ALA B 61 5.155 17.827 10.732 1.00 0.00 H new ATOM 0 HA ALA B 61 4.118 19.352 8.532 1.00 0.00 H new ATOM 0 HB1 ALA B 61 6.475 19.992 8.241 1.00 0.00 H new ATOM 0 HB2 ALA B 61 5.953 20.149 9.935 1.00 0.00 H new ATOM 0 HB3 ALA B 61 6.954 18.764 9.437 1.00 0.00 H new ATOM 1678 N LYS B 62 4.913 16.420 7.902 1.00 0.00 N ATOM 1679 CA LYS B 62 5.091 15.389 6.905 1.00 0.00 C ATOM 1680 C LYS B 62 4.025 14.308 7.067 1.00 0.00 C ATOM 1681 O LYS B 62 4.000 13.591 8.067 1.00 0.00 O ATOM 1682 CB LYS B 62 6.489 14.775 7.025 1.00 0.00 C ATOM 1683 CG LYS B 62 6.924 14.525 8.460 1.00 0.00 C ATOM 1684 CD LYS B 62 7.983 15.516 8.906 1.00 0.00 C ATOM 1685 CE LYS B 62 9.380 14.968 8.682 1.00 0.00 C ATOM 1686 NZ LYS B 62 10.251 15.182 9.867 1.00 0.00 N ATOM 0 H LYS B 62 4.600 16.072 8.808 1.00 0.00 H new ATOM 0 HA LYS B 62 4.988 15.836 5.916 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.511 13.832 6.478 1.00 0.00 H new ATOM 0 HB3 LYS B 62 7.210 15.438 6.546 1.00 0.00 H new ATOM 0 HG2 LYS B 62 6.059 14.595 9.120 1.00 0.00 H new ATOM 0 HG3 LYS B 62 7.313 13.511 8.551 1.00 0.00 H new ATOM 0 HD2 LYS B 62 7.864 16.450 8.357 1.00 0.00 H new ATOM 0 HD3 LYS B 62 7.846 15.747 9.962 1.00 0.00 H new ATOM 0 HE2 LYS B 62 9.322 13.902 8.461 1.00 0.00 H new ATOM 0 HE3 LYS B 62 9.825 15.450 7.812 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 11.197 14.795 9.677 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 10.327 16.201 10.063 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 9.839 14.701 10.692 1.00 0.00 H new ATOM 1700 N ILE B 63 3.121 14.233 6.103 1.00 0.00 N ATOM 1701 CA ILE B 63 2.069 13.226 6.113 1.00 0.00 C ATOM 1702 C ILE B 63 2.674 11.923 5.610 1.00 0.00 C ATOM 1703 O ILE B 63 3.017 11.812 4.431 1.00 0.00 O ATOM 1704 CB ILE B 63 0.885 13.665 5.226 1.00 0.00 C ATOM 1705 CG1 ILE B 63 0.369 15.029 5.692 1.00 0.00 C ATOM 1706 CG2 ILE B 63 -0.233 12.637 5.264 1.00 0.00 C ATOM 1707 CD1 ILE B 63 0.180 16.025 4.570 1.00 0.00 C ATOM 0 H ILE B 63 3.094 14.861 5.299 1.00 0.00 H new ATOM 0 HA ILE B 63 1.679 13.093 7.122 1.00 0.00 H new ATOM 0 HB ILE B 63 1.233 13.745 4.196 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -0.582 14.891 6.207 1.00 0.00 H new ATOM 0 HG13 ILE B 63 1.068 15.443 6.419 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.055 12.970 4.631 1.00 0.00 H new ATOM 0 HG22 ILE B 63 0.140 11.680 4.900 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -0.587 12.522 6.288 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -0.187 16.967 4.978 1.00 0.00 H new ATOM 0 HD12 ILE B 63 1.133 16.194 4.069 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -0.542 15.633 3.854 1.00 0.00 H new ATOM 1719 N GLN B 64 2.825 10.936 6.488 1.00 0.00 N ATOM 1720 CA GLN B 64 3.500 9.699 6.088 1.00 0.00 C ATOM 1721 C GLN B 64 2.740 8.435 6.458 1.00 0.00 C ATOM 1722 O GLN B 64 1.746 8.471 7.173 1.00 0.00 O ATOM 1723 CB GLN B 64 4.889 9.646 6.738 1.00 0.00 C ATOM 1724 CG GLN B 64 5.756 10.858 6.445 1.00 0.00 C ATOM 1725 CD GLN B 64 6.782 11.139 7.529 1.00 0.00 C ATOM 1726 OE1 GLN B 64 7.920 11.506 7.239 1.00 0.00 O ATOM 1727 NE2 GLN B 64 6.379 11.001 8.780 1.00 0.00 N ATOM 0 H GLN B 64 2.501 10.961 7.455 1.00 0.00 H new ATOM 0 HA GLN B 64 3.564 9.724 5.000 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.770 9.550 7.817 1.00 0.00 H new ATOM 0 HB3 GLN B 64 5.406 8.751 6.393 1.00 0.00 H new ATOM 0 HG2 GLN B 64 6.272 10.706 5.497 1.00 0.00 H new ATOM 0 HG3 GLN B 64 5.117 11.733 6.324 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.427 10.694 8.978 1.00 0.00 H new ATOM 0 HE22 GLN B 64 7.020 11.201 9.547 1.00 0.00 H new ATOM 1736 N LEU B 65 3.218 7.320 5.918 1.00 0.00 N ATOM 1737 CA LEU B 65 2.659 6.006 6.191 1.00 0.00 C ATOM 1738 C LEU B 65 3.756 5.096 6.745 1.00 0.00 C ATOM 1739 O LEU B 65 4.915 5.206 6.345 1.00 0.00 O ATOM 1740 CB LEU B 65 2.094 5.376 4.919 1.00 0.00 C ATOM 1741 CG LEU B 65 1.276 4.101 5.145 1.00 0.00 C ATOM 1742 CD1 LEU B 65 -0.191 4.421 5.336 1.00 0.00 C ATOM 1743 CD2 LEU B 65 1.459 3.128 4.005 1.00 0.00 C ATOM 0 H LEU B 65 4.009 7.305 5.275 1.00 0.00 H new ATOM 0 HA LEU B 65 1.853 6.120 6.916 1.00 0.00 H new ATOM 0 HB2 LEU B 65 1.466 6.110 4.415 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.920 5.147 4.246 1.00 0.00 H new ATOM 0 HG LEU B 65 1.645 3.632 6.057 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.747 3.497 5.494 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -0.312 5.070 6.203 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -0.572 4.926 4.448 1.00 0.00 H new ATOM 0 HD21 LEU B 65 0.867 2.232 4.192 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.131 