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: A 414 LYS NZ :NH3+ -158:sc= 1.18 (180deg=-2.91!) USER MOD Set 1.2: B 97 GLN : amide:sc= -7.21! C(o=-7.6!,f=-22!) USER MOD Set 1.3: B 98 GLN : amide:sc= -1.58! C(o=-7.6!,f=-17!) USER MOD Set 2.1: B 81 ASN : amide:sc= -0.128 K(o=0.73,f=-5!) USER MOD Set 2.2: B 84 THR OG1 : rot 88:sc= 0.862 USER MOD Set 3.1: B 66 GLN : amide:sc= 1.1 K(o=-4.3,f=-5.9!) USER MOD Set 3.2: B 76 ASN : amide:sc= -5.44! C(o=-4.3!,f=-5.9!) USER MOD Set 4.1: B 51 LYS NZ :NH3+ 173:sc= 1.45 (180deg=0.0203) USER MOD Set 4.2: B 52 CYS SG : rot 162:sc= -0.131! USER MOD Set 5.1: B 45 HIS : no HE2:sc= -2.34! C(o=-1.2!,f=-5!) USER MOD Set 5.2: B 75 THR OG1 : rot -129:sc= 1.11 USER MOD Set 6.1: B 13 LYS NZ :NH3+ -163:sc= 0.0242 (180deg=0) USER MOD Set 6.2: B 25 TYR OH : rot 180:sc=-0.00373 USER MOD Single : B 14 LYS NZ :NH3+ -143:sc= 0.38 (180deg=0.131) USER MOD Single : B 17 GLN : amide:sc= -1.55 K(o=-1.6,f=-0.08) USER MOD Single : B 18 LYS NZ :NH3+ 172:sc= 1.2 (180deg=0.947) USER MOD Single : B 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 20 GLN : amide:sc= 0.0472 X(o=0.047,f=0) USER MOD Single : B 27 MET CE :methyl 170:sc= -0.0229 (180deg=-0.17) USER MOD Single : B 42 THR OG1 : rot -17:sc= 0.648 USER MOD Single : B 44 SER OG : rot 160:sc= 0.0051 USER MOD Single : B 46 MET CE :methyl -149:sc= -0.39 (180deg=-2.28!) USER MOD Single : B 47 TYR OH : rot -42:sc= 1.13 USER MOD Single : B 53 GLN : amide:sc= -8.56! C(o=-8.6!,f=-4.8!) USER MOD Single : B 54 LYS NZ :NH3+ 124:sc= 1.22 (180deg=0.27) USER MOD Single : B 56 SER OG : rot 131:sc= -0.467 USER MOD Single : B 60 LYS NZ :NH3+ 155:sc= -1.78 (180deg=-2.44) USER MOD Single : B 62 LYS NZ :NH3+ 162:sc= -0.0741 (180deg=-0.447) USER MOD Single : B 64 GLN : amide:sc= -4.04! C(o=-4!,f=-10!) USER MOD Single : B 70 HIS : no HD1:sc= -0.0279 K(o=-0.028,f=-0.54) USER MOD Single : B 74 THR OG1 : rot 39:sc= 0.05 USER MOD Single : B 78 HIS : no HD1:sc= -3.88 K(o=-3.9,f=-3.1!) USER MOD Single : B 80 SER OG : rot 157:sc= 1.37 USER MOD Single : B 83 SER OG : rot 180:sc= 0 USER MOD Single : B 87 LYS NZ :NH3+ 163:sc= 1.27 (180deg=1.26) USER MOD Single : B 93 LYS NZ :NH3+ -173:sc= 2.44 (180deg=1.85) USER MOD ----------------------------------------------------------------- ATOM 229 N ASP A 405 9.631 9.973 11.281 1.00 0.00 N ATOM 230 CA ASP A 405 9.702 8.547 11.629 1.00 0.00 C ATOM 231 C ASP A 405 8.782 8.120 12.766 1.00 0.00 C ATOM 232 O ASP A 405 8.313 6.982 12.780 1.00 0.00 O ATOM 233 CB ASP A 405 11.152 8.166 11.968 1.00 0.00 C ATOM 234 CG ASP A 405 12.151 8.578 10.892 1.00 0.00 C ATOM 235 OD1 ASP A 405 12.816 7.694 10.312 1.00 0.00 O ATOM 236 OD2 ASP A 405 12.280 9.794 10.624 1.00 0.00 O ATOM 0 HA ASP A 405 9.350 8.012 10.747 1.00 0.00 H new ATOM 0 HB2 ASP A 405 11.432 8.633 12.912 1.00 0.00 H new ATOM 0 HB3 ASP A 405 11.212 7.088 12.116 1.00 0.00 H new ATOM 241 N GLU A 406 8.508 9.009 13.693 1.00 0.00 N ATOM 242 CA GLU A 406 7.651 8.681 14.810 1.00 0.00 C ATOM 243 C GLU A 406 6.322 9.402 14.658 1.00 0.00 C ATOM 244 O GLU A 406 6.203 10.296 13.828 1.00 0.00 O ATOM 245 CB GLU A 406 8.347 9.066 16.125 1.00 0.00 C ATOM 246 CG GLU A 406 7.499 8.868 17.373 1.00 0.00 C ATOM 247 CD GLU A 406 7.123 7.415 17.605 1.00 0.00 C ATOM 248 OE1 GLU A 406 6.116 6.960 17.013 1.00 0.00 O ATOM 249 OE2 GLU A 406 7.829 6.734 18.372 1.00 0.00 O ATOM 0 H GLU A 406 8.866 9.964 13.696 1.00 0.00 H new ATOM 0 HA GLU A 406 7.458 7.608 14.829 1.00 0.00 H new ATOM 0 HB2 GLU A 406 9.259 8.477 16.224 1.00 0.00 H new ATOM 0 HB3 GLU A 406 8.648 10.112 16.069 1.00 0.00 H new ATOM 0 HG2 GLU A 406 8.045 9.240 18.240 1.00 0.00 H new ATOM 0 HG3 GLU A 406 6.591 9.464 17.288 1.00 0.00 H new ATOM 256 N ASP A 407 5.331 8.977 15.430 1.00 0.00 N ATOM 257 CA ASP A 407 4.007 9.559 15.425 1.00 0.00 C ATOM 258 C ASP A 407 3.221 9.127 14.204 1.00 0.00 C ATOM 259 O ASP A 407 2.930 9.924 13.313 1.00 0.00 O ATOM 260 CB ASP A 407 4.028 11.075 15.573 1.00 0.00 C ATOM 261 CG ASP A 407 2.662 11.643 15.913 1.00 0.00 C ATOM 262 OD1 ASP A 407 2.520 12.881 15.896 1.00 0.00 O ATOM 263 OD2 ASP A 407 1.734 10.851 16.190 1.00 0.00 O ATOM 0 H ASP A 407 5.432 8.204 16.087 1.00 0.00 H new ATOM 0 HA ASP A 407 3.494 9.175 16.307 1.00 0.00 H new ATOM 0 HB2 ASP A 407 4.738 11.351 16.353 1.00 0.00 H new ATOM 0 HB3 ASP A 407 4.384 11.523 14.645 1.00 0.00 H new ATOM 268 N PHE A 408 2.993 7.821 14.124 1.00 0.00 N ATOM 269 CA PHE A 408 2.171 7.232 13.084 1.00 0.00 C ATOM 270 C PHE A 408 1.023 6.515 13.755 1.00 0.00 C ATOM 271 O PHE A 408 1.220 5.663 14.627 1.00 0.00 O ATOM 272 CB PHE A 408 2.939 6.237 12.201 1.00 0.00 C ATOM 273 CG PHE A 408 3.913 6.858 11.250 1.00 0.00 C ATOM 274 CD1 PHE A 408 5.083 7.433 11.702 1.00 0.00 C ATOM 275 CD2 PHE A 408 3.652 6.865 9.892 1.00 0.00 C ATOM 276 CE1 PHE A 408 5.962 8.005 10.820 1.00 0.00 C ATOM 277 CE2 PHE A 408 4.532 7.436 9.006 1.00 0.00 C ATOM 278 CZ PHE A 408 5.688 8.009 9.473 1.00 0.00 C ATOM 0 H PHE A 408 3.376 7.143 14.782 1.00 0.00 H new ATOM 0 HA PHE A 408 1.828 8.033 12.429 1.00 0.00 H new ATOM 0 HB2 PHE A 408 3.476 5.542 12.846 1.00 0.00 H new ATOM 0 HB3 PHE A 408 2.219 5.651 11.630 1.00 0.00 H new ATOM 0 HD1 PHE A 408 5.308 7.432 12.758 1.00 0.00 H new ATOM 0 HD2 PHE A 408 2.742 6.415 9.523 1.00 0.00 H new ATOM 0 HE1 PHE A 408 6.874 8.455 11.185 1.00 0.00 H new ATOM 0 HE2 PHE A 408 4.316 7.434 7.948 1.00 0.00 H new ATOM 0 HZ PHE A 408 6.383 8.463 8.782 1.00 0.00 H new ATOM 288 N VAL A 409 -0.167 6.851 13.332 1.00 0.00 N ATOM 289 CA VAL A 409 -1.356 6.284 13.882 1.00 0.00 C ATOM 290 C VAL A 409 -1.639 4.983 13.194 1.00 0.00 C ATOM 291 O VAL A 409 -1.776 4.925 11.978 1.00 0.00 O ATOM 292 CB VAL A 409 -2.500 7.299 13.778 1.00 0.00 C ATOM 293 CG1 VAL A 409 -2.213 8.358 14.775 1.00 0.00 C ATOM 294 CG2 VAL A 409 -2.586 7.942 12.434 1.00 0.00 C ATOM 0 H VAL A 409 -0.333 7.531 12.590 1.00 0.00 H new ATOM 0 HA VAL A 409 -1.237 6.062 14.942 1.00 0.00 H new ATOM 0 HB VAL A 409 -3.444 6.782 13.949 1.00 0.00 H new ATOM 0 HG11 VAL A 409 -3.001 9.111 14.743 1.00 0.00 H new ATOM 0 HG12 VAL A 409 -2.172 7.918 15.771 1.00 0.00 H new ATOM 0 HG13 VAL A 409 -1.255 8.825 14.544 1.00 0.00 H new ATOM 0 HG21 VAL A 409 -3.414 8.650 12.422 1.00 0.00 H new ATOM 0 HG22 VAL A 409 -1.655 8.469 12.222 1.00 0.00 H new ATOM 0 HG23 VAL A 409 -2.751 7.177 11.675 1.00 0.00 H new ATOM 304 N GLU A 410 -1.672 3.936 13.989 1.00 0.00 N ATOM 305 CA GLU A 410 -1.860 2.607 13.470 1.00 0.00 C ATOM 306 C GLU A 410 -3.170 2.482 12.716 1.00 0.00 C ATOM 307 O GLU A 410 -4.259 2.611 13.276 1.00 0.00 O ATOM 308 CB GLU A 410 -1.756 1.576 14.593 1.00 0.00 C ATOM 309 CG GLU A 410 -1.387 0.180 14.112 1.00 0.00 C ATOM 310 CD GLU A 410 -0.448 -0.546 15.066 1.00 0.00 C ATOM 311 OE1 GLU A 410 0.353 0.133 15.753 1.00 0.00 O ATOM 312 OE2 GLU A 410 -0.485 -1.798 15.109 1.00 0.00 O ATOM 0 H GLU A 410 -1.570 3.984 15.003 1.00 0.00 H new ATOM 0 HA GLU A 410 -1.063 2.408 12.753 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -1.010 1.911 15.313 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -2.709 1.529 15.120 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -2.296 -0.408 13.987 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -0.917 0.251 13.131 1.00 0.00 H new ATOM 319 N VAL A 411 -3.022 2.251 11.432 1.00 0.00 N ATOM 320 CA VAL A 411 -4.124 2.092 10.528 1.00 0.00 C ATOM 321 C VAL A 411 -4.582 0.639 10.542 1.00 0.00 C ATOM 322 O VAL A 411 -3.809 -0.273 10.217 1.00 0.00 O ATOM 323 CB VAL A 411 -3.734 2.506 9.093 1.00 0.00 C ATOM 324 CG1 VAL A 411 -4.969 2.659 8.244 1.00 0.00 C ATOM 325 CG2 VAL A 411 -2.955 3.780 9.104 1.00 0.00 C ATOM 0 H VAL A 411 -2.110 2.168 10.983 1.00 0.00 H new ATOM 0 HA VAL A 411 -4.937 2.740 10.855 1.00 0.00 H new ATOM 0 HB VAL A 411 -3.106 1.723 8.667 1.00 0.00 H new ATOM 0 HG11 VAL A 411 -4.682 2.951 7.234 1.00 0.00 H new ATOM 0 HG12 VAL A 411 -5.506 1.711 8.209 1.00 0.00 H new ATOM 0 HG13 VAL A 411 -5.614 3.426 8.674 1.00 0.00 H new ATOM 0 HG21 VAL A 411 -2.690 4.053 8.083 1.00 0.00 H new ATOM 0 HG22 VAL A 411 -3.559 4.572 9.547 1.00 0.00 H new ATOM 0 HG23 VAL A 411 -2.046 3.646 9.691 1.00 0.00 H new ATOM 335 N PRO A 412 -5.833 0.405 10.954 1.00 0.00 N ATOM 336 CA PRO A 412 -6.411 -0.934 11.023 1.00 0.00 C ATOM 337 C PRO A 412 -6.852 -1.429 9.654 1.00 0.00 C ATOM 338 O PRO A 412 -6.823 -0.681 8.680 1.00 0.00 O ATOM 339 CB PRO A 412 -7.626 -0.729 11.922 1.00 0.00 C ATOM 340 CG PRO A 412 -8.058 0.664 11.624 1.00 0.00 C ATOM 341 CD PRO A 412 -6.791 1.439 11.390 1.00 0.00 C ATOM 0 HA PRO A 412 -5.704 -1.678 11.390 1.00 0.00 H new ATOM 0 HB2 PRO A 412 -8.414 -1.448 11.699 1.00 0.00 H new ATOM 0 HB3 PRO A 412 -7.370 -0.852 12.974 1.00 0.00 H new ATOM 0 HG2 PRO A 412 -8.704 0.695 10.747 1.00 0.00 H new ATOM 0 HG3 PRO A 412 -8.627 1.084 12.454 1.00 0.00 H new ATOM 0 HD2 PRO A 412 -6.925 2.208 10.630 1.00 0.00 H new ATOM 0 HD3 PRO A 412 -6.454 1.942 12.297 1.00 0.00 H new ATOM 349 N GLU A 413 -7.260 -2.683 9.585 1.00 0.00 N ATOM 350 CA GLU A 413 -7.722 -3.263 8.340 1.00 0.00 C ATOM 351 C GLU A 413 -9.244 -3.192 8.281 1.00 0.00 C ATOM 352 O GLU A 413 -9.906 -3.198 9.318 1.00 0.00 O ATOM 353 CB GLU A 413 -7.221 -4.700 8.220 1.00 0.00 C ATOM 354 CG GLU A 413 -5.705 -4.791 8.290 1.00 0.00 C ATOM 355 CD GLU A 413 -5.193 -6.211 8.383 1.00 0.00 C ATOM 356 OE1 GLU A 413 -5.359 -6.841 9.444 1.00 0.00 O ATOM 357 OE2 GLU A 413 -4.588 -6.690 7.404 1.00 0.00 O ATOM 0 H GLU A 413 -7.280 -3.321 10.381 1.00 0.00 H new ATOM 0 HA GLU A 413 -7.323 -2.700 7.496 1.00 0.00 H new ATOM 0 HB2 GLU A 413 -7.656 -5.302 9.018 1.00 0.00 H new ATOM 0 HB3 GLU A 413 -7.565 -5.125 7.277 1.00 0.00 H new ATOM 0 HG2 GLU A 413 -5.279 -4.316 7.407 1.00 0.00 H new ATOM 0 HG3 GLU A 413 -5.354 -4.229 9.155 1.00 0.00 H new ATOM 364 N LYS A 414 -9.799 -3.102 7.079 1.00 0.00 N ATOM 365 CA LYS A 414 -11.241 -2.998 6.927 1.00 0.00 C ATOM 366 C LYS A 414 -11.830 -4.194 6.198 1.00 0.00 C ATOM 367 O LYS A 414 -12.839 -4.744 6.633 1.00 0.00 O ATOM 368 CB LYS A 414 -11.614 -1.710 6.203 1.00 0.00 C ATOM 369 CG LYS A 414 -11.649 -0.504 7.123 1.00 0.00 C ATOM 370 CD LYS A 414 -10.859 0.644 6.540 1.00 0.00 C ATOM 371 CE LYS A 414 -11.613 1.332 5.422 1.00 0.00 C ATOM 372 NZ LYS A 414 -10.705 2.107 4.538 1.00 0.00 N ATOM 0 H LYS A 414 -9.276 -3.099 6.203 1.00 0.00 H new ATOM 0 HA LYS A 414 -11.665 -2.982 7.931 1.00 0.00 H new ATOM 0 HB2 LYS A 414 -10.897 -1.529 5.402 1.00 0.00 H new ATOM 0 HB3 LYS A 414 -12.591 -1.832 5.735 1.00 0.00 H new ATOM 0 HG2 LYS A 414 -12.682 -0.195 7.284 1.00 0.00 H new ATOM 0 HG3 LYS A 414 -11.241 -0.773 8.097 1.00 0.00 H new ATOM 0 HD2 LYS A 414 -10.633 1.366 7.325 1.00 0.00 H new ATOM 0 HD3 LYS A 414 -9.905 0.275 6.162 1.00 0.00 H new ATOM 0 HE2 LYS A 414 -12.146 0.587 4.831 1.00 0.00 H new ATOM 0 HE3 LYS A 414 -12.363 1.999 5.