3.592 3.075 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.512 2.857 3.924 1.00 0.00 H new ATOM 1755 N GLN B 66 3.392 4.222 7.667 1.00 0.00 N ATOM 1756 CA GLN B 66 4.329 3.288 8.265 1.00 0.00 C ATOM 1757 C GLN B 66 3.790 1.868 8.168 1.00 0.00 C ATOM 1758 O GLN B 66 2.714 1.572 8.678 1.00 0.00 O ATOM 1759 CB GLN B 66 4.564 3.653 9.728 1.00 0.00 C ATOM 1760 CG GLN B 66 5.670 2.851 10.394 1.00 0.00 C ATOM 1761 CD GLN B 66 6.052 3.404 11.751 1.00 0.00 C ATOM 1762 OE1 GLN B 66 5.444 3.064 12.768 1.00 0.00 O ATOM 1763 NE2 GLN B 66 7.065 4.256 11.775 1.00 0.00 N ATOM 0 H GLN B 66 2.439 4.140 8.022 1.00 0.00 H new ATOM 0 HA GLN B 66 5.274 3.344 7.725 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.808 4.713 9.793 1.00 0.00 H new ATOM 0 HB3 GLN B 66 3.637 3.505 10.282 1.00 0.00 H new ATOM 0 HG2 GLN B 66 5.347 1.816 10.505 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.548 2.843 9.748 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.539 4.509 10.908 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.371 4.659 12.660 1.00 0.00 H new ATOM 1772 N LEU B 67 4.528 0.998 7.506 1.00 0.00 N ATOM 1773 CA LEU B 67 4.114 -0.389 7.358 1.00 0.00 C ATOM 1774 C LEU B 67 4.749 -1.265 8.421 1.00 0.00 C ATOM 1775 O LEU B 67 5.956 -1.477 8.407 1.00 0.00 O ATOM 1776 CB LEU B 67 4.505 -0.919 5.981 1.00 0.00 C ATOM 1777 CG LEU B 67 3.644 -0.428 4.825 1.00 0.00 C ATOM 1778 CD1 LEU B 67 4.099 -1.073 3.528 1.00 0.00 C ATOM 1779 CD2 LEU B 67 2.178 -0.731 5.089 1.00 0.00 C ATOM 0 H LEU B 67 5.418 1.224 7.061 1.00 0.00 H new ATOM 0 HA LEU B 67 3.030 -0.421 7.470 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.541 -0.642 5.784 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.465 -2.008 6.005 1.00 0.00 H new ATOM 0 HG LEU B 67 3.757 0.652 4.735 1.00 0.00 H new ATOM 0 HD11 LEU B 67 3.478 -0.716 2.707 1.00 0.00 H new ATOM 0 HD12 LEU B 67 5.139 -0.811 3.337 1.00 0.00 H new ATOM 0 HD13 LEU B 67 4.007 -2.156 3.608 1.00 0.00 H new ATOM 0 HD21 LEU B 67 1.576 -0.374 4.253 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.043 -1.807 5.199 1.00 0.00 H new ATOM 0 HD23 LEU B 67 1.862 -0.230 6.004 1.00 0.00 H new ATOM 1791 N VAL B 68 3.943 -1.765 9.346 1.00 0.00 N ATOM 1792 CA VAL B 68 4.456 -2.637 10.389 1.00 0.00 C ATOM 1793 C VAL B 68 4.281 -4.083 9.964 1.00 0.00 C ATOM 1794 O VAL B 68 3.162 -4.593 9.893 1.00 0.00 O ATOM 1795 CB VAL B 68 3.767 -2.413 11.750 1.00 0.00 C ATOM 1796 CG1 VAL B 68 4.294 -3.395 12.785 1.00 0.00 C ATOM 1797 CG2 VAL B 68 3.991 -0.992 12.222 1.00 0.00 C ATOM 0 H VAL B 68 2.940 -1.583 9.395 1.00 0.00 H new ATOM 0 HA VAL B 68 5.511 -2.398 10.522 1.00 0.00 H new ATOM 0 HB VAL B 68 2.697 -2.581 11.626 1.00 0.00 H new ATOM 0 HG11 VAL B 68 3.796 -3.221 13.739 1.00 0.00 H new ATOM 0 HG12 VAL B 68 4.097 -4.414 12.453 1.00 0.00 H new ATOM 0 HG13 VAL B 68 5.368 -3.255 12.906 1.00 0.00 H new ATOM 0 HG21 VAL B 68 3.500 -0.846 13.184 1.00 0.00 H new ATOM 0 HG22 VAL B 68 5.060 -0.808 12.329 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.575 -0.297 11.493 1.00 0.00 H new ATOM 1807 N LEU B 69 5.391 -4.736 9.681 1.00 0.00 N ATOM 1808 CA LEU B 69 5.365 -6.112 9.235 1.00 0.00 C ATOM 1809 C LEU B 69 5.063 -7.064 10.393 1.00 0.00 C ATOM 1810 O LEU B 69 4.963 -6.644 11.552 1.00 0.00 O ATOM 1811 CB LEU B 69 6.672 -6.482 8.544 1.00 0.00 C ATOM 1812 CG LEU B 69 7.051 -5.627 7.329 1.00 0.00 C ATOM 1813 CD1 LEU B 69 7.841 -6.458 6.345 1.00 0.00 C ATOM 1814 CD2 LEU B 69 5.839 -5.007 6.655 1.00 0.00 C ATOM 0 H LEU B 69 6.325 -4.332 9.753 1.00 0.00 H new ATOM 0 HA LEU B 69 4.559 -6.214 8.508 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.478 -6.418 9.275 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.611 -7.523 8.227 1.00 0.00 H new ATOM 0 HG LEU B 69 7.667 -4.802 7.686 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.108 -5.846 5.484 1.00 0.00 H new ATOM 0 HD12 LEU B 69 8.749 -6.825 6.825 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.237 -7.304 6.016 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.162 -4.412 5.801 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.169 -5.796 6.314 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.315 -4.367 7.365 1.00 0.00 H new ATOM 1826 N HIS B 70 4.909 -8.342 10.074 1.00 0.00 N ATOM 1827 CA HIS B 70 4.575 -9.364 11.065 1.00 0.00 C ATOM 1828 C HIS B 70 5.614 -9.496 12.178 1.00 0.00 C ATOM 1829 O HIS B 70 5.249 -9.537 13.354 1.00 0.00 O ATOM 1830 CB HIS B 70 4.366 -10.718 10.387 1.00 0.00 C ATOM 1831 CG HIS B 70 3.100 -10.795 9.593 1.00 0.00 C ATOM 1832 ND1 HIS B 70 1.948 -10.111 9.912 1.00 0.00 N ATOM 1833 CD2 HIS B 70 2.819 -11.486 8.464 1.00 0.00 C ATOM 1834 CE1 HIS B 70 1.027 -10.402 8.986 1.00 0.00 C ATOM 1835 NE2 HIS B 70 1.504 -11.234 8.090 1.00 0.00 N ATOM 0 H HIS B 70 5.011 -8.702 9.125 1.00 0.00 H new ATOM 0 HA HIS B 70 3.649 -9.036 11.537 1.00 0.00 H new ATOM 0 HB2 HIS B 70 5.211 -10.921 9.730 1.00 0.00 H new ATOM 0 HB3 HIS B 70 4.358 -11.499 11.147 1.00 0.00 H new ATOM 0 HD2 HIS B 70 3.507 -12.131 7.937 1.00 0.00 H new ATOM 0 HE1 HIS B 70 0.023 -10.004 8.977 1.00 0.00 H new ATOM 0 HE2 HIS B 70 1.011 -11.617 7.284 1.00 0.00 H new ATOM 1843 N ALA B 71 6.891 -9.536 11.825 1.00 0.00 N ATOM 1844 CA ALA B 71 7.950 -9.692 12.824 1.00 0.00 C ATOM 1845 C ALA B 71 8.109 -8.437 13.679 1.00 0.00 C ATOM 1846 O ALA B 71 8.570 -8.502 14.817 1.00 0.00 O ATOM 1847 CB ALA B 71 9.267 -10.042 12.147 1.00 0.00 C ATOM 0 H ALA B 71 7.222 -9.464 10.863 1.00 0.00 H new ATOM 0 HA ALA B 71 7.662 -10.508 13.487 1.00 0.00 H new ATOM 0 HB1 ALA B 71 10.045 -10.155 12.902 1.00 0.00 H new ATOM 0 HB2 ALA B 71 9.156 -10.977 11.597 1.00 0.00 H new ATOM 0 HB3 ALA B 71 9.544 -9.245 11.456 1.00 0.00 H new ATOM 1853 N GLY B 72 7.689 -7.309 13.137 1.00 0.00 N ATOM 1854 CA GLY B 72 7.808 -6.048 13.845 1.00 0.00 C ATOM 1855 C GLY B 72 8.675 -5.094 13.066 1.00 0.00 C ATOM 1856 O GLY B 72 9.334 -4.216 13.620 1.00 0.00 O ATOM 0 H GLY B 72 7.264 -7.240 12.212 1.00 0.00 H new ATOM 0 HA2 GLY B 72 6.820 -5.613 13.996 1.00 0.00 H new ATOM 0 HA3 GLY B 72 8.236 -6.216 14.833 1.00 0.00 H new ATOM 1860 N ASP B 73 8.637 -5.278 11.762 1.00 0.00 N ATOM 1861 CA ASP B 73 9.406 -4.493 10.822 1.00 0.00 C ATOM 1862 C ASP B 73 8.605 -3.263 10.464 1.00 0.00 C ATOM 1863 O ASP B 73 7.390 -3.254 10.650 1.00 0.00 O ATOM 1864 CB ASP B 73 9.681 -5.324 9.564 1.00 0.00 C ATOM 1865 CG ASP B 73 9.906 -6.796 9.865 1.00 0.00 C ATOM 1866 OD1 ASP B 73 8.917 -7.495 10.206 1.00 0.00 O ATOM 1867 OD2 ASP B 73 11.058 -7.257 9.756 1.00 0.00 O ATOM 0 H ASP B 73 8.059 -5.992 11.319 1.00 0.00 H new ATOM 0 HA ASP B 73 10.359 -4.200 11.262 1.00 0.00 H new ATOM 0 HB2 ASP B 73 8.841 -5.223 8.877 1.00 0.00 H new ATOM 0 HB3 ASP B 73 10.558 -4.924 9.055 1.00 0.00 H new ATOM 1872 N THR B 74 9.251 -2.228 9.962 1.00 0.00 N ATOM 1873 CA THR B 74 8.532 -1.019 9.612 1.00 0.00 C ATOM 1874 C THR B 74 9.147 -0.310 8.412 1.00 0.00 C ATOM 1875 O THR B 74 10.366 -0.304 8.233 1.00 0.00 O ATOM 1876 CB THR B 74 8.485 -0.041 10.802 1.00 0.00 C ATOM 1877 OG1 THR B 74 9.716 -0.104 11.534 1.00 0.00 O ATOM 1878 CG2 THR B 74 7.330 -0.354 11.735 1.00 0.00 C ATOM 0 H THR B 74 10.256 -2.199 9.790 1.00 0.00 H new ATOM 0 HA THR B 74 7.520 -1.329 9.349 1.00 0.00 H new ATOM 0 HB THR B 74 8.340 0.962 10.401 1.00 0.00 H new ATOM 0 HG1 THR B 74 9.681 0.521 12.288 1.00 0.00 H new ATOM 0 HG21 THR B 74 7.328 0.356 12.562 1.00 0.00 H new ATOM 0 HG22 THR B 74 6.390 -0.277 11.189 1.00 0.00 H new ATOM 0 HG23 THR B 74 7.441 -1.366 12.125 1.00 0.00 H new ATOM 1886 N THR B 75 8.283 0.261 7.588 1.00 0.00 N ATOM 1887 CA THR B 75 8.703 1.003 6.415 1.00 0.00 C ATOM 1888 C THR B 75 8.002 2.358 6.401 1.00 0.00 C ATOM 1889 O THR B 75 6.773 2.424 6.494 1.00 0.00 O ATOM 1890 CB THR B 75 8.360 0.231 5.131 1.00 0.00 C ATOM 1891 OG1 THR B 75 8.387 -1.180 5.388 1.00 0.00 O ATOM 1892 CG2 THR B 75 9.343 0.567 4.022 1.00 0.00 C ATOM 0 H THR B 75 7.272 0.222 7.715 1.00 0.00 H new ATOM 0 HA THR B 75 9.783 1.143 6.455 1.00 0.00 H new ATOM 0 HB THR B 75 7.360 0.524 4.811 1.00 0.00 H new ATOM 0 HG1 THR B 75 8.914 -1.629 4.694 1.00 0.00 H new ATOM 0 HG21 THR B 75 9.081 0.009 3.123 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.302 1.636 3.811 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.351 0.297 4.336 1.00 0.00 H new ATOM 1900 N ASN B 76 8.774 3.431 6.297 1.00 0.00 N ATOM 1901 CA ASN B 76 8.213 4.781 6.300 1.00 0.00 C ATOM 1902 C ASN B 76 8.114 5.373 4.904 1.00 0.00 C ATOM 1903 O ASN B 76 9.088 5.403 4.158 1.00 0.00 O ATOM 1904 CB ASN B 76 9.050 5.711 7.176 1.00 0.00 C ATOM 1905 CG ASN B 76 8.573 5.754 8.611 1.00 0.00 C ATOM 1906 OD1 ASN B 76 8.012 4.789 9.132 1.00 0.00 O ATOM 1907 ND2 ASN B 76 8.787 6.884 9.259 1.00 0.00 N ATOM 0 H ASN B 76 9.790 3.396 6.209 1.00 0.00 H new ATOM 0 HA ASN B 76 7.204 4.694 6.704 1.00 0.00 H new ATOM 0 HB2 ASN B 76 10.090 5.385 7.154 1.00 0.00 H new ATOM 0 HB3 ASN B 76 9.022 6.718 6.759 1.00 0.00 H new ATOM 0 HD21 ASN B 76 8.484 6.981 10.228 1.00 0.00 H new ATOM 0 HD22 ASN B 76 9.255 7.660 8.791 1.00 0.00 H new ATOM 1914 N PHE B 77 6.929 5.855 4.566 1.00 0.00 N ATOM 1915 CA PHE B 77 6.687 6.471 3.270 1.00 0.00 C ATOM 1916 C PHE B 77 6.137 7.880 3.457 1.00 0.00 C ATOM 1917 O