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 414 -11.249 2.839 4.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 414 -9.964 2.558 5.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 414 -10.266 1.468 3.845 1.00 0.00 H new ATOM 786 N VAL B 8 -0.126 -2.889 -10.900 1.00 0.00 N ATOM 787 CA VAL B 8 -0.163 -1.656 -10.136 1.00 0.00 C ATOM 788 C VAL B 8 -1.600 -1.160 -10.019 1.00 0.00 C ATOM 789 O VAL B 8 -2.187 -0.696 -10.995 1.00 0.00 O ATOM 790 CB VAL B 8 0.704 -0.558 -10.787 1.00 0.00 C ATOM 791 CG1 VAL B 8 0.789 0.663 -9.885 1.00 0.00 C ATOM 792 CG2 VAL B 8 2.094 -1.088 -11.104 1.00 0.00 C ATOM 0 HA VAL B 8 0.240 -1.869 -9.146 1.00 0.00 H new ATOM 0 HB VAL B 8 0.231 -0.260 -11.723 1.00 0.00 H new ATOM 0 HG11 VAL B 8 1.405 1.426 -10.362 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -0.212 1.059 -9.714 1.00 0.00 H new ATOM 0 HG13 VAL B 8 1.235 0.381 -8.931 1.00 0.00 H new ATOM 0 HG21 VAL B 8 2.689 -0.298 -11.562 1.00 0.00 H new ATOM 0 HG22 VAL B 8 2.576 -1.418 -10.184 1.00 0.00 H new ATOM 0 HG23 VAL B 8 2.014 -1.929 -11.793 1.00 0.00 H new ATOM 802 N LEU B 9 -2.162 -1.278 -8.826 1.00 0.00 N ATOM 803 CA LEU B 9 -3.534 -0.858 -8.579 1.00 0.00 C ATOM 804 C LEU B 9 -3.591 0.610 -8.172 1.00 0.00 C ATOM 805 O LEU B 9 -4.531 1.323 -8.514 1.00 0.00 O ATOM 806 CB LEU B 9 -4.168 -1.716 -7.479 1.00 0.00 C ATOM 807 CG LEU B 9 -3.959 -3.227 -7.611 1.00 0.00 C ATOM 808 CD1 LEU B 9 -4.594 -3.953 -6.436 1.00 0.00 C ATOM 809 CD2 LEU B 9 -4.532 -3.740 -8.924 1.00 0.00 C ATOM 0 H LEU B 9 -1.687 -1.663 -8.010 1.00 0.00 H new ATOM 0 HA LEU B 9 -4.093 -0.988 -9.506 1.00 0.00 H new ATOM 0 HB2 LEU B 9 -3.767 -1.395 -6.517 1.00 0.00 H new ATOM 0 HB3 LEU B 9 -5.239 -1.516 -7.460 1.00 0.00 H new ATOM 0 HG LEU B 9 -2.887 -3.425 -7.607 1.00 0.00 H new ATOM 0 HD11 LEU B 9 -4.437 -5.026 -6.544 1.00 0.00 H new ATOM 0 HD12 LEU B 9 -4.137 -3.611 -5.507 1.00 0.00 H new ATOM 0 HD13 LEU B 9 -5.663 -3.743 -6.413 1.00 0.00 H new ATOM 0 HD21 LEU B 9 -4.372 -4.816 -8.995 1.00 0.00 H new ATOM 0 HD22 LEU B 9 -5.601 -3.529 -8.962 1.00 0.00 H new ATOM 0 HD23 LEU B 9 -4.035 -3.243 -9.757 1.00 0.00 H new ATOM 821 N LEU B 10 -2.580 1.059 -7.440 1.00 0.00 N ATOM 822 CA LEU B 10 -2.543 2.446 -6.983 1.00 0.00 C ATOM 823 C LEU B 10 -1.209 3.097 -7.316 1.00 0.00 C ATOM 824 O LEU B 10 -0.152 2.517 -7.077 1.00 0.00 O ATOM 825 CB LEU B 10 -2.795 2.517 -5.478 1.00 0.00 C ATOM 826 CG LEU B 10 -3.184 3.902 -4.948 1.00 0.00 C ATOM 827 CD1 LEU B 10 -4.620 4.248 -5.311 1.00 0.00 C ATOM 828 CD2 LEU B 10 -2.998 3.967 -3.445 1.00 0.00 C ATOM 0 H LEU B 10 -1.782 0.493 -7.151 1.00 0.00 H new ATOM 0 HA LEU B 10 -3.331 2.991 -7.503 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -3.587 1.812 -5.224 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -1.896 2.186 -4.959 1.00 0.00 H new ATOM 0 HG LEU B 10 -2.528 4.634 -5.419 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -4.866 5.236 -4.921 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -4.731 4.248 -6.395 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -5.293 3.509 -4.877 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.279 4.957 -3.086 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.627 3.216 -2.968 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -1.954 3.775 -3.199 1.00 0.00 H new ATOM 840 N ILE B 11 -1.266 4.300 -7.866 1.00 0.00 N ATOM 841 CA ILE B 11 -0.062 5.030 -8.225 1.00 0.00 C ATOM 842 C ILE B 11 0.049 6.312 -7.412 1.00 0.00 C ATOM 843 O ILE B 11 -0.837 7.162 -7.455 1.00 0.00 O ATOM 844 CB ILE B 11 -0.027 5.372 -9.732 1.00 0.00 C ATOM 845 CG1 ILE B 11 0.038 4.086 -10.562 1.00 0.00 C ATOM 846 CG2 ILE B 11 1.158 6.280 -10.046 1.00 0.00 C ATOM 847 CD1 ILE B 11 0.069 4.319 -12.056 1.00 0.00 C ATOM 0 H ILE B 11 -2.135 4.792 -8.073 1.00 0.00 H new ATOM 0 HA ILE B 11 0.785 4.382 -8.001 1.00 0.00 H new ATOM 0 HB ILE B 11 -0.941 5.906 -9.993 1.00 0.00 H new ATOM 0 HG12 ILE B 11 0.927 3.524 -10.274 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -0.824 3.465 -10.319 1.00 0.00 H new ATOM 0 HG21 ILE B 11 1.167 6.511 -11.111 1.00 0.00 H new ATOM 0 HG22 ILE B 11 1.069 7.204 -9.475 1.00 0.00 H new ATOM 0 HG23 ILE B 11 2.085 5.775 -9.776 1.00 0.00 H new ATOM 0 HD11 ILE B 11 0.115 3.360 -12.573 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -0.832 4.852 -12.360 1.00 0.00 H new ATOM 0 HD13 ILE B 11 0.946 4.912 -12.314 1.00 0.00 H new ATOM 859 N VAL B 12 1.134 6.424 -6.667 1.00 0.00 N ATOM 860 CA VAL B 12 1.396 7.586 -5.834 1.00 0.00 C ATOM 861 C VAL B 12 2.644 8.304 -6.340 1.00 0.00 C ATOM 862 O VAL B 12 3.577 7.660 -6.834 1.00 0.00 O ATOM 863 CB VAL B 12 1.603 7.170 -4.362 1.00 0.00 C ATOM 864 CG1 VAL B 12 1.611 8.380 -3.444 1.00 0.00 C ATOM 865 CG2 VAL B 12 0.532 6.179 -3.934 1.00 0.00 C ATOM 0 H VAL B 12 1.861 5.710 -6.622 1.00 0.00 H new ATOM 0 HA VAL B 12 0.536 8.253 -5.889 1.00 0.00 H new ATOM 0 HB VAL B 12 2.576 6.686 -4.283 1.00 0.00 H new ATOM 0 HG11 VAL B 12 1.759 8.054 -2.414 1.00 0.00 H new ATOM 0 HG12 VAL B 12 2.421 9.050 -3.732 1.00 0.00 H new ATOM 0 HG13 VAL B 12 0.659 8.905 -3.526 1.00 0.00 H new ATOM 0 HG21 VAL B 12 0.693 5.896 -2.894 1.00 0.00 H new ATOM 0 HG22 VAL B 12 -0.451 6.638 -4.037 1.00 0.00 H new ATOM 0 HG23 VAL B 12 0.585 5.291 -4.564 1.00 0.00 H new ATOM 875 N LYS B 13 2.668 9.621 -6.237 1.00 0.00 N ATOM 876 CA LYS B 13 3.809 10.394 -6.703 1.00 0.00 C ATOM 877 C LYS B 13 4.456 11.180 -5.569 1.00 0.00 C ATOM 878 O LYS B 13 3.811 11.487 -4.571 1.00 0.00 O ATOM 879 CB LYS B 13 3.388 11.342 -7.829 1.00 0.00 C ATOM 880 CG LYS B 13 2.944 10.625 -9.095 1.00 0.00 C ATOM 881 CD LYS B 13 4.029 9.697 -9.625 1.00 0.00 C ATOM 882 CE LYS B 13 3.527 8.863 -10.791 1.00 0.00 C ATOM 883 NZ LYS B 13 4.527 7.847 -11.223 1.00 0.00 N ATOM 0 H LYS B 13 1.913 10.178 -5.836 1.00 0.00 H new ATOM 0 HA LYS B 13 4.548 9.691 -7.086 1.00 0.00 H new ATOM 0 HB2 LYS B 13 2.574 11.974 -7.475 1.00 0.00 H new ATOM 0 HB3 LYS B 13 4.222 12.001 -8.068 1.00 0.00 H new ATOM 0 HG2 LYS B 13 2.041 10.050 -8.890 1.00 0.00 H new ATOM 0 HG3 LYS B 13 2.688 11.359 -9.859 1.00 0.00 H new ATOM 0 HD2 LYS B 13 4.890 10.286 -9.941 1.00 0.00 H new ATOM 0 HD3 LYS B 13 4.369 9.039 -8.825 1.00 0.00 H new ATOM 0 HE2 LYS B 13 2.602 8.362 -10.506 1.00 0.00 H new ATOM 0 HE3 LYS B 13 3.290 9.518 -11.630 1.00 0.00 H new ATOM 0 HZ1 LYS B 13 4.284 7.503 -12.174 1.00 0.00 H new ATOM 0 HZ2 LYS B 13 5.473 8.278 -11.242 1.00 0.00 H new ATOM 0 HZ3 LYS B 13 4.523 7.050 -10.555 1.00 0.00 H new ATOM 897 N LYS B 14 5.735 11.503 -5.762 1.00 0.00 N ATOM 898 CA LYS B 14 6.533 12.255 -4.797 1.00 0.00 C ATOM 899 C LYS B 14 6.443 11.674 -3.387 1.00 0.00 C ATOM 900 O LYS B 14 5.751 12.206 -2.519 1.00 0.00 O ATOM 901 CB LYS B 14 6.111 13.715 -4.808 1.00 0.00 C ATOM 902 CG LYS B 14 6.890 14.569 -5.795 1.00 0.00 C ATOM 903 CD LYS B 14 7.008 16.004 -5.312 1.00 0.00 C ATOM 904 CE LYS B 14 8.127 16.158 -4.294 1.00 0.00 C ATOM 905 NZ LYS B 14 7.907 17.323 -3.397 1.00 0.00 N ATOM 0 H LYS B 14 6.251 11.246 -6.603 1.00 0.00 H new ATOM 0 HA LYS B 14 7.578 12.178 -5.099 1.00 0.00 H new ATOM 0 HB2 LYS B 14 5.049 13.775 -5.048 1.00 0.00 H new ATOM 0 HB3 LYS B 14 6.236 14.128 -3.807 1.00 0.00 H new ATOM 0 HG2 LYS B 14 7.885 14.148 -5.937 1.00 0.00 H new ATOM 0 HG3 LYS B 14 6.395 14.550 -6.766 1.00 0.00 H new ATOM 0 HD2 LYS B 14 7.194 16.661 -6.162 1.00 0.00 H new ATOM 0 HD3 LYS B 14 6.064 16.318 -4.867 1.00 0.00 H new ATOM 0 HE2 LYS B 14 8.201 15.249 -3.697 1.00 0.00 H new ATOM 0 HE3 LYS B 14 9.077 16.276 -4.815 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 8.819 17.778 -3.190 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 7.277 18.006 -3.864 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 7.471 17.000 -2.509 1.00 0.00 H new ATOM 919 N VAL B 15 7.140 10.570 -3.178 1.00 0.00 N ATOM 920 CA VAL B 15 7.165 9.906 -1.886 1.00 0.00 C ATOM 921 C VAL B 15 8.604 9.661 -1.452 1.00 0.00 C ATOM 922 O VAL B 15 9.363 8.996 -2.152 1.00 0.00 O ATOM 923 CB VAL B 15 6.400 8.563 -1.922 1.00 0.00 C ATOM 924 CG1 VAL B 15 6.495 7.843 -0.585 1.00 0.00 C ATOM 925 CG2 VAL B 15 4.946 8.792 -2.300 1.00 0.00 C ATOM 0 H VAL B 15 7.702 10.111 -3.895 1.00 0.00 H new ATOM 0 HA VAL B 15 6.670 10.561 -1.169 1.00 0.00 H new ATOM 0 HB VAL B 15 6.863 7.930 -2.679 1.00 0.00 H new ATOM 0 HG11 VAL B 15 5.948 6.902 -0.639 1.00 0.00 H new ATOM 0 HG12 VAL B 15 7.541 7.642 -0.353 1.00 0.00 H new ATOM 0 HG13 VAL B 15 6.064 8.469 0.197 1.00 0.00 H new ATOM 0 HG21 VAL B 15 