PHE B 77 4.983 8.059 3.844 1.00 0.00 O ATOM 1918 CB PHE B 77 5.715 5.624 2.447 1.00 0.00 C ATOM 1919 CG PHE B 77 6.243 4.255 2.131 1.00 0.00 C ATOM 1920 CD1 PHE B 77 5.565 3.122 2.549 1.00 0.00 C ATOM 1921 CD2 PHE B 77 7.421 4.102 1.418 1.00 0.00 C ATOM 1922 CE1 PHE B 77 6.052 1.861 2.262 1.00 0.00 C ATOM 1923 CE2 PHE B 77 7.913 2.845 1.128 1.00 0.00 C ATOM 1924 CZ PHE B 77 7.228 1.723 1.550 1.00 0.00 C ATOM 0 H PHE B 77 6.113 5.831 5.177 1.00 0.00 H new ATOM 0 HA PHE B 77 7.632 6.531 2.729 1.00 0.00 H new ATOM 0 HB2 PHE B 77 4.776 5.527 2.993 1.00 0.00 H new ATOM 0 HB3 PHE B 77 5.490 6.143 1.515 1.00 0.00 H new ATOM 0 HD1 PHE B 77 4.645 3.225 3.106 1.00 0.00 H new ATOM 0 HD2 PHE B 77 7.961 4.976 1.085 1.00 0.00 H new ATOM 0 HE1 PHE B 77 5.514 0.985 2.594 1.00 0.00 H new ATOM 0 HE2 PHE B 77 8.833 2.740 0.572 1.00 0.00 H new ATOM 0 HZ PHE B 77 7.611 0.739 1.324 1.00 0.00 H new ATOM 1934 N HIS B 78 6.978 8.872 3.201 1.00 0.00 N ATOM 1935 CA HIS B 78 6.598 10.273 3.343 1.00 0.00 C ATOM 1936 C HIS B 78 6.034 10.810 2.040 1.00 0.00 C ATOM 1937 O HIS B 78 6.720 10.833 1.028 1.00 0.00 O ATOM 1938 CB HIS B 78 7.825 11.095 3.770 1.00 0.00 C ATOM 1939 CG HIS B 78 7.638 12.590 3.778 1.00 0.00 C ATOM 1940 ND1 HIS B 78 8.687 13.485 3.784 1.00 0.00 N ATOM 1941 CD2 HIS B 78 6.509 13.345 3.773 1.00 0.00 C ATOM 1942 CE1 HIS B 78 8.177 14.721 3.779 1.00 0.00 C ATOM 1943 NE2 HIS B 78 6.858 14.692 3.771 1.00 0.00 N ATOM 0 H HIS B 78 7.939 8.731 2.890 1.00 0.00 H new ATOM 0 HA HIS B 78 5.824 10.354 4.106 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.121 10.779 4.770 1.00 0.00 H new ATOM 0 HB3 HIS B 78 8.652 10.854 3.102 1.00 0.00 H new ATOM 0 HD2 HIS B 78 5.500 12.961 3.771 1.00 0.00 H new ATOM 0 HE1 HIS B 78 8.768 15.625 3.781 1.00 0.00 H new ATOM 0 HE2 HIS B 78 6.225 15.492 3.765 1.00 0.00 H new ATOM 1951 N PHE B 79 4.793 11.252 2.070 1.00 0.00 N ATOM 1952 CA PHE B 79 4.167 11.804 0.885 1.00 0.00 C ATOM 1953 C PHE B 79 4.593 13.259 0.727 1.00 0.00 C ATOM 1954 O PHE B 79 3.907 14.177 1.175 1.00 0.00 O ATOM 1955 CB PHE B 79 2.644 11.676 0.978 1.00 0.00 C ATOM 1956 CG PHE B 79 2.176 10.248 1.063 1.00 0.00 C ATOM 1957 CD1 PHE B 79 1.765 9.573 -0.073 1.00 0.00 C ATOM 1958 CD2 PHE B 79 2.156 9.580 2.278 1.00 0.00 C ATOM 1959 CE1 PHE B 79 1.341 8.259 0.000 1.00 0.00 C ATOM 1960 CE2 PHE B 79 1.732 8.267 2.356 1.00 0.00 C ATOM 1961 CZ PHE B 79 1.324 7.606 1.216 1.00 0.00 C ATOM 0 H PHE B 79 4.199 11.240 2.899 1.00 0.00 H new ATOM 0 HA PHE B 79 4.489 11.247 0.005 1.00 0.00 H new ATOM 0 HB2 PHE B 79 2.292 12.220 1.855 1.00 0.00 H new ATOM 0 HB3 PHE B 79 2.192 12.149 0.106 1.00 0.00 H new ATOM 0 HD1 PHE B 79 1.776 10.078 -1.027 1.00 0.00 H new ATOM 0 HD2 PHE B 79 2.475 10.092 3.174 1.00 0.00 H new ATOM 0 HE1 PHE B 79 1.023 7.744 -0.894 1.00 0.00 H new ATOM 0 HE2 PHE B 79 1.720 7.759 3.309 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.992 6.580 1.275 1.00 0.00 H new ATOM 1971 N SER B 80 5.744 13.452 0.092 1.00 0.00 N ATOM 1972 CA SER B 80 6.315 14.775 -0.117 1.00 0.00 C ATOM 1973 C SER B 80 5.646 15.511 -1.275 1.00 0.00 C ATOM 1974 O SER B 80 6.140 16.543 -1.737 1.00 0.00 O ATOM 1975 CB SER B 80 7.816 14.641 -0.371 1.00 0.00 C ATOM 1976 OG SER B 80 8.111 13.401 -0.992 1.00 0.00 O ATOM 0 H SER B 80 6.307 12.693 -0.292 1.00 0.00 H new ATOM 0 HA SER B 80 6.140 15.366 0.782 1.00 0.00 H new ATOM 0 HB2 SER B 80 8.157 15.460 -1.004 1.00 0.00 H new ATOM 0 HB3 SER B 80 8.358 14.719 0.572 1.00 0.00 H new ATOM 0 HG SER B 80 8.806 13.532 -1.671 1.00 0.00 H new ATOM 1982 N ASN B 81 4.535 14.982 -1.760 1.00 0.00 N ATOM 1983 CA ASN B 81 3.822 15.629 -2.843 1.00 0.00 C ATOM 1984 C ASN B 81 2.858 16.658 -2.275 1.00 0.00 C ATOM 1985 O ASN B 81 1.718 16.345 -1.961 1.00 0.00 O ATOM 1986 CB ASN B 81 3.076 14.618 -3.711 1.00 0.00 C ATOM 1987 CG ASN B 81 2.925 15.119 -5.131 1.00 0.00 C ATOM 1988 OD1 ASN B 81 3.809 15.802 -5.653 1.00 0.00 O ATOM 1989 ND2 ASN B 81 1.822 14.777 -5.773 1.00 0.00 N ATOM 0 H ASN B 81 4.113 14.116 -1.424 1.00 0.00 H new ATOM 0 HA ASN B 81 4.551 16.128 -3.482 1.00 0.00 H new ATOM 0 HB2 ASN B 81 3.614 13.670 -3.713 1.00 0.00 H new ATOM 0 HB3 ASN B 81 2.092 14.425 -3.284 1.00 0.00 H new ATOM 0 HD21 ASN B 81 1.678 15.079 -6.736 1.00 0.00 H new ATOM 0 HD22 ASN B 81 1.114 14.211 -5.305 1.00 0.00 H new ATOM 1996 N GLU B 82 3.345 17.886 -2.147 1.00 0.00 N ATOM 1997 CA GLU B 82 2.577 19.008 -1.601 1.00 0.00 C ATOM 1998 C GLU B 82 1.187 19.151 -2.230 1.00 0.00 C ATOM 1999 O GLU B 82 0.249 19.603 -1.573 1.00 0.00 O ATOM 2000 CB GLU B 82 3.371 20.316 -1.777 1.00 0.00 C ATOM 2001 CG GLU B 82 3.538 20.776 -3.228 1.00 0.00 C ATOM 2002 CD GLU B 82 4.209 19.741 -4.113 1.00 0.00 C ATOM 2003 OE1 GLU B 82 3.513 19.120 -4.941 1.00 0.00 O ATOM 2004 OE2 GLU B 82 5.425 19.515 -3.954 1.00 0.00 O ATOM 0 H GLU B 82 4.295 18.138 -2.421 1.00 0.00 H new ATOM 0 HA GLU B 82 2.421 18.799 -0.543 1.00 0.00 H new ATOM 0 HB2 GLU B 82 2.872 21.106 -1.216 1.00 0.00 H new ATOM 0 HB3 GLU B 82 4.359 20.187 -1.336 1.00 0.00 H new ATOM 0 HG2 GLU B 82 2.558 21.016 -3.641 1.00 0.00 H new ATOM 0 HG3 GLU B 82 4.125 21.694 -3.245 1.00 0.00 H new ATOM 2011 N SER B 83 1.063 18.759 -3.488 1.00 0.00 N ATOM 2012 CA SER B 83 -0.198 18.860 -4.208 1.00 0.00 C ATOM 2013 C SER B 83 -1.296 17.979 -3.596 1.00 0.00 C ATOM 2014 O SER B 83 -2.362 18.472 -3.227 1.00 0.00 O ATOM 2015 CB SER B 83 0.029 18.488 -5.673 1.00 0.00 C ATOM 2016 OG SER B 83 1.283 17.839 -5.843 1.00 0.00 O ATOM 0 H SER B 83 1.827 18.364 -4.036 1.00 0.00 H new ATOM 0 HA SER B 83 -0.546 19.890 -4.132 1.00 0.00 H new ATOM 0 HB2 SER B 83 -0.773 17.834 -6.015 1.00 0.00 H new ATOM 0 HB3 SER B 83 -0.007 19.386 -6.290 1.00 0.00 H new ATOM 0 HG SER B 83 1.407 17.609 -6.787 1.00 0.00 H new ATOM 2022 N THR B 84 -1.037 16.682 -3.479 1.00 0.00 N ATOM 2023 CA THR B 84 -2.027 15.759 -2.936 1.00 0.00 C ATOM 2024 C THR B 84 -1.438 14.836 -1.869 1.00 0.00 C ATOM 2025 O THR B 84 -1.770 13.656 -1.817 1.00 0.00 O ATOM 2026 CB THR B 84 -2.640 14.906 -4.064 1.00 0.00 C ATOM 2027 OG1 THR B 84 -1.682 14.728 -5.119 1.00 0.00 O ATOM 2028 CG2 THR B 84 -3.899 15.555 -4.619 1.00 0.00 C ATOM 0 H THR B 84 -0.155 16.247 -3.751 1.00 0.00 H new ATOM 0 HA THR B 84 -2.800 16.367 -2.465 1.00 0.00 H new ATOM 0 HB THR B 84 -2.909 13.935 -3.647 1.00 0.00 H new ATOM 0 HG1 THR B 84 -0.981 14.110 -4.824 1.00 0.00 H new ATOM 0 HG21 THR B 84 -4.310 14.932 -5.413 1.00 0.00 H new ATOM 0 HG22 THR B 84 -4.636 15.660 -3.822 1.00 0.00 H new ATOM 0 HG23 THR B 84 -3.655 16.539 -5.020 1.00 0.00 H new ATOM 2036 N ALA B 85 -0.604 15.390 -0.999 1.00 0.00 N ATOM 2037 CA ALA B 85 0.048 14.616 0.060 1.00 0.00 C ATOM 2038 C ALA B 85 -0.952 13.863 0.927 1.00 0.00 C ATOM 2039 O ALA B 85 -0.830 12.659 1.129 1.00 0.00 O ATOM 2040 CB ALA B 85 0.897 15.524 0.936 1.00 0.00 C ATOM 0 H ALA B 85 -0.359 16.380 -1.003 1.00 0.00 H new ATOM 0 HA ALA B 85 0.682 13.880 -0.433 1.00 0.00 H new ATOM 0 HB1 ALA B 85 1.374 14.933 1.718 1.00 0.00 H new ATOM 0 HB2 ALA B 85 1.662 16.006 0.327 1.00 0.00 H new ATOM 0 HB3 ALA B 85 0.264 16.285 1.392 1.00 0.00 H new ATOM 2046 N VAL B 86 -1.951 14.579 1.419 1.00 0.00 N ATOM 2047 CA VAL B 86 -2.962 13.991 2.285 1.00 0.00 C ATOM 2048 C VAL B 86 -3.846 13.004 1.519 1.00 0.00 C ATOM 2049 O VAL B 86 -4.218 11.952 2.039 1.00 0.00 O ATOM 2050 CB VAL B 86 -3.845 15.093 2.915 1.00 0.00 C ATOM 2051 CG1 VAL B 86 -4.986 14.493 3.721 1.00 0.00 C ATOM 2052 CG2 VAL B 86 -3.020 16.017 3.793 1.00 0.00 C ATOM 0 H VAL B 86 -2.084 15.573 1.232 1.00 0.00 H new ATOM 0 HA VAL B 86 -2.441 13.450 3.075 1.00 0.00 H new ATOM 0 HB VAL B 86 -4.270 15.675 2.097 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -5.588 15.293 4.151 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -5.609 13.880 3.069 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -4.580 13.874 4.521 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -3.666 16.782 4.223 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -2.557 15.441 4.594 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -2.244 16.492 3.193 1.00 0.00 H new ATOM 2062 N LYS B 87 -4.135 13.321 0.263 1.00 0.00 N ATOM 2063 CA LYS B 87 -5.007 12.479 -0.545 1.00 0.00 C ATOM 2064 C LYS B 87 -4.311 11.215 -1.035 1.00 0.00 C ATOM 2065 O LYS B 87 -4.887 10.130 -0.961 1.00 0.00 O ATOM 2066 CB LYS B 87 -5.593 13.265 -1.715 1.00 0.00 C ATOM 2067 CG LYS B 87 -7.104 13.118 -1.821 1.00 0.00 C ATOM 2068 CD LYS B 87 -7.749 13.062 -0.441 1.00 0.00 C ATOM 2069 CE LYS B 87 -8.730 11.903 -0.327 1.00 0.00 C ATOM 2070 NZ LYS B 87 -9.191 11.686 1.073 1.00 0.00 N ATOM 0 H LYS B 87 -3.781 14.149 -0.215 1.00 0.00 H new ATOM 0 HA LYS B 87 -5.823 12.159 0.103 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -5.341 14.319 -1.602 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -5.133 12.925 -2.643 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -7.515 13.956 -2.384 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -7.346 12.212 -2.376 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -6.975 12.960 0.319 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -8.268 14.000 -0.243 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -9.592 12.096 -0.965 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -8.258 