4.421 7.837 -2.321 1.00 0.00 H new ATOM 0 HG22 VAL B 15 4.478 9.447 -1.565 1.00 0.00 H new ATOM 0 HG23 VAL B 15 4.895 9.256 -3.285 1.00 0.00 H new ATOM 935 N ARG B 16 8.973 10.209 -0.304 1.00 0.00 N ATOM 936 CA ARG B 16 10.318 10.053 0.222 1.00 0.00 C ATOM 937 C ARG B 16 10.436 8.840 1.134 1.00 0.00 C ATOM 938 O ARG B 16 9.630 8.638 2.045 1.00 0.00 O ATOM 939 CB ARG B 16 10.761 11.298 1.003 1.00 0.00 C ATOM 940 CG ARG B 16 11.477 12.345 0.168 1.00 0.00 C ATOM 941 CD ARG B 16 11.855 13.577 0.988 1.00 0.00 C ATOM 942 NE ARG B 16 12.319 13.246 2.342 1.00 0.00 N ATOM 943 CZ ARG B 16 13.301 13.888 2.989 1.00 0.00 C ATOM 944 NH1 ARG B 16 13.999 14.844 2.392 1.00 0.00 N ATOM 945 NH2 ARG B 16 13.586 13.567 4.244 1.00 0.00 N ATOM 0 H ARG B 16 8.355 10.769 0.283 1.00 0.00 H new ATOM 0 HA ARG B 16 10.967 9.912 -0.642 1.00 0.00 H new ATOM 0 HB2 ARG B 16 9.884 11.755 1.461 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.419 10.987 1.815 1.00 0.00 H new ATOM 0 HG2 ARG B 16 12.377 11.909 -0.265 1.00 0.00 H new ATOM 0 HG3 ARG B 16 10.837 12.645 -0.662 1.00 0.00 H new ATOM 0 HD2 ARG B 16 12.638 14.128 0.466 1.00 0.00 H new ATOM 0 HD3 ARG B 16 10.992 14.239 1.058 1.00 0.00 H new ATOM 0 HE ARG B 16 11.861 12.472 2.824 1.00 0.00 H new ATOM 0 HH11 ARG B 16 13.791 15.100 1.427 1.00 0.00 H new ATOM 0 HH12 ARG B 16 14.744 15.324 2.898 1.00 0.00 H new ATOM 0 HH21 ARG B 16 13.058 12.832 4.715 1.00 0.00 H new ATOM 0 HH22 ARG B 16 14.333 14.055 4.738 1.00 0.00 H new ATOM 959 N GLN B 17 11.436 8.029 0.856 1.00 0.00 N ATOM 960 CA GLN B 17 11.744 6.872 1.659 1.00 0.00 C ATOM 961 C GLN B 17 13.104 7.122 2.286 1.00 0.00 C ATOM 962 O GLN B 17 14.128 6.984 1.621 1.00 0.00 O ATOM 963 CB GLN B 17 11.770 5.604 0.790 1.00 0.00 C ATOM 964 CG GLN B 17 12.302 4.364 1.500 1.00 0.00 C ATOM 965 CD GLN B 17 11.457 3.961 2.690 1.00 0.00 C ATOM 966 OE1 GLN B 17 11.958 3.435 3.680 1.00 0.00 O ATOM 967 NE2 GLN B 17 10.166 4.200 2.595 1.00 0.00 N ATOM 0 H GLN B 17 12.060 8.158 0.060 1.00 0.00 H new ATOM 0 HA GLN B 17 10.987 6.718 2.428 1.00 0.00 H new ATOM 0 HB2 GLN B 17 10.759 5.400 0.437 1.00 0.00 H new ATOM 0 HB3 GLN B 17 12.383 5.794 -0.091 1.00 0.00 H new ATOM 0 HG2 GLN B 17 12.344 3.536 0.793 1.00 0.00 H new ATOM 0 HG3 GLN B 17 13.323 4.551 1.832 1.00 0.00 H new ATOM 0 HE21 GLN B 17 9.789 4.639 1.755 1.00 0.00 H new ATOM 0 HE22 GLN B 17 9.543 3.946 3.361 1.00 0.00 H new ATOM 976 N LYS B 18 13.095 7.498 3.560 1.00 0.00 N ATOM 977 CA LYS B 18 14.311 7.798 4.302 1.00 0.00 C ATOM 978 C LYS B 18 15.315 8.627 3.487 1.00 0.00 C ATOM 979 O LYS B 18 16.389 8.141 3.121 1.00 0.00 O ATOM 980 CB LYS B 18 14.928 6.515 4.837 1.00 0.00 C ATOM 981 CG LYS B 18 14.436 6.143 6.232 1.00 0.00 C ATOM 982 CD LYS B 18 15.102 6.979 7.325 1.00 0.00 C ATOM 983 CE LYS B 18 14.432 8.340 7.513 1.00 0.00 C ATOM 984 NZ LYS B 18 14.737 8.935 8.841 1.00 0.00 N ATOM 0 H LYS B 18 12.241 7.603 4.108 1.00 0.00 H new ATOM 0 HA LYS B 18 14.035 8.426 5.149 1.00 0.00 H new ATOM 0 HB2 LYS B 18 14.703 5.699 4.151 1.00 0.00 H new ATOM 0 HB3 LYS B 18 16.012 6.624 4.859 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.356 6.279 6.282 1.00 0.00 H new ATOM 0 HG3 LYS B 18 14.633 5.087 6.415 1.00 0.00 H new ATOM 0 HD2 LYS B 18 15.072 6.430 8.266 1.00 0.00 H new ATOM 0 HD3 LYS B 18 16.153 7.127 7.075 1.00 0.00 H new ATOM 0 HE2 LYS B 18 14.764 9.019 6.727 1.00 0.00 H new ATOM 0 HE3 LYS B 18 13.353 8.230 7.405 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 14.378 9.910 8.875 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 14.281 8.372 9.587 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 15.766 8.939 8.991 1.00 0.00 H new ATOM 998 N LYS B 19 14.909 9.865 3.180 1.00 0.00 N ATOM 999 CA LYS B 19 15.715 10.837 2.440 1.00 0.00 C ATOM 1000 C LYS B 19 15.816 10.553 0.943 1.00 0.00 C ATOM 1001 O LYS B 19 16.680 11.105 0.262 1.00 0.00 O ATOM 1002 CB LYS B 19 17.091 10.923 3.061 1.00 0.00 C ATOM 1003 CG LYS B 19 17.208 11.978 4.140 1.00 0.00 C ATOM 1004 CD LYS B 19 18.438 12.841 3.934 1.00 0.00 C ATOM 1005 CE LYS B 19 19.331 12.826 5.157 1.00 0.00 C ATOM 1006 NZ LYS B 19 20.072 11.546 5.305 1.00 0.00 N ATOM 0 H LYS B 19 13.992 10.224 3.446 1.00 0.00 H new ATOM 0 HA LYS B 19 15.201 11.795 2.517 1.00 0.00 H new ATOM 0 HB2 LYS B 19 17.350 9.953 3.485 1.00 0.00 H new ATOM 0 HB3 LYS B 19 17.820 11.134 2.279 1.00 0.00 H new ATOM 0 HG2 LYS B 19 16.316 12.605 4.137 1.00 0.00 H new ATOM 0 HG3 LYS B 19 17.257 11.498 5.117 1.00 0.00 H new ATOM 0 HD2 LYS B 19 18.996 12.482 3.069 1.00 0.00 H new ATOM 0 HD3 LYS B 19 18.134 13.865 3.715 1.00 0.00 H new ATOM 0 HE2 LYS B 19 20.043 13.649 5.093 1.00 0.00 H new ATOM 0 HE3 LYS B 19 18.726 12.997 6.047 1.00 0.00 H new ATOM 0 HZ1 LYS B 19 20.668 11.586 6.156 1.00 0.00 H new ATOM 0 HZ2 LYS B 19 19.395 10.761 5.393 1.00 0.00 H new ATOM 0 HZ3 LYS B 19 20.672 11.393 4.469 1.00 0.00 H new ATOM 1020 N GLN B 20 14.935 9.720 0.420 1.00 0.00 N ATOM 1021 CA GLN B 20 14.946 9.416 -1.007 1.00 0.00 C ATOM 1022 C GLN B 20 13.565 9.659 -1.592 1.00 0.00 C ATOM 1023 O GLN B 20 12.618 8.989 -1.220 1.00 0.00 O ATOM 1024 CB GLN B 20 15.361 7.962 -1.248 1.00 0.00 C ATOM 1025 CG GLN B 20 16.754 7.627 -0.743 1.00 0.00 C ATOM 1026 CD GLN B 20 16.925 6.148 -0.457 1.00 0.00 C ATOM 1027 OE1 GLN B 20 17.304 5.372 -1.332 1.00 0.00 O ATOM 1028 NE2 GLN B 20 16.639 5.750 0.772 1.00 0.00 N ATOM 0 H GLN B 20 14.207 9.243 0.953 1.00 0.00 H new ATOM 0 HA GLN B 20 15.670 10.068 -1.496 1.00 0.00 H new ATOM 0 HB2 GLN B 20 14.641 7.304 -0.762 1.00 0.00 H new ATOM 0 HB3 GLN B 20 15.313 7.753 -2.317 1.00 0.00 H new ATOM 0 HG2 GLN B 20 17.491 7.939 -1.484 1.00 0.00 H new ATOM 0 HG3 GLN B 20 16.955 8.195 0.165 1.00 0.00 H new ATOM 0 HE21 GLN B 20 16.328 6.428 1.468 1.00 0.00 H new ATOM 0 HE22 GLN B 20 16.730 4.766 1.023 1.00 0.00 H new ATOM 1037 N ASP B 21 13.449 10.603 -2.509 1.00 0.00 N ATOM 1038 CA ASP B 21 12.154 10.907 -3.114 1.00 0.00 C ATOM 1039 C ASP B 21 11.904 9.989 -4.300 1.00 0.00 C ATOM 1040 O ASP B 21 12.847 9.484 -4.911 1.00 0.00 O ATOM 1041 CB ASP B 21 12.072 12.376 -3.548 1.00 0.00 C ATOM 1042 CG ASP B 21 10.655 12.929 -3.462 1.00 0.00 C ATOM 1043 OD1 ASP B 21 10.387 13.755 -2.558 1.00 0.00 O ATOM 1044 OD2 ASP B 21 9.806 12.540 -4.288 1.00 0.00 O ATOM 0 H ASP B 21 14.224 11.170 -2.852 1.00 0.00 H new ATOM 0 HA ASP B 21 11.381 10.738 -2.364 1.00 0.00 H new ATOM 0 HB2 ASP B 21 12.732 12.975 -2.920 1.00 0.00 H new ATOM 0 HB3 ASP B 21 12.434 12.470 -4.572 1.00 0.00 H new ATOM 1049 N GLY B 22 10.641 9.739 -4.597 1.00 0.00 N ATOM 1050 CA GLY B 22 10.304 8.875 -5.702 1.00 0.00 C ATOM 1051 C GLY B 22 8.814 8.688 -5.860 1.00 0.00 C ATOM 1052 O GLY B 22 8.034 9.600 -5.599 1.00 0.00 O ATOM 0 H GLY B 22 9.842 10.121 -4.091 1.00 0.00 H new ATOM 0 HA2 GLY B 22 10.714 9.292 -6.622 1.00 0.00 H new ATOM 0 HA3 GLY B 22 10.775 7.903 -5.555 1.00 0.00 H new ATOM 1056 N ALA B 23 8.417 7.506 -6.292 1.00 0.00 N ATOM 1057 CA ALA B 23 7.009 7.198 -6.491 1.00 0.00 C ATOM 1058 C ALA B 23 6.633 5.861 -5.870 1.00 0.00 C ATOM 1059 O ALA B 23 7.384 4.890 -5.947 1.00 0.00 O ATOM 1060 CB ALA B 23 6.677 7.209 -7.974 1.00 0.00 C ATOM 0 H ALA B 23 9.051 6.738 -6.513 1.00 0.00 H new ATOM 0 HA ALA B 23 6.423 7.968 -5.988 1.00 0.00 H new ATOM 0 HB1 ALA B 23 5.621 6.977 -8.112 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.889 8.195 -8.387 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.282 6.462 -8.488 1.00 0.00 H new ATOM 1066 N LEU B 24 5.460 5.826 -5.258 1.00 0.00 N ATOM 1067 CA LEU B 24 4.959 4.621 -4.619 1.00 0.00 C ATOM 1068 C LEU B 24 3.895 3.975 -5.493 1.00 0.00 C ATOM 1069 O LEU B 24 3.060 4.660 -6.078 1.00 0.00 O ATOM 1070 CB LEU B 24 4.380 4.945 -3.243 1.00 0.00 C ATOM 1071 CG LEU B 24 3.947 3.727 -2.432 1.00 0.00 C ATOM 1072 CD1 LEU B 24 5.134 3.106 -1.716 1.00 0.00 C ATOM 1073 CD2 LEU B 24 2.857 4.104 -1.442 1.00 0.00 C ATOM 0 H LEU B 24 4.832 6.627 -5.191 1.00 0.00 H new ATOM 0 HA LEU B 24 5.788 3.925 -4.491 1.00 0.00 H new ATOM 0 HB2 LEU B 24 5.125 5.499 -2.672 1.00 0.00 H new ATOM 0 HB3 LEU B 24 3.521 5.604 -3.371 1.00 0.00 H new ATOM 0 HG LEU B 24 3.542 2.985 -3.120 1.00 0.00 H new ATOM 0 HD11 LEU B 24 4.801 2.240 -1.144 1.00 0.00 H new ATOM 0 HD12 LEU B 24 5.878 2.794 -2.449 1.00 0.00 H new ATOM 0 HD13 LEU B 24 5.575 3.839 -1.040 1.00 0.00 H new ATOM 0 HD21 LEU B 24 2.561 3.222 -0.873 1.00 0.00 H new ATOM 0 HD22 LEU B 24 3.233 4.867 -0.760 1.00 0.00 H new ATOM 0 HD23 LEU B 24 1.994 4.494 -1.982 1.00 0.00 H new ATOM 1085 N TYR B 25 3.943 2.662 -5.599 1.00 0.00 N ATOM 1086 CA TYR B 25 2.981 1.928 -6.408 1.00 0.00 C ATOM 1087 C TYR B 25 2.398 0.746 -5.636 1.00 0.00 C ATOM 1088 O TYR B 25 3.124 -0.165 -5.233 1.00 0.00 O ATOM 1089 CB TYR B 25 3.640 1.424 -7.697 1.00 0.00 C ATOM 1090 CG TYR B 25 4.266 2.515 -8.540 1.00 0.00 C ATOM 1091 CD1 TYR B 25 3.507 3.237 -9.451 1.00 0.00 C ATOM 1092 CD2 TYR B 25 5.617 2.820 -8.425 1.00 0.00 C ATOM 1093 CE1 TYR B 25 4.075 4.231 -10.222 1.00 0.00 C ATOM 1094 CE2 TYR B 25 6.191 3.813 -9.192 1.00 0.00 C ATOM 1095 CZ TYR B 25 5.417 4.515 -10.090 1.00 0.00 C ATOM 1096 OH TYR B 25 5.985 5.509 -10.858 1.00 0.00 O ATOM 0 H TYR B 25 4.638 2.077 -5.135 1.00 0.00 H new ATOM 0 HA TYR B 25 2.170 2.612 -6.660 1.00 0.00 H new ATOM 0 HB2 TYR B 25 4.407 0.694 -7.438 1.00 0.00 H new ATOM 0 HB3 TYR B 25 2.892 0.902 -8.294 1.00 0.00 H new ATOM 0 HD1 TYR B 25 2.455 3.017 -9.558 1.00 0.00 H new ATOM 0 HD2 TYR B 25 6.228 2.271 -7.724 1.00 0.00 H new ATOM 0 HE1 TYR B 25 3.470 4.784 -10.926 1.00 0.00 H new ATOM 0 HE2 TYR B 25 7.242 4.039 -9.089 1.00 0.00 H new ATOM 0 HH TYR B 25 6.938 5.584 -10.643 1.00 0.00 H new ATOM 1106 N LEU B 26 1.089 