10.993 -0.697 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -9.659 10.760 1.145 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -8.374 11.711 1.716 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -9.862 12.435 1.337 1.00 0.00 H new ATOM 2084 N GLU B 88 -3.085 11.339 -1.533 1.00 0.00 N ATOM 2085 CA GLU B 88 -2.351 10.169 -1.998 1.00 0.00 C ATOM 2086 C GLU B 88 -2.044 9.278 -0.803 1.00 0.00 C ATOM 2087 O GLU B 88 -1.952 8.056 -0.924 1.00 0.00 O ATOM 2088 CB GLU B 88 -1.080 10.569 -2.754 1.00 0.00 C ATOM 2089 CG GLU B 88 -1.379 11.311 -4.049 1.00 0.00 C ATOM 2090 CD GLU B 88 -0.140 11.671 -4.842 1.00 0.00 C ATOM 2091 OE1 GLU B 88 0.194 12.871 -4.912 1.00 0.00 O ATOM 2092 OE2 GLU B 88 0.490 10.766 -5.433 1.00 0.00 O ATOM 0 H GLU B 88 -2.585 12.224 -1.624 1.00 0.00 H new ATOM 0 HA GLU B 88 -2.964 9.613 -2.708 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -0.463 11.199 -2.113 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -0.498 9.675 -2.978 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -2.030 10.695 -4.669 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -1.929 12.223 -3.817 1.00 0.00 H new ATOM 2099 N ARG B 89 -1.907 9.910 0.362 1.00 0.00 N ATOM 2100 CA ARG B 89 -1.681 9.191 1.604 1.00 0.00 C ATOM 2101 C ARG B 89 -2.891 8.318 1.874 1.00 0.00 C ATOM 2102 O ARG B 89 -2.770 7.132 2.161 1.00 0.00 O ATOM 2103 CB ARG B 89 -1.478 10.175 2.766 1.00 0.00 C ATOM 2104 CG ARG B 89 -1.085 9.527 4.091 1.00 0.00 C ATOM 2105 CD ARG B 89 -2.295 9.059 4.896 1.00 0.00 C ATOM 2106 NE ARG B 89 -3.390 10.033 4.901 1.00 0.00 N ATOM 2107 CZ ARG B 89 -3.590 10.941 5.859 1.00 0.00 C ATOM 2108 NH1 ARG B 89 -2.773 11.016 6.901 1.00 0.00 N ATOM 2109 NH2 ARG B 89 -4.621 11.770 5.779 1.00 0.00 N ATOM 0 H ARG B 89 -1.950 10.924 0.466 1.00 0.00 H new ATOM 0 HA ARG B 89 -0.783 8.579 1.517 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -0.707 10.893 2.486 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -2.400 10.738 2.912 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -0.432 8.677 3.896 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -0.512 10.240 4.684 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -2.656 8.117 4.484 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -1.987 8.861 5.923 1.00 0.00 H new ATOM 0 HE ARG B 89 -4.044 10.016 4.119 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -1.982 10.376 6.976 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -2.935 11.714 7.627 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -5.260 11.714 4.986 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -4.775 12.464 6.510 1.00 0.00 H new ATOM 2123 N ASP B 90 -4.061 8.933 1.754 1.00 0.00 N ATOM 2124 CA ASP B 90 -5.332 8.254 1.970 1.00 0.00 C ATOM 2125 C ASP B 90 -5.509 7.114 0.987 1.00 0.00 C ATOM 2126 O ASP B 90 -5.968 6.043 1.356 1.00 0.00 O ATOM 2127 CB ASP B 90 -6.501 9.227 1.812 1.00 0.00 C ATOM 2128 CG ASP B 90 -6.726 10.081 3.037 1.00 0.00 C ATOM 2129 OD1 ASP B 90 -6.186 9.739 4.112 1.00 0.00 O ATOM 2130 OD2 ASP B 90 -7.450 11.092 2.925 1.00 0.00 O ATOM 0 H ASP B 90 -4.155 9.917 1.504 1.00 0.00 H new ATOM 0 HA ASP B 90 -5.322 7.859 2.986 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -6.315 9.873 0.954 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -7.409 8.664 1.596 1.00 0.00 H new ATOM 2135 N ALA B 91 -5.132 7.349 -0.263 1.00 0.00 N ATOM 2136 CA ALA B 91 -5.261 6.341 -1.300 1.00 0.00 C ATOM 2137 C ALA B 91 -4.495 5.073 -0.935 1.00 0.00 C ATOM 2138 O ALA B 91 -5.008 3.971 -1.089 1.00 0.00 O ATOM 2139 CB ALA B 91 -4.783 6.893 -2.634 1.00 0.00 C ATOM 0 H ALA B 91 -4.734 8.232 -0.581 1.00 0.00 H new ATOM 0 HA ALA B 91 -6.315 6.078 -1.389 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -4.885 6.127 -3.402 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -5.384 7.761 -2.905 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -3.737 7.187 -2.552 1.00 0.00 H new ATOM 2145 N VAL B 92 -3.278 5.236 -0.431 1.00 0.00 N ATOM 2146 CA VAL B 92 -2.454 4.095 -0.047 1.00 0.00 C ATOM 2147 C VAL B 92 -2.935 3.516 1.271 1.00 0.00 C ATOM 2148 O VAL B 92 -3.043 2.305 1.438 1.00 0.00 O ATOM 2149 CB VAL B 92 -0.970 4.497 0.101 1.00 0.00 C ATOM 2150 CG1 VAL B 92 -0.137 3.330 0.605 1.00 0.00 C ATOM 2151 CG2 VAL B 92 -0.420 5.009 -1.215 1.00 0.00 C ATOM 0 H VAL B 92 -2.840 6.144 -0.279 1.00 0.00 H new ATOM 0 HA VAL B 92 -2.543 3.350 -0.837 1.00 0.00 H new ATOM 0 HB VAL B 92 -0.912 5.299 0.836 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.904 3.640 0.700 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.511 3.009 1.578 