0.771 -5.421 1.00 0.00 N ATOM 1107 CA LEU B 26 0.417 -0.317 -4.725 1.00 0.00 C ATOM 1108 C LEU B 26 0.088 -1.397 -5.733 1.00 0.00 C ATOM 1109 O LEU B 26 -0.456 -1.106 -6.796 1.00 0.00 O ATOM 1110 CB LEU B 26 -0.869 0.145 -4.038 1.00 0.00 C ATOM 1111 CG LEU B 26 -0.691 1.154 -2.907 1.00 0.00 C ATOM 1112 CD1 LEU B 26 -1.867 1.088 -1.946 1.00 0.00 C ATOM 1113 CD2 LEU B 26 0.607 0.915 -2.166 1.00 0.00 C ATOM 0 H LEU B 26 0.474 1.529 -5.717 1.00 0.00 H new ATOM 0 HA LEU B 26 1.084 -0.692 -3.949 1.00 0.00 H new ATOM 0 HB2 LEU B 26 -1.524 0.583 -4.791 1.00 0.00 H new ATOM 0 HB3 LEU B 26 -1.382 -0.731 -3.641 1.00 0.00 H new ATOM 0 HG LEU B 26 -0.653 2.151 -3.347 1.00 0.00 H new ATOM 0 HD11 LEU B 26 -1.724 1.814 -1.146 1.00 0.00 H new ATOM 0 HD12 LEU B 26 -2.788 1.316 -2.482 1.00 0.00 H new ATOM 0 HD13 LEU B 26 -1.933 0.087 -1.520 1.00 0.00 H new ATOM 0 HD21 LEU B 26 0.709 1.648 -1.365 1.00 0.00 H new ATOM 0 HD22 LEU B 26 0.604 -0.089 -1.741 1.00 0.00 H new ATOM 0 HD23 LEU B 26 1.444 1.014 -2.857 1.00 0.00 H new ATOM 1125 N MET B 27 0.410 -2.632 -5.415 1.00 0.00 N ATOM 1126 CA MET B 27 0.161 -3.726 -6.328 1.00 0.00 C ATOM 1127 C MET B 27 -0.806 -4.728 -5.720 1.00 0.00 C ATOM 1128 O MET B 27 -1.075 -4.686 -4.520 1.00 0.00 O ATOM 1129 CB MET B 27 1.469 -4.416 -6.694 1.00 0.00 C ATOM 1130 CG MET B 27 2.678 -3.497 -6.660 1.00 0.00 C ATOM 1131 SD MET B 27 4.142 -4.242 -7.393 1.00 0.00 S ATOM 1132 CE MET B 27 4.289 -3.234 -8.862 1.00 0.00 C ATOM 0 H MET B 27 0.844 -2.903 -4.533 1.00 0.00 H new ATOM 0 HA MET B 27 -0.290 -3.319 -7.233 1.00 0.00 H new ATOM 0 HB2 MET B 27 1.636 -5.246 -6.007 1.00 0.00 H new ATOM 0 HB3 MET B 27 1.377 -4.843 -7.693 1.00 0.00 H new ATOM 0 HG2 MET B 27 2.442 -2.574 -7.190 1.00 0.00 H new ATOM 0 HG3 MET B 27 2.893 -3.225 -5.627 1.00 0.00 H new ATOM 0 HE1 MET B 27 5.243 -3.436 -9.348 1.00 0.00 H new ATOM 0 HE2 MET B 27 3.475 -3.470 -9.548 1.00 0.00 H new ATOM 0 HE3 MET B 27 4.238 -2.180 -8.587 1.00 0.00 H new ATOM 1142 N ALA B 28 -1.297 -5.633 -6.557 1.00 0.00 N ATOM 1143 CA ALA B 28 -2.263 -6.652 -6.150 1.00 0.00 C ATOM 1144 C ALA B 28 -1.889 -7.362 -4.848 1.00 0.00 C ATOM 1145 O ALA B 28 -2.684 -7.397 -3.914 1.00 0.00 O ATOM 1146 CB ALA B 28 -2.441 -7.671 -7.263 1.00 0.00 C ATOM 0 H ALA B 28 -1.037 -5.683 -7.542 1.00 0.00 H new ATOM 0 HA ALA B 28 -3.201 -6.131 -5.960 1.00 0.00 H new ATOM 0 HB1 ALA B 28 -3.162 -8.427 -6.952 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -2.804 -7.170 -8.160 1.00 0.00 H new ATOM 0 HB3 ALA B 28 -1.484 -8.148 -7.476 1.00 0.00 H new ATOM 1152 N GLU B 29 -0.680 -7.903 -4.767 1.00 0.00 N ATOM 1153 CA GLU B 29 -0.271 -8.626 -3.567 1.00 0.00 C ATOM 1154 C GLU B 29 0.849 -7.929 -2.806 1.00 0.00 C ATOM 1155 O GLU B 29 1.401 -8.505 -1.864 1.00 0.00 O ATOM 1156 CB GLU B 29 0.195 -10.038 -3.926 1.00 0.00 C ATOM 1157 CG GLU B 29 -0.874 -10.921 -4.540 1.00 0.00 C ATOM 1158 CD GLU B 29 -0.467 -12.380 -4.549 1.00 0.00 C ATOM 1159 OE1 GLU B 29 -0.974 -13.148 -3.707 1.00 0.00 O ATOM 1160 OE2 GLU B 29 0.388 -12.758 -5.379 1.00 0.00 O ATOM 0 H GLU B 29 0.025 -7.857 -5.503 1.00 0.00 H new ATOM 0 HA GLU B 29 -1.150 -8.661 -2.923 1.00 0.00 H new ATOM 0 HB2 GLU B 29 1.030 -9.964 -4.622 1.00 0.00 H new ATOM 0 HB3 GLU B 29 0.573 -10.521 -3.025 1.00 0.00 H new ATOM 0 HG2 GLU B 29 -1.803 -10.807 -3.982 1.00 0.00 H new ATOM 0 HG3 GLU B 29 -1.073 -10.594 -5.560 1.00 0.00 H new ATOM 1167 N ARG B 30 1.179 -6.693 -3.158 1.00 0.00 N ATOM 1168 CA ARG B 30 2.278 -6.023 -2.472 1.00 0.00 C ATOM 1169 C ARG B 30 2.282 -4.518 -2.692 1.00 0.00 C ATOM 1170 O ARG B 30 1.509 -3.987 -3.472 1.00 0.00 O ATOM 1171 CB ARG B 30 3.617 -6.603 -2.953 1.00 0.00 C ATOM 1172 CG ARG B 30 4.141 -5.973 -4.236 1.00 0.00 C ATOM 1173 CD ARG B 30 5.434 -6.624 -4.687 1.00 0.00 C ATOM 1174 NE ARG B 30 5.196 -7.894 -5.366 1.00 0.00 N ATOM 1175 CZ ARG B 30 6.157 -8.674 -5.850 1.00 0.00 C ATOM 1176 NH1 ARG B 30 7.434 -8.341 -5.690 1.00 0.00 N ATOM 1177 NH2 ARG B 30 5.838 -9.793 -6.488 1.00 0.00 N ATOM 0 H ARG B 30 0.720 -6.149 -3.889 1.00 0.00 H new ATOM 0 HA ARG B 30 2.139 -6.198 -1.405 1.00 0.00 H new ATOM 0 HB2 ARG B 30 4.361 -6.473 -2.167 1.00 0.00 H new ATOM 0 HB3 ARG B 30 3.501 -7.676 -3.108 1.00 0.00 H new ATOM 0 HG2 ARG B 30 3.391 -6.068 -5.022 1.00 0.00 H new ATOM 0 HG3 ARG B 30 4.305 -4.907 -4.079 1.00 0.00 H new ATOM 0 HD2 ARG B 30 5.966 -5.948 -5.357 1.00 0.00 H new ATOM 0 HD3 ARG B 30 6.078 -6.789 -3.823 1.00 0.00 H new ATOM 0 HE ARG B 30 4.230 -8.203 -5.476 1.00 0.00 H new ATOM 0 HH11 ARG B 30 7.679 -7.484 -5.194 1.00 0.00 H new ATOM 0 HH12 ARG B 30 8.168 -8.942 -6.063 1.00 0.00 H new ATOM 0 HH21 ARG B 30 4.858 -10.052 -6.605 1.00 0.00 H new ATOM 0 HH22 ARG B 30 6.572 -10.394 -6.861 1.00 0.00 H new ATOM 1191 N ILE B 31 3.167 -3.850 -1.976 1.00 0.00 N ATOM 1192 CA ILE B 31 3.355 -2.418 -2.089 1.00 0.00 C ATOM 1193 C ILE B 31 4.823 -2.166 -2.404 1.00 0.00 C ATOM 1194 O ILE B 31 5.709 -2.662 -1.701 1.00 0.00 O ATOM 1195 CB ILE B 31 2.942 -1.670 -0.795 1.00 0.00 C ATOM 1196 CG1 ILE B 31 3.524 -0.251 -0.773 1.00 0.00 C ATOM 1197 CG2 ILE B 31 3.378 -2.447 0.436 1.00 0.00 C ATOM 1198 CD1 ILE B 31 3.093 0.568 0.427 1.00 0.00 C ATOM 0 H ILE B 31 3.782 -4.292 -1.293 1.00 0.00 H new ATOM 0 HA ILE B 31 2.715 -2.034 -2.884 1.00 0.00 H new ATOM 0 HB ILE B 31 1.855 -1.590 -0.783 1.00 0.00 H new ATOM 0 HG12 ILE B 31 4.612 -0.314 -0.786 1.00 0.00 H new ATOM 0 HG13 ILE B 31 3.224 0.269 -1.683 1.00 0.00 H new ATOM 0 HG21 ILE B 31 3.079 -1.905 1.333 1.00 0.00 H new ATOM 0 HG22 ILE B 31 2.907 -3.430 0.432 1.00 0.00 H new ATOM 0 HG23 ILE B 31 4.462 -2.564 0.427 1.00 0.00 H new ATOM 0 HD11 ILE B 31 3.544 1.559 0.373 1.00 0.00 H new ATOM 0 HD12 ILE B 31 2.007 0.664 0.431 1.00 0.00 H new ATOM 0 HD13 ILE B 31 3.417 0.071 1.342 1.00 0.00 H new ATOM 1210 N ALA B 32 5.090 -1.439 -3.471 1.00 0.00 N ATOM 1211 CA ALA B 32 6.462 -1.177 -3.862 1.00 0.00 C ATOM 1212 C ALA B 32 6.724 0.306 -4.054 1.00 0.00 C ATOM 1213 O ALA B 32 5.824 1.074 -4.393 1.00 0.00 O ATOM 1214 CB ALA B 32 6.797 -1.948 -5.125 1.00 0.00 C ATOM 0 H ALA B 32 4.384 -1.023 -4.078 1.00 0.00 H new ATOM 0 HA ALA B 32 7.110 -1.515 -3.053 1.00 0.00 H new ATOM 0 HB1 ALA B 32 7.829 -1.746 -5.412 1.00 0.00 H new ATOM 0 HB2 ALA B 32 6.674 -3.016 -4.943 1.00 0.00 H new ATOM 0 HB3 ALA B 32 6.129 -1.637 -5.929 1.00 0.00 H new ATOM 1220 N TRP B 33 7.965 0.695 -3.828 1.00 0.00 N ATOM 1221 CA TRP B 33 8.379 2.076 -3.975 1.00 0.00 C ATOM 1222 C TRP B 33 9.614 2.158 -4.857 1.00 0.00 C ATOM 1223 O TRP B 33 10.562 1.386 -4.686 1.00 0.00 O ATOM 1224 CB TRP B 33 8.674 2.696 -2.605 1.00 0.00 C ATOM 1225 CG TRP B 33 9.201 4.099 -2.683 1.00 0.00 C ATOM 1226 CD1 TRP B 33 8.469 5.249 -2.729 1.00 0.00 C ATOM 1227 CD2 TRP B 33 10.577 4.497 -2.728 1.00 0.00 C ATOM 1228 NE1 TRP B 33 9.305 6.334 -2.804 1.00 0.00 N ATOM 1229 CE2 TRP B 33 10.602 5.899 -2.806 1.00 0.00 C ATOM 1230 CE3 TRP B 33 11.790 3.802 -2.713 1.00 0.00 C ATOM 1231 CZ2 TRP B 33 11.789 6.620 -2.869 1.00 0.00 C ATOM 1232 CZ3 TRP B 33 12.969 4.520 -2.775 1.00 0.00 C ATOM 1233 CH2 TRP B 33 12.960 5.916 -2.852 1.00 0.00 C ATOM 0 H TRP B 33 8.712 0.064 -3.538 1.00 0.00 H new ATOM 0 HA TRP B 33 7.568 2.634 -4.443 1.00 0.00 H new ATOM 0 HB2 TRP B 33 7.761 2.692 -2.009 1.00 0.00 H new ATOM 0 HB3 TRP B 33 9.399 2.073 -2.082 1.00 0.00 H new ATOM 0 HD1 TRP B 33 7.390 5.298 -2.709 1.00 0.00 H new ATOM 0 HE1 TRP B 33 9.007 7.308 -2.851 1.00 0.00 H new ATOM 0 HE3 TRP B 33 11.805 2.724 -2.654 1.00 0.00 H new ATOM 0 HZ2 TRP B 33 11.786 7.698 -2.929 1.00 0.00 H new ATOM 0 HZ3 TRP B 33 13.912 3.994 -2.764 1.00 0.00 H new ATOM 0 HH2 TRP B 33 13.898 6.449 -2.899 1.00 0.00 H new ATOM 1244 N ALA B 34 9.591 3.085 -5.795 1.00 0.00 N ATOM 1245 CA ALA B 34 10.705 3.293 -6.700 1.00 0.00 C ATOM 1246 C ALA B 34 11.158 4.743 -6.623 1.00 0.00 C ATOM 1247 O ALA B 34 10.327 5.646 -6.565 1.00 0.00 O ATOM 1248 CB ALA B 34 10.307 2.933 -8.124 1.00 0.00 C ATOM 0 H ALA B 34 8.803 3.713 -5.951 1.00 0.00 H new ATOM 0 HA ALA B 34 11.531 2.646 -6.405 1.00 0.00 H new ATOM 0 HB1 ALA B 34 11.154 3.095 -8.791 1.00 0.00 H new ATOM 0 HB2 ALA B 34 10.008 1.886 -8.165 1.00 0.00 H new ATOM 0 HB3 ALA B 34 9.473 3.561 -8.438 1.00 0.00 H new ATOM 1254 N PRO B 35 12.477 4.984 -6.596 1.00 0.00 N ATOM 1255 CA PRO B 35 13.027 6.341 -6.525 1.00 0.00 C ATOM 1256 C PRO B 35 12.607 7.199 -7.723 1.00 0.00 C ATOM 1257 O PRO B 35 12.081 6.693 -8.720 1.00 0.00 O ATOM 1258 CB PRO B 35 14.544 6.123 -6.520 1.00 0.00 C ATOM 1259 CG PRO B 35 14.733 4.702 -6.110 1.00 0.00 C ATOM 1260 CD PRO B 35 13.531 3.960 -6.621 1.00 0.00 C ATOM 0 HA PRO B 35 12.666 6.879 -5.649 1.00 0.00 H new ATOM 0 HB2 PRO B 35 14.972 6.309 -7.505 1.00 0.00 H new ATOM 0 HB3 PRO B 35 15.037 6.802 -5.825 1.00 0.00 H new ATOM 0 HG2 PRO B 35 15.652 4.293 -6.531 1.00 0.00 H new ATOM 0 HG3 PRO B 35 14.813 4.616 -5.026 1.00 0.00 H new ATOM 0 HD2 PRO B 35 13.693 3.572 -7.627 1.00 0.00 H new ATOM 0 HD3 PRO B 35 13.282 3.109 -5.987 1.00 0.00 H new ATOM 1368 N THR B 42 13.028 -0.251 -5.134 1.00 0.00 N ATOM 1369 CA THR B 42 14.005 -0.661 -4.140 1.00 0.00 C ATOM 1370 C THR B 42 13.301 -1.198 -2.902 1.00 0.00 C ATOM 1371 O THR B 42 13.867 -1.970 -2.127 1.00 0.00 O ATOM 1372 CB THR B 42 14.917 0.514 -3.754 1.00 0.00 C ATOM 1373 OG1 THR B 42 14.196 1.748 -3.888 1.00 0.00 O ATOM 1374 CG2 THR B 42 16.159 0.549 -4.632 1.00 0.00 C ATOM 0 HA THR B 42 14.621 -1.450 -4.572 1.00 0.00 H new ATOM 0 HB THR B 42 15.231 0.381 -2.719 1.00 0.00 H new ATOM 0 HG1 THR B 42 13.402 1.604 -4.444 1.00 0.00 H new ATOM 0 HG21 THR B 42 16.788 1.389 -4.339 1.00 0.00 H new ATOM 0 HG22 THR B 42 16.716 -0.380 -4.512 1.00 0.00 H new ATOM 0 HG23 THR B 42 15.864 0.663 -5.675 1.00 0.00 H new ATOM 1382 N ILE B 43 12.057 -0.778 -2.727 1.00 0.00 N ATOM 1383 CA ILE B 43 11.249 -1.210 -1.600 1.00 0.00 C ATOM 1384 C ILE B 43 10.086 -2.057 -2.099 1.00 0.00 C ATOM 1385 O ILE B 43 9.255 -1.577 -2.865 1.00 0.00 O ATOM 1386 CB ILE B 43 10.691 -0.006 -0.808 1.00 0.00 C ATOM 1387 CG1 ILE B 43 11.827 0.903 -0.328 1.00 0.00 C ATOM 1388 CG2 ILE B 43 9.853 -0.482 0.371 1.00 0.00 C ATOM 1389 CD1 ILE B 43 12.750 0.252 0.680 1.00 0.00 C ATOM 0 H ILE B 43 11.583 -0.132 -3.359 1.00 0.00 H new ATOM 0 HA ILE B 43 11.887 -1.794 -0.937 1.00 0.00 H new ATOM 0 HB ILE B 43 10.051 0.572 -1.475 1.00 0.00 H new ATOM 0 HG12 ILE B 43 12.413 1.221 -1.190 1.00 0.00 H new ATOM 0 HG13 ILE B 43 11.398 1.802 0.115 1.00 0.00 H new ATOM 0 HG21 ILE B 43 9.469 0.380 0.916 1.00 0.00 H new ATOM 0 HG22 ILE B 43 9.019 -1.081 0.006 1.00 0.00 H new ATOM 0 HG23 ILE B 43 10.470 -1.086 1.036 1.00 0.00 H new ATOM 0 HD11 ILE B 43 13.527 0.959 0.971 1.00 0.00 H new ATOM 0 HD12 ILE B 43 12.178 -0.041 1.560 1.00 0.00 H new ATOM 0 HD13 ILE B 43 13.210 -0.631 0.235 1.00 0.00 H new ATOM 1401 N SER B 44 10.042 -3.314 -1.691 1.00 0.00 N ATOM 1402 CA SER B 44 8.975 -4.204 -2.104 1.00 0.00 C ATOM 1403 C SER B 44 8.489 -5.029 -0.916 1.00 0.00 C ATOM 1404 O SER B 44 9.196 -5.911 -0.434 1.00 0.00 O ATOM 1405 CB SER B 44 9.472 -5.120 -3.226 1.00 0.00 C ATOM 1406 OG SER B 44 8.408 -5.534 -4.071 1.00 0.00 O ATOM 0 H SER B 44 10.734 -3.740 -1.074 1.00 0.00 H new ATOM 0 HA SER B 44 8.139 -3.613 -2.477 1.00 0.00 H new ATOM 0 HB2 SER B 44 10.225 -4.598 -3.817 1.00 0.00 H new ATOM 0 HB3 SER B 44 9.957 -5.996 -2.794 1.00 0.00 H new ATOM 0 HG SER B 44 8.771 -5.834 -4.931 1.00 0.00 H new ATOM 1412 N HIS B 45 7.293 -4.720 -0.437 1.00 0.00 N ATOM 1413 CA HIS B 45 6.710 -5.437 0.693 1.00 0.00 C ATOM 1414 C HIS B 45 5.391 -6.051 0.299 1.00 0.00 C ATOM 1415 O HIS B 45 4.519 -5.370 -0.235 1.00 0.00 O ATOM 1416 CB HIS B 45 6.485 -4.504 1.885 1.00 0.00 C ATOM 1417 CG HIS B 45 7.737 -4.073 2.579 1.00 0.00 C ATOM 1418 ND1 HIS B 45 8.486 -4.890 3.390 1.00 0.00 N ATOM 1419 CD2 HIS B 45 8.352 -2.867 2.592 1.00 0.00 C ATOM 1420 CE1 HIS B 45 9.509 -4.173 3.867 1.00 0.00 C ATOM 1421 NE2 HIS B 45 9.476 -2.935 3.409 1.00 0.00 N ATOM 0 H HIS B 45 6.704 -3.976 -0.813 1.00 0.00 H new ATOM 0 HA HIS B 45 7.412 -6.219 0.982 1.00 0.00 H new ATOM 0 HB2 HIS B 45 5.952 -3.618 1.541 1.00 0.00 H new ATOM 0 HB3 HIS B 45 5.839 -5.005 2.606 1.00 0.00 H new ATOM 0 HD1 HIS B 45 8.295 -5.871 3.593 1.00 0.00 H new ATOM 0 HD2 HIS B 45 8.022 -1.991 2.053 1.00 0.00 H new ATOM 0 HE1 HIS B 45 10.263 -4.556 4.539 1.00 0.00 H new ATOM 1429 N MET B 46 5.242 -7.334 0.552 1.00 0.00 N ATOM 1430 CA MET B 46 4.008 -8.010 0.236 1.00 0.00 C ATOM 1431 C MET B 46 3.044 -7.828 1.387 1.00 0.00 C ATOM 1432 O MET B 46 3.456 -7.670 2.535 1.00 0.00 O ATOM 1433 CB MET B 46 4.238 -9.499 -0.021 1.00 0.00 C ATOM 1434 CG MET B 46 4.766 -9.813 -1.411 1.00 0.00 C ATOM 1435 SD MET B 46 3.828 -11.124 -2.220 1.00 0.00 S ATOM 1436 CE MET B 46 3.703 -12.308 -0.879 1.00 0.00 C ATOM 0 H MET B 46 5.958 -7.925 0.974 1.00 0.00 H new ATOM 0 HA MET B 46 3.594 -7.578 -0.675 1.00 0.00 H new ATOM 0 HB2 MET B 46 4.942 -9.880 0.718 1.00 0.00 H new ATOM 0 HB3 MET B 46 3.299 -10.032 0.129 1.00 0.00 H new ATOM 0 HG2 MET B 46 4.729 -8.912 -2.023 1.00 0.00 H new ATOM 0 HG3 MET B 46 5.813 -10.108 -1.341 1.00 0.00 H new ATOM 0 HE1 MET B 46 3.675 -13.318 -1.287 1.00 0.00 H new ATOM 0 HE2 MET B 46 4.567 -12.206 -0.222 1.00 0.00 H new ATOM 0 HE3 MET B 46 2.791 -12.121 -0.312 1.00 0.00 H new ATOM 1446 N TYR B 47 1.763 -7.832 1.081 1.00 0.00 N ATOM 1447 CA TYR B 47 0.738 -7.675 2.108 1.00 0.00 C ATOM 1448 C TYR B 47 0.805 -8.834 3.097 1.00 0.00 C ATOM 1449 O TYR B 47 0.388 -8.714 4.247 1.00 0.00 O ATOM 1450 CB TYR B 47 -0.655 -7.598 1.481 1.00 0.00 C ATOM 1451 CG TYR B 47 -0.828 -6.447 0.516 1.00 0.00 C ATOM 1452 CD1 TYR B 47 -1.603 -6.586 -0.628 1.00 0.00 C ATOM 1453 CD2 TYR B 47 -0.213 -5.223 0.745 1.00 0.00 C ATOM 1454 CE1 TYR B 47 -1.760 -5.539 -1.513 1.00 0.00 C ATOM 1455 CE2 TYR B 47 -0.367 -4.171 -0.136 1.00 0.00 C ATOM 1456 CZ TYR B 47 -1.140 -4.334 -1.263 1.00 0.00 C ATOM 1457 OH TYR B 47 -1.294 -3.292 -2.144 1.00 0.00 O ATOM 0 H TYR B 47 1.401 -7.942 0.134 1.00 0.00 H new ATOM 0 HA TYR B 47 0.926 -6.742 2.639 1.00 0.00 H new ATOM 0 HB2 TYR B 47 -0.860 -8.532 0.958 1.00 0.00 H new ATOM 0 HB3 TYR B 47 -1.396 -7.508 2.275 1.00 0.00 H new ATOM 0 HD1 TYR B 47 -2.091 -7.529 -0.828 1.00 0.00 H new ATOM 0 HD2 TYR B 47 0.396 -5.092 1.627 1.00 0.00 H new ATOM 0 HE1 TYR B 47 -2.366 -5.663 -2.398 1.00 0.00 H new ATOM 0 HE2 TYR B 47 0.117 -3.225 0.058 1.00 0.00 H new ATOM 0 HH TYR B 47 -1.239 -3.629 -3.062 1.00 0.00 H new ATOM 1467 N ALA B 48 1.377 -9.941 2.638 1.00 0.00 N ATOM 1468 CA ALA B 48 1.512 -11.140 3.450 1.00 0.00 C ATOM 1469 C ALA B 48 2.640 -11.009 4.471 1.00 0.00 C ATOM 1470 O ALA B 48 2.852 -11.904 5.283 1.00 0.00 O ATOM 1471 CB ALA B 48 1.742 -12.348 2.553 1.00 0.00 C ATOM 0 H ALA B 48 1.758 -10.031 1.696 1.00 0.00 H new ATOM 0 HA ALA B 48 0.585 -11.276 4.007 1.00 0.00 H new ATOM 0 HB1 ALA B 48 1.842 -13.243 3.167 1.00 0.00 H new ATOM 0 HB2 ALA B 48 0.896 -12.465 1.876 1.00 0.00 H new ATOM 0 HB3 ALA B 48 2.653 -12.202 1.973 1.00 0.00 H new ATOM 1477 N ASP B 49 3.375 -9.903 4.421 1.00 0.00 N ATOM 1478 CA ASP B 49 4.462 -9.679 5.366 1.00 0.00 C ATOM 1479 C ASP B 49 4.131 -8.504 6.274 1.00 0.00 C ATOM 1480 O ASP B 49 4.849 -8.226 7.236 1.00 0.00 O ATOM 1481 CB ASP B 49 5.791 -9.380 4.653 1.00 0.00 C ATOM 1482 CG ASP B 49 5.935 -10.038 3.293 1.00 0.00 C ATOM 1483 OD1 ASP B 49 5.783 -11.273 3.199 1.00 0.00 O ATOM 1484 OD2 ASP B 49 6.216 -9.307 2.314 1.00 0.00 O ATOM 0 H ASP B 49 3.239 -9.154 3.742 1.00 0.00 H new ATOM 0 HA ASP B 49 4.573 -10.595 5.946 1.00 0.00 H new ATOM 0 HB2 ASP B 49 5.890 -8.301 4.533 1.00 0.00 H new ATOM 0 HB3 ASP B 49 6.613 -9.707 5.290 1.00 0.00 H new ATOM 1489 N ILE B 50 3.031 -7.826 5.979 1.00 0.00 N ATOM 1490 CA ILE B 50 2.630 -6.656 6.746 1.00 0.00 C ATOM 1491 C ILE B 50 1.605 -7.016 7.830 1.00 0.00 C ATOM 1492 O ILE B 50 0.550 -7.586 7.542 1.00 0.00 O ATOM 1493 CB ILE B 50 2.042 -5.570 5.819 1.00 0.00 C ATOM 1494 CG1 ILE B 50 2.983 -5.314 4.637 1.00 0.00 C ATOM 1495 CG2 ILE B 50 1.803 -4.285 6.594 1.00 0.00 C ATOM 1496 CD1 ILE B 50 2.402 -4.402 3.578 1.00 0.00 C ATOM 0 H ILE B 50 2.401 -8.066 5.214 1.00 0.00 H new ATOM 0 HA ILE B 50 3.525 -6.268 7.233 1.00 0.00 H new ATOM 0 HB ILE B 50 1.086 -5.923 5.432 1.00 0.00 H new ATOM 0 HG12 ILE B 50 3.909 -4.877 5.010 1.00 0.00 H new ATOM 0 HG13 ILE B 50 3.243 -6.268 4.178 1.00 0.00 H new ATOM 0 HG21 ILE B 50 1.388 -3.529 5.927 1.00 0.00 H new ATOM 0 HG22 ILE B 50 1.102 -4.475 7.407 1.00 0.00 H new ATOM 0 HG23 ILE B 50 2.747 -3.927 7.005 1.00 0.00 H new ATOM 0 HD11 ILE B 50 3.127 -4.269 2.775 1.00 0.00 H new ATOM 0 HD12 ILE B 50 1.492 -4.846 3.175 1.00 0.00 H new ATOM 0 HD13 ILE B 50 2.169 -3.433 4.020 1.00 0.00 H new ATOM 1508 N LYS B 51 1.918 -6.674 9.078 1.00 0.00 N ATOM 1509 CA LYS B 51 1.026 -6.949 10.202 1.00 0.00 C ATOM 1510 C LYS B 51 -0.107 -5.931 10.222 1.00 0.00 C ATOM 1511 O LYS B 51 -1.274 -6.283 10.383 1.00 0.00 O ATOM 1512 CB LYS B 51 1.804 -6.909 11.531 1.00 0.00 C ATOM 1513 CG LYS B 51 1.010 -7.396 12.745 1.00 0.00 C ATOM 1514 CD LYS B 51 0.287 -6.259 13.465 1.00 0.00 C ATOM 1515 CE LYS B 51 1.212 -5.496 14.409 1.00 0.00 C ATOM 1516 NZ LYS B 51 0.491 -4.416 15.149 1.00 0.00 N ATOM 0 H LYS B 51 2.786 -6.204 9.337 1.00 0.00 H new ATOM 0 HA LYS B 51 0.605 -7.947 10.081 1.00 0.00 H new ATOM 0 HB2 LYS B 51 2.701 -7.520 11.431 1.00 0.00 H new ATOM 0 HB3 LYS B 51 2.133 -5.886 11.714 1.00 0.00 H new ATOM 0 HG2 LYS B 51 0.281 -8.140 12.424 1.00 0.00 H new ATOM 0 HG3 LYS B 51 1.686 -7.892 13.442 1.00 0.00 H new ATOM 0 HD2 LYS B 51 -0.127 -5.570 12.729 1.00 0.00 H new ATOM 0 HD3 LYS B 51 -0.552 -6.664 14.030 1.00 0.00 H new ATOM 0 HE2 LYS B 51 1.655 -6.191 15.123 1.00 0.00 H new ATOM 0 HE3 LYS B 51 2.032 -5.059 13.839 1.00 0.00 H new ATOM 0 HZ1 LYS B 51 1.124 -4.002 15.863 1.00 0.00 H new ATOM 0 HZ2 LYS B 51 0.192 -3.677 14.481 1.00 0.00 H new ATOM 0 HZ3 LYS B 51 -0.346 -4.816 15.619 1.00 0.00 H new ATOM 1530 N CYS B 52 0.258 -4.673 10.048 1.00 0.00 N ATOM 1531 CA CYS B 52 -0.694 -3.573 10.033 1.00 0.00 C ATOM 1532 C CYS B 52 -0.034 -2.370 9.393 1.00 0.00 C ATOM 1533 O CYS B 52 1.125 -2.444 8.983 1.00 0.00 O ATOM 1534 CB CYS B 52 -1.144 -3.219 11.447 1.00 0.00 C ATOM 1535 SG CYS B 52 0.226 -2.858 12.566 1.00 0.00 S ATOM 0 H CYS B 52 1.227 -4.383 9.912 1.00 0.00 H new ATOM 0 HA CYS B 52 -1.574 -3.872 9.464 1.00 0.00 H new ATOM 0 HB2 CYS B 52 -1.806 -2.354 11.404 1.00 0.00 H new ATOM 0 HB3 CYS B 52 -1.727 -4.046 11.853 1.00 0.00 H new ATOM 0 HG CYS B 52 -0.218 -2.208 13.600 1.00 0.00 H new ATOM 1541 N GLN B 53 -0.735 -1.260 9.327 1.00 0.00 N ATOM 1542 CA GLN B 53 -0.183 -0.083 8.728 1.00 0.00 C ATOM 1543 C GLN B 53 -0.354 1.051 9.716 1.00 0.00 C ATOM 1544 O GLN B 53 -1.071 0.898 10.686 1.00 0.00 O ATOM 1545 CB GLN B 53 -0.918 0.179 7.410 1.00 0.00 C ATOM 1546 CG GLN B 53 -2.415 -0.038 7.526 1.00 0.00 C ATOM 1547 CD GLN B 53 -3.208 0.598 6.408 1.00 0.00 C ATOM 1548 OE1 GLN B 53 -4.296 0.143 6.079 1.00 0.00 O ATOM 1549 NE2 GLN B 53 -2.680 1.661 5.826 1.00 0.00 N ATOM 0 H GLN B 53 -1.685 -1.156 9.682 1.00 0.00 H new ATOM 0 HA GLN B 53 0.878 -0.189 8.500 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -0.726 1.203 7.088 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -0.518 -0.478 6.638 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -2.618 -1.109 7.540 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -2.759 