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.206 2.502 -0.101 1.00 0.00 H new ATOM 0 HG21 VAL B 92 0.626 5.287 -1.089 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -0.499 4.228 -1.971 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -0.991 5.881 -1.533 1.00 0.00 H new ATOM 2161 N LYS B 93 -3.256 4.410 2.183 1.00 0.00 N ATOM 2162 CA LYS B 93 -3.702 4.055 3.515 1.00 0.00 C ATOM 2163 C LYS B 93 -5.007 3.270 3.472 1.00 0.00 C ATOM 2164 O LYS B 93 -5.111 2.185 4.047 1.00 0.00 O ATOM 2165 CB LYS B 93 -3.854 5.349 4.317 1.00 0.00 C ATOM 2166 CG LYS B 93 -4.886 5.311 5.424 1.00 0.00 C ATOM 2167 CD LYS B 93 -4.982 6.663 6.107 1.00 0.00 C ATOM 2168 CE LYS B 93 -6.410 7.002 6.483 1.00 0.00 C ATOM 2169 NZ LYS B 93 -7.161 7.617 5.353 1.00 0.00 N ATOM 0 H LYS B 93 -3.214 5.416 2.019 1.00 0.00 H new ATOM 0 HA LYS B 93 -2.970 3.405 3.993 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -2.888 5.601 4.753 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -4.113 6.154 3.629 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -5.857 5.034 5.014 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -4.618 4.547 6.153 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -4.360 6.663 7.002 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -4.587 7.434 5.445 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -6.923 6.096 6.807 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -6.407 7.687 7.330 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -7.946 8.187 5.727 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -6.522 8.226 4.802 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -7.540 6.868 4.739 1.00 0.00 H new ATOM 2183 N ASP B 94 -5.982 3.811 2.763 1.00 0.00 N ATOM 2184 CA ASP B 94 -7.293 3.192 2.642 1.00 0.00 C ATOM 2185 C ASP B 94 -7.233 1.919 1.806 1.00 0.00 C ATOM 2186 O ASP B 94 -7.929 0.943 2.087 1.00 0.00 O ATOM 2187 CB ASP B 94 -8.287 4.186 2.041 1.00 0.00 C ATOM 2188 CG ASP B 94 -8.917 5.077 3.096 1.00 0.00 C ATOM 2189 OD1 ASP B 94 -10.123 4.912 3.378 1.00 0.00 O ATOM 2190 OD2 ASP B 94 -8.210 5.938 3.661 1.00 0.00 O ATOM 0 H ASP B 94 -5.889 4.691 2.255 1.00 0.00 H new ATOM 0 HA ASP B 94 -7.631 2.912 3.640 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -7.777 4.805 1.303 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -9.070 3.641 1.514 1.00 0.00 H new ATOM 2195 N LEU B 95 -6.376 1.913 0.803 1.00 0.00 N ATOM 2196 CA LEU B 95 -6.235 0.746 -0.062 1.00 0.00 C ATOM 2197 C LEU B 95 -5.503 -0.354 0.685 1.00 0.00 C ATOM 2198 O LEU B 95 -5.680 -1.536 0.405 1.00 0.00 O ATOM 2199 CB LEU B 95 -5.500 1.095 -1.360 1.00 0.00 C ATOM 2200 CG LEU B 95 -5.467 -0.015 -2.416 1.00 0.00 C ATOM 2201 CD1 LEU B 95 -6.868 -0.537 -2.697 1.00 0.00 C ATOM 2202 CD2 LEU B 95 -4.831 0.492 -3.700 1.00 0.00 C ATOM 0 H LEU B 95 -5.768 2.696 0.564 1.00 0.00 H new ATOM 0 HA LEU B 95 -7.231 0.398 -0.335 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -5.970 1.976 -1.798 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -4.474 1.370 -1.114 1.00 0.00 H new ATOM 0 HG LEU B 95 -4.865 -0.836 -2.025 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -6.819 -1.324 -3.450 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -7.297 -0.939 -1.779 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -7.493 0.277 -3.064 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -4.816 -0.309 -4.439 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -5.410 1.331 -4.086 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -3.811 0.818 -3.497 1.00 0.00 H new ATOM 2214 N LEU B 96 -4.679 0.039 1.644 1.00 0.00 N ATOM 2215 CA LEU B 96 -3.963 -0.931 2.443 1.00 0.00 C ATOM 2216 C LEU B 96 -4.948 -1.651 3.343 1.00 0.00 C ATOM 2217 O LEU B 96 -5.041 -2.863 3.278 1.00 0.00 O ATOM 2218 CB LEU B 96 -2.849 -0.278 3.244 1.00 0.00 C ATOM 2219 CG LEU B 96 -1.505 -0.217 2.524 1.00 0.00 C ATOM 2220 CD1 LEU B 96 -0.516 0.595 3.327 1.00 0.00 C ATOM 2221 CD2 LEU B 96 -0.963 -1.616 2.274 1.00 0.00 C ATOM 0 H LEU B 96 -4.494 1.013 1.883 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.486 -1.656 1.784 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -3.153 0.735 3.506 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -2.722 -0.824 4.179 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.655 0.268 1.560 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.438 0.630 2.801 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.897 1.608 3.456 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.375 0.134 4.304 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.004 -1.548 1.760 