0.365 8.479 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -1.771 2.009 6.129 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -3.182 2.133 5.074 1.00 0.00 H new ATOM 1558 N LYS B 54 0.369 2.130 9.538 1.00 0.00 N ATOM 1559 CA LYS B 54 0.241 3.291 10.397 1.00 0.00 C ATOM 1560 C LYS B 54 0.371 4.504 9.522 1.00 0.00 C ATOM 1561 O LYS B 54 0.784 4.393 8.373 1.00 0.00 O ATOM 1562 CB LYS B 54 1.323 3.342 11.479 1.00 0.00 C ATOM 1563 CG LYS B 54 1.783 1.994 11.984 1.00 0.00 C ATOM 1564 CD LYS B 54 1.427 1.827 13.440 1.00 0.00 C ATOM 1565 CE LYS B 54 2.541 2.281 14.359 1.00 0.00 C ATOM 1566 NZ LYS B 54 2.197 2.039 15.786 1.00 0.00 N ATOM 0 H LYS B 54 1.062 2.232 8.797 1.00 0.00 H new ATOM 0 HA LYS B 54 -0.721 3.247 10.908 1.00 0.00 H new ATOM 0 HB2 LYS B 54 2.185 3.879 11.085 1.00 0.00 H new ATOM 0 HB3 LYS B 54 0.946 3.920 12.322 1.00 0.00 H new ATOM 0 HG2 LYS B 54 1.319 1.201 11.397 1.00 0.00 H new ATOM 0 HG3 LYS B 54 2.861 1.898 11.854 1.00 0.00 H new ATOM 0 HD2 LYS B 54 0.524 2.397 13.659 1.00 0.00 H new ATOM 0 HD3 LYS B 54 1.199 0.780 13.638 1.00 0.00 H new ATOM 0 HE2 LYS B 54 3.460 1.751 14.109 1.00 0.00 H new ATOM 0 HE3 LYS B 54 2.733 3.343 14.204 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 2.936 1.456 16.227 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 2.129 2.948 16.286 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 1.284 1.544 15.844 1.00 0.00 H new ATOM 1580 N ILE B 55 -0.006 5.642 10.033 1.00 0.00 N ATOM 1581 CA ILE B 55 0.098 6.867 9.252 1.00 0.00 C ATOM 1582 C ILE B 55 0.491 8.029 10.126 1.00 0.00 C ATOM 1583 O ILE B 55 -0.060 8.169 11.187 1.00 0.00 O ATOM 1584 CB ILE B 55 -1.266 7.215 8.618 1.00 0.00 C ATOM 1585 CG1 ILE B 55 -2.345 6.969 9.660 1.00 0.00 C ATOM 1586 CG2 ILE B 55 -1.525 6.401 7.364 1.00 0.00 C ATOM 1587 CD1 ILE B 55 -3.765 7.209 9.229 1.00 0.00 C ATOM 0 H ILE B 55 -0.385 5.759 10.973 1.00 0.00 H new ATOM 0 HA ILE B 55 0.853 6.697 8.484 1.00 0.00 H new ATOM 0 HB ILE B 55 -1.269 8.261 8.313 1.00 0.00 H new ATOM 0 HG12 ILE B 55 -2.262 5.936 9.999 1.00 0.00 H new ATOM 0 HG13 ILE B 55 -2.138 7.605 10.521 1.00 0.00 H new ATOM 0 HG21 ILE B 55 -2.494 6.674 6.947 1.00 0.00 H new ATOM 0 HG22 ILE B 55 -0.744 6.604 6.631 1.00 0.00 H new ATOM 0 HG23 ILE B 55 -1.523 5.340 7.612 1.00 0.00 H new ATOM 0 HD11 ILE B 55 -4.438 6.999 10.060 1.00 0.00 H new ATOM 0 HD12 ILE B 55 -3.881 8.248 8.922 1.00 0.00 H new ATOM 0 HD13 ILE B 55 -4.007 6.554 8.392 1.00 0.00 H new ATOM 1599 N SER B 56 1.455 8.846 9.732 1.00 0.00 N ATOM 1600 CA SER B 56 1.753 9.999 10.550 1.00 0.00 C ATOM 1601 C SER B 56 0.553 10.900 10.396 1.00 0.00 C ATOM 1602 O SER B 56 0.312 11.422 9.288 1.00 0.00 O ATOM 1603 CB SER B 56 3.053 10.699 10.165 1.00 0.00 C ATOM 1604 OG SER B 56 3.331 10.559 8.801 1.00 0.00 O ATOM 0 H SER B 56 2.019 8.738 8.889 1.00 0.00 H new ATOM 0 HA SER B 56 1.922 9.708 11.587 1.00 0.00 H new ATOM 0 HB2 SER B 56 2.985 11.758 10.416 1.00 0.00 H new ATOM 0 HB3 SER B 56 3.876 10.286 10.749 1.00 0.00 H new ATOM 0 HG SER B 56 3.547 11.436 8.419 1.00 0.00 H new ATOM 1610 N PRO B 57 -0.220 11.007 11.508 1.00 0.00 N ATOM 1611 CA PRO B 57 -1.495 11.728 11.600 1.00 0.00 C ATOM 1612 C PRO B 57 -1.437 13.178 11.132 1.00 0.00 C ATOM 1613 O PRO B 57 -0.358 13.758 10.966 1.00 0.00 O ATOM 1614 CB PRO B 57 -1.824 11.708 13.103 1.00 0.00 C ATOM 1615 CG PRO B 57 -0.556 11.325 13.778 1.00 0.00 C ATOM 1616 CD PRO B 57 0.148 10.442 12.815 1.00 0.00 C ATOM 0 HA PRO B 57 -2.233 11.252 10.954 1.00 0.00 H new ATOM 0 HB2 PRO B 57 -2.171 12.684 13.443 1.00 0.00 H new ATOM 0 HB3 PRO B 57 -2.618 10.994 13.322 1.00 0.00 H new ATOM 0 HG2 PRO B 57 0.043 12.203 14.017 1.00 0.00 H new ATOM 0 HG3 PRO B 57 -0.751 10.807 14.717 1.00 0.00 H new ATOM 0 HD2 PRO B 57 1.227 10.456 12.970 1.00 0.00 H new ATOM 0 HD3 PRO B 57 -0.174 9.405 12.910 1.00 0.00 H new ATOM 1624 N GLU B 58 -2.615 13.760 10.941 1.00 0.00 N ATOM 1625 CA GLU B 58 -2.728 15.151 10.540 1.00 0.00 C ATOM 1626 C GLU B 58 -2.166 16.034 11.645 1.00 0.00 C ATOM 1627 O GLU B 58 -2.450 15.824 12.824 1.00 0.00 O ATOM 1628 CB GLU B 58 -4.191 15.514 10.267 1.00 0.00 C ATOM 1629 CG GLU B 58 -4.627 15.283 8.827 1.00 0.00 C ATOM 1630 CD GLU B 58 -4.033 14.026 8.224 1.00 0.00 C ATOM 1631 OE1 GLU B 58 -4.369 12.916 8.692 1.00 0.00 O ATOM 1632 OE2 GLU B 58 -3.232 14.143 7.281 1.00 0.00 O ATOM 0 H GLU B 58 -3.509 13.284 11.059 1.00 0.00 H new ATOM 0 HA GLU B 58 -2.162 15.308 9.622 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -4.830 14.928 10.928 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -4.348 16.563 10.520 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -5.714 15.219 8.788 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -4.336 16.142 8.223 1.00 0.00 H new ATOM 1639 N GLY B 59 -1.376 17.018 11.263 1.00 0.00 N ATOM 1640 CA GLY B 59 -0.767 17.894 12.237 1.00 0.00 C ATOM 1641 C GLY B 59 0.734 17.721 12.256 1.00 0.00 C ATOM 1642 O GLY B 59 1.466 18.624 12.661 1.00 0.00 O ATOM 0 H GLY B 59 -1.144 17.228 10.292 1.00 0.00 H new ATOM 0 HA2 GLY B 59 -1.014 18.930 12.005 1.00 0.00 H new ATOM 0 HA3 GLY B 59 -1.174 17.683 13.226 1.00 0.00 H new ATOM 1646 N LYS B 60 1.191 16.552 11.817 1.00 0.00 N ATOM 1647 CA LYS B 60 2.616 16.272 11.741 1.00 0.00 C ATOM 1648 C LYS B 60 3.201 17.057 10.575 1.00 0.00 C ATOM 1649 O LYS B 60 2.464 17.500 9.692 1.00 0.00 O ATOM 1650 CB LYS B 60 2.871 14.770 11.555 1.00 0.00 C ATOM 1651 CG LYS B 60 2.953 13.985 12.860 1.00 0.00 C ATOM 1652 CD LYS B 60 4.318 14.128 13.531 1.00 0.00 C ATOM 1653 CE LYS B 60 5.174 12.876 13.368 1.00 0.00 C ATOM 1654 NZ LYS B 60 5.073 12.293 12.012 1.00 0.00 N ATOM 0 H LYS B 60 0.593 15.785 11.509 1.00 0.00 H new ATOM 0 HA LYS B 60 3.095 16.574 12.672 1.00 0.00 H new ATOM 0 HB2 LYS B 60 2.074 14.351 10.941 1.00 0.00 H new ATOM 0 HB3 LYS B 60 3.802 14.636 11.004 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.176 14.333 13.541 1.00 0.00 H new ATOM 0 HG3 LYS B 60 2.755 12.932 12.662 1.00 0.00 H new ATOM 0 HD2 LYS B 60 4.843 14.983 13.105 1.00 0.00 H new ATOM 0 HD3 LYS B 60 4.179 14.336 14.592 1.00 0.00 H new ATOM 0 HE2 LYS B 60 6.215 13.122 13.578 1.00 0.00 H new ATOM 0 HE3 LYS B 60 4.868 12.132 14.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 5.933 11.746 11.804 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 4.244 11.667 11.964 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 4.971 13.056 11.313 1.00 0.00 H new ATOM 1668 N ALA B 61 4.513 17.224 10.561 1.00 0.00 N ATOM 1669 CA ALA B 61 5.161 17.977 9.498 1.00 0.00 C ATOM 1670 C ALA B 61 5.096 17.229 8.177 1.00 0.00 C ATOM 1671 O ALA B 61 5.159 17.835 7.108 1.00 0.00 O ATOM 1672 CB ALA B 61 6.603 18.290 9.868 1.00 0.00 C ATOM 0 H ALA B 61 5.147 16.852 11.268 1.00 0.00 H new ATOM 0 HA ALA B 61 4.623 18.917 9.376 1.00 0.00 H new ATOM 0 HB1 ALA B 61 7.072 18.853 9.061 1.00 0.00 H new ATOM 0 HB2 ALA B 61 6.624 18.882 10.783 1.00 0.00 H new ATOM 0 HB3 ALA B 61 7.149 17.359 10.025 1.00 0.00 H new ATOM 1678 N LYS B 62 4.982 15.913 8.249 1.00 0.00 N ATOM 1679 CA LYS B 62 4.900 15.103 7.049 1.00 0.00 C ATOM 1680 C LYS B 62 3.807 14.054 7.175 1.00 0.00 C ATOM 1681 O LYS B 62 3.845 13.204 8.070 1.00 0.00 O ATOM 1682 CB LYS B 62 6.222 14.391 6.770 1.00 0.00 C ATOM 1683 CG LYS B 62 7.467 15.239 6.944 1.00 0.00 C ATOM 1684 CD LYS B 62 8.708 14.362 6.925 1.00 0.00 C ATOM 1685 CE LYS B 62 9.960 15.136 7.272 1.00 0.00 C ATOM 1686 NZ LYS B 62 9.867 15.771 8.614 1.00 0.00 N ATOM 0 H LYS B 62 4.944 15.387 9.122 1.00 0.00 H new ATOM 0 HA LYS B 62 4.670 15.779 6.226 1.00 0.00 H new ATOM 0 HB2 LYS B 62 6.296 13.527 7.430 1.00 0.00 H new ATOM 0 HB3 LYS B 62 6.202 14.011 5.749 1.00 0.00 H new ATOM 0 HG2 LYS B 62 7.525 15.980 6.147 1.00 0.00 H new ATOM 0 HG3 LYS B 62 7.414 15.786 7.885 1.00 0.00 H new ATOM 0 HD2 LYS B 62 8.582 13.542 7.632 1.00 0.00 H new ATOM 0 HD3 LYS B 62 8.821 13.916 5.937 1.00 0.00 H new ATOM 0 HE2 LYS B 62 10.819 14.466 7.246 1.00 0.00 H new ATOM 0 HE3 LYS B 62 10.132 15.904 6.518 1.00 0.00 H new ATOM 0 HZ1 LYS B 62 10.820 16.025 8.945 1.00 0.00 H new ATOM 0 HZ2 LYS B 62 9.282 16.629 8.552 1.00 0.00 H new ATOM 0 HZ3 LYS B 62 9.434 15.104 9.284 1.00 0.00 H new ATOM 1700 N ILE B 63 2.829 14.125 6.289 1.00 0.00 N ATOM 1701 CA ILE B 63 1.752 13.152 6.269 1.00 0.00 C ATOM 1702 C ILE B 63 2.298 11.886 5.633 1.00 0.00 C ATOM 1703 O ILE B 63 2.668 11.888 4.454 1.00 0.00 O ATOM 1704 CB ILE B 63 0.532 13.687 5.496 1.00 0.00 C ATOM 1705 CG1 ILE B 63 0.059 15.003 6.117 1.00 0.00 C ATOM 1706 CG2 ILE B 63 -0.592 12.669 5.500 1.00 0.00 C ATOM 1707 CD1 ILE B 63 0.245 16.203 5.215 1.00 0.00 C ATOM 0 H ILE B 63 2.759 14.848 5.573 1.00 0.00 H new ATOM 0 HA ILE B 63 1.406 12.947 7.282 1.00 0.00 H new ATOM 0 HB ILE B 63 0.825 13.867 4.462 1.00 0.00 H new ATOM 0 HG12 ILE B 63 -0.996 14.914 6.375 1.00 0.00 H new ATOM 0 HG13 ILE B 63 0.602 15.171 7.047 1.00 0.00 H new ATOM 0 HG21 ILE B 63 -1.444 13.066 4.949 1.00 0.00 H new ATOM 0 HG22 ILE B 63 -0.251 11.748 5.027 1.00 0.00 H new ATOM 0 HG23 ILE B 63 -0.890 12.460 6.527 1.00 0.00 H new ATOM 0 HD11 ILE B 63 -0.113 17.099 5.723 1.00 0.00 H new ATOM 0 HD12 ILE B 63 1.302 16.319 4.977 1.00 0.00 H new ATOM 0 HD13 ILE B 63 -0.320 16.057 4.295 1.00 0.00 H new ATOM 1719 N GLN B 64 2.378 10.802 6.399 1.00 0.00 N ATOM 1720 CA GLN B 64 3.002 9.586 5.862 1.00 0.00 C ATOM 1721 C GLN B 64 2.314 8.299 6.262 1.00 0.00 C ATOM 1722 O GLN B 64 1.413 8.284 7.089 1.00 0.00 O ATOM 1723 CB GLN B 64 4.452 9.493 6.331 1.00 0.00 C ATOM 1724 CG GLN B 64 5.271 10.741 6.092 1.00 0.00 C ATOM 1725 CD GLN B 64 6.647 10.651 6.707 1.00 0.00 C ATOM 1726 OE1 GLN B 64 7.239 11.657 7.056 1.00 0.00 O ATOM 1727 NE2 GLN B 64 7.167 9.442 6.841 1.00 0.00 N ATOM 0 H GLN B 64 2.035 10.733 7.357 1.00 0.00 H new ATOM 0 HA GLN B 64 2.921 9.682 4.779 1.00 0.00 H new ATOM 0 HB2 GLN B 64 4.462 9.266 7.397 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.932 8.656 5.823 1.00 0.00 H new ATOM 0 HG2 GLN B 64 5.365 10.911 5.019 1.00 0.00 H new ATOM 0 HG3 GLN B 64 4.746 11.602 6.506 1.00 0.00 H new ATOM 0 HE21 GLN B 64 6.640 8.624 6.537 1.00 0.00 H new ATOM 0 HE22 GLN B 64 8.095 9.328 7.249 1.00 0.00 H new ATOM 1736 N LEU B 65 2.751 7.223 5.620 1.00 0.00 N ATOM 1737 CA LEU B 65 2.262 5.887 5.902 1.00 0.00 C ATOM 1738 C LEU B 65 3.424 5.022 6.388 1.00 0.00 C ATOM 1739 O LEU B 65 4.530 5.097 5.851 1.00 0.00 O ATOM 1740 CB LEU B 65 1.652 5.245 4.659 1.00 0.00 C ATOM 1741 CG LEU B 65 0.910 3.933 4.926 1.00 0.00 C ATOM 1742 CD1 LEU B 65 -0.556 4.186 5.212 1.00 0.00 C ATOM 1743 CD2 LEU B 65 1.064 2.979 3.766 1.00 0.00 C ATOM 0 H LEU B 65 3.458 7.257 4.886 1.00 0.00 H new ATOM 0 HA LEU B 65 1.489 5.960 6.667 1.00 0.00 H new ATOM 0 HB2 LEU B 65 0.961 5.953 4.201 1.00 0.00 H new ATOM 0 HB3 LEU B 65 2.445 5.059 3.934 1.00 0.00 H new ATOM 0 HG LEU B 65 1.356 3.474 5.808 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -1.059 3.237 5.398 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -0.650 4.825 6.090 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.014 4.678 4.354 1.00 0.00 H new ATOM 0 HD21 LEU B 65 0.528 2.055 3.981 1.00 0.00 H new ATOM 0 HD22 LEU B 65 0.655 3.434 2.864 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.121 2.758 3.614 1.00 0.00 H new ATOM 1755 N GLN B 66 3.175 4.223 7.406 1.00 0.00 N ATOM 1756 CA GLN B 66 4.179 3.338 7.963 1.00 0.00 C ATOM 1757 C GLN B 66 3.725 1.893 7.837 1.00 0.00 C ATOM 1758 O GLN B 66 2.595 1.560 8.185 1.00 0.00 O ATOM 1759 CB GLN B 66 4.417 3.680 9.432 1.00 0.00 C ATOM 1760 CG GLN B 66 5.515 2.862 10.091 1.00 0.00 C ATOM 1761 CD GLN B 66 5.792 3.306 11.513 1.00 0.00 C ATOM 1762 OE1 GLN B 66 5.127 2.871 12.453 1.00 0.00 O ATOM 1763 NE2 GLN B 66 6.781 4.168 11.679 1.00 0.00 N ATOM 0 H GLN B 66 2.269 4.169 7.871 1.00 0.00 H new ATOM 0 HA GLN B 66 5.110 3.468 7.411 1.00 0.00 H new ATOM 0 HB2 GLN B 66 4.670 4.737 9.511 1.00 0.00 H new ATOM 0 HB3 GLN B 66 3.488 3.532 9.983 1.00 0.00 H new ATOM 0 HG2 GLN B 66 5.230 1.810 10.091 1.00 0.00 H new ATOM 0 HG3 GLN B 66 6.429 2.945 9.503 1.00 0.00 H new ATOM 0 HE21 GLN B 66 7.307 4.503 10.872 1.00 0.00 H new ATOM 0 HE22 GLN B 66 7.018 4.498 12.615 1.00 0.00 H new ATOM 1772 N LEU B 67 4.591 1.045 7.318 1.00 0.00 N ATOM 1773 CA LEU B 67 4.270 -0.364 7.162 1.00 0.00 C ATOM 1774 C LEU B 67 4.874 -1.184 8.284 1.00 0.00 C ATOM 1775 O LEU B 67 6.080 -1.407 8.303 1.00 0.00 O ATOM 1776 CB LEU B 67 4.798 -0.894 5.832 1.00 0.00 C ATOM 1777 CG LEU B 67 4.070 -0.402 4.588 1.00 0.00 C ATOM 1778 CD1 LEU B 67 4.610 -1.119 3.365 1.00 0.00 C ATOM 1779 CD2 LEU B 67 2.572 -0.623 4.721 1.00 0.00 C ATOM 0 H LEU B 67 5.523 1.305 6.996 1.00 0.00 H new ATOM 0 HA LEU B 67 3.184 -0.455 7.189 1.00 0.00 H new ATOM 0 HB2 LEU B 67 5.850 -0.622 5.746 1.00 0.00 H new ATOM 0 HB3 LEU B 67 4.750 -1.983 5.851 1.00 0.00 H new ATOM 0 HG LEU B 67 4.242 0.668 4.476 1.00 0.00 H new ATOM 0 HD11 LEU B 67 4.088 -0.766 2.476 1.00 0.00 H new ATOM 0 HD12 LEU B 67 5.676 -0.915 3.265 1.00 0.00 H new ATOM 0 HD13 LEU B 67 4.455 -2.192 3.474 1.00 0.00 H new ATOM 0 HD21 LEU B 67 2.070 -0.265 3.822 1.00 0.00 H new ATOM 0 HD22 LEU B 67 2.371 -1.687 4.849 1.00 0.00 H new ATOM 0 HD23 LEU B 67 2.199 -0.076 5.587 1.00 0.00 H new ATOM 1791 N VAL B 68 4.049 -1.617 9.225 1.00 0.00 N ATOM 1792 CA VAL B 68 4.537 -2.442 10.315 1.00 0.00 C ATOM 1793 C VAL B 68 4.425 -3.898 9.912 1.00 0.00 C ATOM 1794 O VAL B 68 3.326 -4.451 9.814 1.00 0.00 O ATOM 1795 CB VAL B 68 3.785 -2.195 11.639 1.00 0.00 C ATOM 1796 CG1 VAL B 68 4.145 -3.252 12.673 1.00 0.00 C ATOM 1797 CG2 VAL B 68 4.117 -0.817 12.173 1.00 0.00 C ATOM 0 H VAL B 68 3.050 -1.413 9.255 1.00 0.00 H new ATOM 0 HA VAL B 68 5.577 -2.172 10.499 1.00 0.00 H new ATOM 0 HB VAL B 68 2.715 -2.258 11.442 1.00 0.00 H new ATOM 0 HG11 VAL B 68 3.602 -3.056 13.598 1.00 0.00 H new ATOM 0 HG12 VAL B 68 3.874 -4.238 12.295 1.00 0.00 H new ATOM 0 HG13 VAL B 68 5.217 -3.220 12.868 1.00 0.00 H new ATOM 0 HG21 VAL B 68 3.582 -0.650 13.108 1.00 0.00 H new ATOM 0 HG22 VAL B 68 5.190 -0.745 12.351 1.00 0.00 H new ATOM 0 HG23 VAL B 68 3.818 -0.063 11.445 1.00 0.00 H new ATOM 1807 N LEU B 69 5.565 -4.508 9.661 1.00 0.00 N ATOM 1808 CA LEU B 69 5.608 -5.887 9.231 1.00 0.00 C ATOM 1809 C LEU B 69 5.356 -6.839 10.400 1.00 0.00 C ATOM 1810 O LEU B 69 5.198 -6.410 11.545 1.00 0.00 O ATOM 1811 CB LEU B 69 6.932 -6.200 8.542 1.00 0.00 C ATOM 1812 CG LEU B 69 7.274 -5.335 7.323 1.00 0.00 C ATOM 1813 CD1 LEU B 69 8.101 -6.138 6.341 1.00 0.00 C ATOM 1814 CD2 LEU B 69 6.038 -4.772 6.644 1.00 0.00 C ATOM 0 H LEU B 69 6.480 -4.065 9.749 1.00 0.00 H new ATOM 0 HA LEU B 69 4.808 -6.037 8.506 1.00 0.00 H new ATOM 0 HB2 LEU B 69 7.733 -6.096 9.273 1.00 0.00 H new ATOM 0 HB3 LEU B 69 6.919 -7.244 8.230 1.00 0.00 H new ATOM 0 HG LEU B 69 7.853 -4.482 7.677 1.00 0.00 H new ATOM 0 HD11 LEU B 69 8.342 -5.519 5.477 1.00 0.00 H new ATOM 0 HD12 LEU B 69 9.023 -6.463 6.822 1.00 0.00 H new ATOM 0 HD13 LEU B 69 7.534 -7.011 6.016 1.00 0.00 H new ATOM 0 HD21 LEU B 69 6.337 -4.168 5.788 1.00 0.00 H new ATOM 0 HD22 LEU B 69 5.403 -5.591 6.306 1.00 0.00 H new ATOM 0 HD23 LEU B 69 5.485 -4.152 7.350 1.00 0.00 H new ATOM 1826 N HIS B 70 5.322 -8.131 10.102 1.00 0.00 N ATOM 1827 CA HIS B 70 5.049 -9.155 11.111 1.00 0.00 C ATOM 1828 C HIS B 70 6.131 -9.256 12.188 1.00 0.00 C ATOM 1829 O HIS B 70 5.827 -9.598 13.329 1.00 0.00 O ATOM 1830 CB HIS B 70 4.870 -10.522 10.449 1.00 0.00 C ATOM 1831 CG HIS B 70 3.627 -10.642 9.621 1.00 0.00 C ATOM 1832 ND1 HIS B 70 2.431 -10.034 9.930 1.00 0.00 N ATOM 1833 CD2 HIS B 70 3.411 -11.323 8.469 1.00 0.00 C ATOM 1834 CE1 HIS B 70 1.547 -10.357 8.977 1.00 0.00 C ATOM 1835 NE2 HIS B 70 2.090 -11.137 8.071 1.00 0.00 N ATOM 0 H HIS B 70 5.481 -8.500 9.164 1.00 0.00 H new ATOM 0 HA HIS B 70 4.129 -8.847 11.607 1.00 0.00 H new ATOM 0 HB2 HIS B 70 5.735 -10.724 9.818 1.00 0.00 H new ATOM 0 HB3 HIS B 70 4.854 -11.289 11.223 1.00 0.00 H new ATOM 0 HD2 HIS B 70 4.146 -11.915 7.944 1.00 0.00 H new ATOM 0 HE1 HIS B 70 0.521 -10.020 8.956 1.00 0.00 H new ATOM 0 HE2 HIS B 70 1.637 -11.527 7.245 1.00 0.00 H new ATOM 1843 N ALA B 71 7.377 -8.958 11.844 1.00 0.00 N ATOM 1844 CA ALA B 71 8.467 -9.065 12.812 1.00 0.00 C ATOM 1845 C ALA B 71 8.738 -7.741 13.518 1.00 0.00 C ATOM 1846 O ALA B 71 9.713 -7.610 14.257 1.00 0.00 O ATOM 1847 CB ALA B 71 9.730 -9.574 12.129 1.00 0.00 C ATOM 0 H ALA B 71 7.659 -8.644 10.915 1.00 0.00 H new ATOM 0 HA ALA B 71 8.159 -9.780 13.575 1.00 0.00 H new ATOM 0 HB1 ALA B 71 10.534 -9.649 12.861 1.00 0.00 H new ATOM 0 HB2 ALA B 71 9.539 -10.556 11.697 1.00 0.00 H new ATOM 0 HB3 ALA B 71 10.021 -8.881 11.340 1.00 0.00 H new ATOM 1853 N GLY B 72 7.861 -6.769 13.311 1.00 0.00 N ATOM 1854 CA GLY B 72 8.040 -5.472 13.935 1.00 0.00 C ATOM 1855 C GLY B 72 8.843 -4.541 13.058 1.00 0.00 C ATOM 1856 O GLY B 72 9.418 -3.560 13.529 1.00 0.00 O ATOM 0 H GLY B 72 7.031 -6.854 12.724 1.00 0.00 H new ATOM 0 HA2 GLY B 72 7.066 -5.029 14.141 1.00 0.00 H new ATOM 0 HA3 GLY B 72 8.544 -5.595 14.894 1.00 0.00 H new ATOM 1860 N ASP B 73 8.871 -4.859 11.776 1.00 0.00 N ATOM 1861 CA ASP B 73 9.596 -4.074 10.792 1.00 0.00 C ATOM 1862 C ASP B 73 8.738 -2.889 10.409 1.00 0.00 C ATOM 1863 O ASP B 73 7.517 -2.969 10.498 1.00 0.00 O ATOM 1864 CB ASP B 73 9.899 -4.913 9.546 1.00 0.00 C ATOM 1865 CG ASP B 73 10.237 -6.358 9.863 1.00 0.00 C ATOM 1866 OD1 ASP B 73 9.296 -7.143 10.132 1.00 0.00 O ATOM 1867 OD2 ASP B 73 11.431 -6.712 9.828 1.00 0.00 O ATOM 0 H ASP B 73 8.391 -5.670 11.387 1.00 0.00 H new ATOM 0 HA ASP B 73 10.544 -3.742 11.216 1.00 0.00 H new ATOM 0 HB2 ASP B 73 9.036 -4.887 8.880 1.00 0.00 H new ATOM 0 HB3 ASP B 73 10.732 -4.462 9.007 1.00 0.00 H new ATOM 1872 N THR B 74 9.340 -1.794 9.989 1.00 0.00 N ATOM 1873 CA THR B 74 8.554 -0.627 9.629 1.00 0.00 C ATOM 1874 C THR B 74 9.142 0.125 8.444 1.00 0.00 C ATOM 1875 O THR B 74 10.338 0.419 8.410 1.00 0.00 O ATOM 1876 CB THR B 74 8.436 0.357 10.815 1.00 0.00 C ATOM 1877 OG1 THR B 74 9.738 0.642 11.341 1.00 0.00 O ATOM 1878 CG2 THR B 74 7.554 -0.197 11.922 1.00 0.00 C ATOM 0 H THR B 74 10.349 -1.686 9.889 1.00 0.00 H new ATOM 0 HA THR B 74 7.569 -1.006 9.355 1.00 0.00 H new ATOM 0 HB THR B 74 7.975 1.271 10.441 1.00 0.00 H new ATOM 0 HG1 THR B 74 10.379 0.719 10.604 1.00 0.00 H new ATOM 0 HG21 THR B 74 7.497 0.525 12.737 1.00 0.00 H new ATOM 0 HG22 THR B 74 6.554 -0.383 11.531 1.00 0.00 H new ATOM 0 HG23 THR B 74 7.978 -1.130 12.293 1.00 0.00 H new ATOM 1886 N THR B 75 8.292 0.425 7.478 1.00 0.00 N ATOM 1887 CA THR B 75 8.694 1.175 6.302 1.00 0.00 C ATOM 1888 C THR B 75 7.978 2.526 6.299 1.00 0.00 C ATOM 1889 O THR B 75 6.748 2.580 6.260 1.00 0.00 O ATOM 1890 CB THR B 75 8.359 0.402 5.015 1.00 0.00 C ATOM 1891 OG1 THR B 75 8.408 -1.008 5.276 1.00 0.00 O ATOM 1892 CG2 THR B 75 9.340 0.748 3.906 1.00 0.00 C ATOM 0 H THR B 75 7.308 0.157 7.486 1.00 0.00 H new ATOM 0 HA THR B 75 9.773 1.327 6.334 1.00 0.00 H new ATOM 0 HB THR B 75 7.357 0.684 4.692 1.00 0.00 H new ATOM 0 HG1 THR B 75 8.975 -1.445 4.607 1.00 0.00 H new ATOM 0 HG21 THR B 75 9.083 0.189 3.006 1.00 0.00 H new ATOM 0 HG22 THR B 75 9.290 1.817 3.697 1.00 0.00 H new ATOM 0 HG23 THR B 75 10.351 0.486 4.219 1.00 0.00 H new ATOM 1900 N ASN B 76 8.743 3.608 6.358 1.00 0.00 N ATOM 1901 CA ASN B 76 8.170 4.955 