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -0.829 -2.130 3.226 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -1.667 -2.174 1.657 1.00 0.00 H new ATOM 2233 N GLN B 97 -5.702 -0.915 4.174 1.00 0.00 N ATOM 2234 CA GLN B 97 -6.729 -1.539 5.011 1.00 0.00 C ATOM 2235 C GLN B 97 -7.674 -2.380 4.157 1.00 0.00 C ATOM 2236 O GLN B 97 -8.387 -3.246 4.659 1.00 0.00 O ATOM 2237 CB GLN B 97 -7.519 -0.475 5.769 1.00 0.00 C ATOM 2238 CG GLN B 97 -7.600 0.849 5.051 1.00 0.00 C ATOM 2239 CD GLN B 97 -7.658 2.028 5.998 1.00 0.00 C ATOM 2240 OE1 GLN B 97 -8.045 3.130 5.623 1.00 0.00 O ATOM 2241 NE2 GLN B 97 -7.318 1.793 7.238 1.00 0.00 N ATOM 0 H GLN B 97 -5.620 0.096 4.281 1.00 0.00 H new ATOM 0 HA GLN B 97 -6.234 -2.189 5.732 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -8.529 -0.844 5.947 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -7.059 -0.321 6.745 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.734 0.956 4.398 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -8.484 0.858 4.413 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -7.001 0.863 7.512 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.370 2.539 7.931 1.00 0.00 H new ATOM 2250 N GLN B 98 -7.701 -2.079 2.867 1.00 0.00 N ATOM 2251 CA GLN B 98 -8.512 -2.812 1.915 1.00 0.00 C ATOM 2252 C GLN B 98 -7.862 -4.134 1.499 1.00 0.00 C ATOM 2253 O GLN B 98 -8.480 -5.187 1.596 1.00 0.00 O ATOM 2254 CB GLN B 98 -8.751 -1.946 0.677 1.00 0.00 C ATOM 2255 CG GLN B 98 -9.953 -1.036 0.801 1.00 0.00 C ATOM 2256 CD GLN B 98 -10.732 -1.285 2.072 1.00 0.00 C ATOM 2257 OE1 GLN B 98 -10.509 -0.632 3.088 1.00 0.00 O ATOM 2258 NE2 GLN B 98 -11.642 -2.238 2.023 1.00 0.00 N ATOM 0 H GLN B 98 -7.160 -1.319 2.454 1.00 0.00 H new ATOM 0 HA GLN B 98 -9.459 -3.050 2.400 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -7.864 -1.340 0.490 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -8.883 -2.594 -0.190 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -9.624 0.003 0.777 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -10.607 -1.183 -0.058 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -11.793 -2.755 1.157 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -12.195 -2.458 2.851 1.00 0.00 H new ATOM 2267 N LEU B 99 -6.611 -4.075 1.059 1.00 0.00 N ATOM 2268 CA LEU B 99 -5.907 -5.265 0.575 1.00 0.00 C ATOM 2269 C LEU B 99 -5.192 -6.057 1.672 1.00 0.00 C ATOM 2270 O LEU B 99 -5.063 -7.274 1.572 1.00 0.00 O ATOM 2271 CB LEU B 99 -4.897 -4.854 -0.492 1.00 0.00 C ATOM 2272 CG LEU B 99 -5.517 -4.190 -1.714 1.00 0.00 C ATOM 2273 CD1 LEU B 99 -4.464 -3.431 -2.506 1.00 0.00 C ATOM 2274 CD2 LEU B 99 -6.202 -5.222 -2.591 1.00 0.00 C ATOM 0 H LEU B 99 -6.060 -3.217 1.026 1.00 0.00 H new ATOM 0 HA LEU B 99 -6.669 -5.928 0.166 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -4.174 -4.170 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -4.345 -5.737 -0.813 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.267 -3.477 -1.372 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.928 -2.964 -3.375 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.019 -2.662 -1.875 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -3.689 -4.122 -2.837 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.639 -4.729 -3.459 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -5.472 -5.960 -2.922 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -6.988 -5.719 -2.022 1.00 0.00 H new ATOM 2286 N LEU B 100 -4.741 -5.366 2.711 1.00 0.00 N ATOM 2287 CA LEU B 100 -3.997 -5.988 3.813 1.00 0.00 C ATOM 2288 C LEU B 100 -4.690 -7.219 4.433 1.00 0.00 C ATOM 2289 O LEU B 100 -4.035 -8.243 4.618 1.00 0.00 O ATOM 2290 CB LEU B 100 -3.671 -4.948 4.900 1.00 0.00 C ATOM 2291 CG LEU B 100 -2.460 -4.062 4.586 1.00 0.00 C ATOM 2292 CD1 LEU B 100 -2.259 -2.966 5.639 1.00 0.00 C ATOM 2293 CD2 LEU B 100 -1.214 -4.919 4.461 1.00 0.00 C ATOM 0 H LEU B 100 -4.877 -4.361 2.819 1.00 0.00 H new ATOM 0 HA LEU B 100 -3.074 -6.362 3.370 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -4.543 -4.311 5.049 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -3.491 -5.468 5.841 1.00 0.00 H new ATOM 0 HG LEU B 100 -2.650 -3.560 3.637 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.390 -2.363 5.375 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -3.144 -2.330 5.676 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.100 -3.424 6.615 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -0.357 -4.284 4.238 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -1.040 -5.447 5.398 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -1.349 -5.642 3.657 1.00 0.00 H new