6.403 1.00 0.00 C ATOM 1902 C ASN B 76 8.080 5.596 5.026 1.00 0.00 C ATOM 1903 O ASN B 76 9.094 5.911 4.414 1.00 0.00 O ATOM 1904 CB ASN B 76 9.003 5.852 7.316 1.00 0.00 C ATOM 1905 CG ASN B 76 8.526 5.823 8.750 1.00 0.00 C ATOM 1906 OD1 ASN B 76 8.018 4.812 9.232 1.00 0.00 O ATOM 1907 ND2 ASN B 76 8.678 6.937 9.438 1.00 0.00 N ATOM 0 H ASN B 76 9.763 3.584 6.376 1.00 0.00 H new ATOM 0 HA ASN B 76 7.157 4.852 6.793 1.00 0.00 H new ATOM 0 HB2 ASN B 76 10.046 5.536 7.277 1.00 0.00 H new ATOM 0 HB3 ASN B 76 8.966 6.876 6.945 1.00 0.00 H new ATOM 0 HD21 ASN B 76 8.369 6.983 10.409 1.00 0.00 H new ATOM 0 HD22 ASN B 76 9.105 7.753 8.999 1.00 0.00 H new ATOM 1914 N PHE B 77 6.861 5.805 4.554 1.00 0.00 N ATOM 1915 CA PHE B 77 6.641 6.427 3.255 1.00 0.00 C ATOM 1916 C PHE B 77 6.143 7.858 3.429 1.00 0.00 C ATOM 1917 O PHE B 77 4.984 8.082 3.774 1.00 0.00 O ATOM 1918 CB PHE B 77 5.645 5.606 2.436 1.00 0.00 C ATOM 1919 CG PHE B 77 6.204 4.288 1.990 1.00 0.00 C ATOM 1920 CD1 PHE B 77 7.249 4.242 1.082 1.00 0.00 C ATOM 1921 CD2 PHE B 77 5.697 3.098 2.484 1.00 0.00 C ATOM 1922 CE1 PHE B 77 7.779 3.035 0.677 1.00 0.00 C ATOM 1923 CE2 PHE B 77 6.222 1.885 2.078 1.00 0.00 C ATOM 1924 CZ PHE B 77 7.266 1.855 1.174 1.00 0.00 C ATOM 0 H PHE B 77 6.007 5.553 5.051 1.00 0.00 H new ATOM 0 HA PHE B 77 7.588 6.456 2.717 1.00 0.00 H new ATOM 0 HB2 PHE B 77 4.749 5.432 3.031 1.00 0.00 H new ATOM 0 HB3 PHE B 77 5.340 6.181 1.561 1.00 0.00 H new ATOM 0 HD1 PHE B 77 7.653 5.162 0.687 1.00 0.00 H new ATOM 0 HD2 PHE B 77 4.883 3.117 3.194 1.00 0.00 H new ATOM 0 HE1 PHE B 77 8.596 3.014 -0.029 1.00 0.00 H new ATOM 0 HE2 PHE B 77 5.817 0.963 2.467 1.00 0.00 H new ATOM 0 HZ PHE B 77 7.680 0.909 0.857 1.00 0.00 H new ATOM 1934 N HIS B 78 7.030 8.812 3.180 1.00 0.00 N ATOM 1935 CA HIS B 78 6.724 10.234 3.317 1.00 0.00 C ATOM 1936 C HIS B 78 6.110 10.774 2.035 1.00 0.00 C ATOM 1937 O HIS B 78 6.750 10.781 0.992 1.00 0.00 O ATOM 1938 CB HIS B 78 8.023 10.993 3.659 1.00 0.00 C ATOM 1939 CG HIS B 78 7.959 12.500 3.576 1.00 0.00 C ATOM 1940 ND1 HIS B 78 9.077 13.300 3.619 1.00 0.00 N ATOM 1941 CD2 HIS B 78 6.906 13.346 3.430 1.00 0.00 C ATOM 1942 CE1 HIS B 78 8.685 14.571 3.491 1.00 0.00 C ATOM 1943 NE2 HIS B 78 7.375 14.656 3.374 1.00 0.00 N ATOM 0 H HIS B 78 7.985 8.623 2.876 1.00 0.00 H new ATOM 0 HA HIS B 78 5.999 10.375 4.118 1.00 0.00 H new ATOM 0 HB2 HIS B 78 8.324 10.718 4.670 1.00 0.00 H new ATOM 0 HB3 HIS B 78 8.809 10.646 2.988 1.00 0.00 H new ATOM 0 HD2 HIS B 78 5.869 13.049 3.367 1.00 0.00 H new ATOM 0 HE1 HIS B 78 9.355 15.418 3.484 1.00 0.00 H new ATOM 0 HE2 HIS B 78 6.820 15.505 3.265 1.00 0.00 H new ATOM 1951 N PHE B 79 4.866 11.217 2.113 1.00 0.00 N ATOM 1952 CA PHE B 79 4.204 11.781 0.952 1.00 0.00 C ATOM 1953 C PHE B 79 4.664 13.223 0.784 1.00 0.00 C ATOM 1954 O PHE B 79 4.018 14.155 1.260 1.00 0.00 O ATOM 1955 CB PHE B 79 2.682 11.705 1.102 1.00 0.00 C ATOM 1956 CG PHE B 79 2.154 10.297 1.139 1.00 0.00 C ATOM 1957 CD1 PHE B 79 2.156 9.570 2.319 1.00 0.00 C ATOM 1958 CD2 PHE B 79 1.653 9.702 -0.006 1.00 0.00 C ATOM 1959 CE1 PHE B 79 1.670 8.278 2.355 1.00 0.00 C ATOM 1960 CE2 PHE B 79 1.166 8.410 0.024 1.00 0.00 C ATOM 1961 CZ PHE B 79 1.175 7.698 1.206 1.00 0.00 C ATOM 0 H PHE B 79 4.300 11.197 2.961 1.00 0.00 H new ATOM 0 HA PHE B 79 4.470 11.208 0.064 1.00 0.00 H new ATOM 0 HB2 PHE B 79 2.389 12.219 2.017 1.00 0.00 H new ATOM 0 HB3 PHE B 79 2.216 12.238 0.273 1.00 0.00 H new ATOM 0 HD1 PHE B 79 2.543 10.020 3.222 1.00 0.00 H new ATOM 0 HD2 PHE B 79 1.643 10.255 -0.934 1.00 0.00 H new ATOM 0 HE1 PHE B 79 1.678 7.723 3.281 1.00 0.00 H new ATOM 0 HE2 PHE B 79 0.779 7.957 -0.877 1.00 0.00 H new ATOM 0 HZ PHE B 79 0.795 6.687 1.231 1.00 0.00 H new ATOM 1971 N SER B 80 5.802 13.390 0.123 1.00 0.00 N ATOM 1972 CA SER B 80 6.389 14.702 -0.090 1.00 0.00 C ATOM 1973 C SER B 80 5.677 15.477 -1.194 1.00 0.00 C ATOM 1974 O SER B 80 6.098 16.574 -1.558 1.00 0.00 O ATOM 1975 CB SER B 80 7.880 14.551 -0.412 1.00 0.00 C ATOM 1976 OG SER B 80 8.145 13.318 -1.062 1.00 0.00 O ATOM 0 H SER B 80 6.340 12.622 -0.278 1.00 0.00 H new ATOM 0 HA SER B 80 6.270 15.277 0.828 1.00 0.00 H new ATOM 0 HB2 SER B 80 8.202 15.376 -1.047 1.00 0.00 H new ATOM 0 HB3 SER B 80 8.461 14.612 0.508 1.00 0.00 H new ATOM 0 HG SER B 80 8.979 13.389 -1.571 1.00 0.00 H new ATOM 1982 N ASN B 81 4.610 14.903 -1.731 1.00 0.00 N ATOM 1983 CA ASN B 81 3.839 15.556 -2.779 1.00 0.00 C ATOM 1984 C ASN B 81 3.036 16.708 -2.193 1.00 0.00 C ATOM 1985 O ASN B 81 2.002 16.504 -1.572 1.00 0.00 O ATOM 1986 CB ASN B 81 2.897 14.560 -3.455 1.00 0.00 C ATOM 1987 CG ASN B 81 2.388 15.060 -4.794 1.00 0.00 C ATOM 1988 OD1 ASN B 81 2.334 16.265 -5.047 1.00 0.00 O ATOM 1989 ND2 ASN B 81 1.990 14.138 -5.651 1.00 0.00 N ATOM 0 H ASN B 81 4.258 13.985 -1.458 1.00 0.00 H new ATOM 0 HA ASN B 81 4.532 15.943 -3.526 1.00 0.00 H new ATOM 0 HB2 ASN B 81 3.417 13.613 -3.598 1.00 0.00 H new ATOM 0 HB3 ASN B 81 2.050 14.363 -2.798 1.00 0.00 H new ATOM 0 HD21 ASN B 81 1.621 14.413 -6.561 1.00 0.00 H new ATOM 0 HD22 ASN B 81 2.051 13.151 -5.403 1.00 0.00 H new ATOM 1996 N GLU B 82 3.510 17.921 -2.411 1.00 0.00 N ATOM 1997 CA GLU B 82 2.855 19.111 -1.888 1.00 0.00 C ATOM 1998 C GLU B 82 1.453 19.290 -2.472 1.00 0.00 C ATOM 1999 O GLU B 82 0.622 20.007 -1.911 1.00 0.00 O ATOM 2000 CB GLU B 82 3.705 20.354 -2.194 1.00 0.00 C ATOM 2001 CG GLU B 82 5.153 20.251 -1.724 1.00 0.00 C ATOM 2002 CD GLU B 82 6.085 19.642 -2.762 1.00 0.00 C ATOM 2003 OE1 GLU B 82 5.610 18.890 -3.642 1.00 0.00 O ATOM 2004 OE2 GLU B 82 7.305 19.889 -2.690 1.00 0.00 O ATOM 0 H GLU B 82 4.354 18.111 -2.952 1.00 0.00 H new ATOM 0 HA GLU B 82 2.756 18.987 -0.810 1.00 0.00 H new ATOM 0 HB2 GLU B 82 3.695 20.532 -3.269 1.00 0.00 H new ATOM 0 HB3 GLU B 82 3.243 21.222 -1.723 1.00 0.00 H new ATOM 0 HG2 GLU B 82 5.514 21.246 -1.462 1.00 0.00 H new ATOM 0 HG3 GLU B 82 5.190 19.649 -0.816 1.00 0.00 H new ATOM 2011 N SER B 83 1.182 18.625 -3.584 1.00 0.00 N ATOM 2012 CA SER B 83 -0.110 18.738 -4.236 1.00 0.00 C ATOM 2013 C SER B 83 -1.130 17.723 -3.711 1.00 0.00 C ATOM 2014 O SER B 83 -2.295 18.070 -3.473 1.00 0.00 O ATOM 2015 CB SER B 83 0.061 18.573 -5.746 1.00 0.00 C ATOM 2016 OG SER B 83 1.040 19.468 -6.244 1.00 0.00 O ATOM 0 H SER B 83 1.840 18.002 -4.052 1.00 0.00 H new ATOM 0 HA SER B 83 -0.502 19.729 -4.007 1.00 0.00 H new ATOM 0 HB2 SER B 83 0.351 17.547 -5.973 1.00 0.00 H new ATOM 0 HB3 SER B 83 -0.891 18.754 -6.246 1.00 0.00 H new ATOM 0 HG SER B 83 1.134 19.344 -7.212 1.00 0.00 H new ATOM 2022 N THR B 84 -0.714 16.478 -3.514 1.00 0.00 N ATOM 2023 CA THR B 84 -1.641 15.443 -3.071 1.00 0.00 C ATOM 2024 C THR B 84 -1.124 14.598 -1.899 1.00 0.00 C ATOM 2025 O THR B 84 -1.535 13.455 -1.756 1.00 0.00 O ATOM 2026 CB THR B 84 -1.973 14.514 -4.255 1.00 0.00 C ATOM 2027 OG1 THR B 84 -0.859 14.465 -5.150 1.00 0.00 O ATOM 2028 CG2 THR B 84 -3.201 14.992 -5.012 1.00 0.00 C ATOM 0 H THR B 84 0.246 16.163 -3.652 1.00 0.00 H new ATOM 0 HA THR B 84 -2.528 15.963 -2.710 1.00 0.00 H new ATOM 0 HB THR B 84 -2.183 13.522 -3.855 1.00 0.00 H new ATOM 0 HG1 THR B 84 -0.239 13.762 -4.863 1.00 0.00 H new ATOM 0 HG21 THR B 84 -3.405 14.313 -5.840 1.00 0.00 H new ATOM 0 HG22 THR B 84 -4.058 15.012 -4.339 1.00 0.00 H new ATOM 0 HG23 THR B 84 -3.021 15.994 -5.401 1.00 0.00 H new ATOM 2036 N ALA B 85 -0.287 15.171 -1.036 1.00 0.00 N ATOM 2037 CA ALA B 85 0.277 14.435 0.110 1.00 0.00 C ATOM 2038 C ALA B 85 -0.798 13.722 0.919 1.00 0.00 C ATOM 2039 O ALA B 85 -0.857 12.494 0.959 1.00 0.00 O ATOM 2040 CB ALA B 85 1.051 15.374 1.021 1.00 0.00 C ATOM 0 H ALA B 85 0.020 16.142 -1.103 1.00 0.00 H new ATOM 0 HA ALA B 85 0.950 13.682 -0.300 1.00 0.00 H new ATOM 0 HB1 ALA B 85 1.459 14.812 1.861 1.00 0.00 H new ATOM 0 HB2 ALA B 85 1.866 15.834 0.462 1.00 0.00 H new ATOM 0 HB3 ALA B 85 0.384 16.151 1.395 1.00 0.00 H new ATOM 2046 N VAL B 86 -1.640 14.511 1.569 1.00 0.00 N ATOM 2047 CA VAL B 86 -2.724 13.986 2.389 1.00 0.00 C ATOM 2048 C VAL B 86 -3.662 13.102 1.562 1.00 0.00 C ATOM 2049 O VAL B 86 -4.027 12.002 1.974 1.00 0.00 O ATOM 2050 CB VAL B 86 -3.529 15.148 3.013 1.00 0.00 C ATOM 2051 CG1 VAL B 86 -4.780 14.647 3.712 1.00 0.00 C ATOM 2052 CG2 VAL B 86 -2.680 15.938 3.982 1.00 0.00 C ATOM 0 H VAL B 86 -1.593 15.530 1.544 1.00 0.00 H new ATOM 0 HA VAL B 86 -2.283 13.380 3.180 1.00 0.00 H new ATOM 0 HB VAL B 86 -3.832 15.803 2.196 1.00 0.00 H new ATOM 0 HG11 VAL B 86 -5.321 15.491 4.139 1.00 0.00 H new ATOM 0 HG12 VAL B 86 -5.418 14.134 2.993 1.00 0.00 H new ATOM 0 HG13 VAL B 86 -4.500 13.956 4.507 1.00 0.00 H new ATOM 0 HG21 VAL B 86 -3.271 16.749 4.406 1.00 0.00 H new ATOM 0 HG22 VAL B 86 -2.336 15.283 4.782 1.00 0.00 H new ATOM 0 HG23 VAL B 86 -1.819 16.352 3.457 1.00 0.00 H new ATOM 2062 N LYS B 87 -4.001 13.584 0.372 1.00 0.00 N ATOM 2063 CA LYS B 87 -4.912 12.885 -0.531 1.00 0.00 C ATOM 2064 C LYS B 87 -4.408 11.484 -0.895 1.00 0.00 C ATOM 2065 O LYS B 87 -5.137 10.502 -0.759 1.00 0.00 O ATOM 2066 CB LYS B 87 -5.120 13.725 -1.793 1.00 0.00 C ATOM 2067 CG LYS B 87 -5.624 15.133 -1.502 1.00 0.00 C ATOM 2068 CD LYS B 87 -5.364 16.075 -2.667 1.00 0.00 C ATOM 2069 CE LYS B 87 -5.569 17.529 -2.273 1.00 0.00 C ATOM 2070 NZ LYS B 87 -4.970 18.463 -3.269 1.00 0.00 N ATOM 0 H LYS B 87 -3.653 14.470 0.005 1.00 0.00 H new ATOM 0 HA LYS B 87 -5.863 12.753 -0.014 1.00 0.00 H new ATOM 0 HB2 LYS B 87 -4.178 13.789 -2.338 1.00 0.00 H new ATOM 0 HB3 LYS B 87 -5.832 13.219 -2.445 1.00 0.00 H new ATOM 0 HG2 LYS B 87 -6.693 15.101 -1.292 1.00 0.00 H new ATOM 0 HG3 LYS B 87 -5.134 15.517 -0.607 1.00 0.00 H new ATOM 0 HD2 LYS B 87 -4.344 15.936 -3.026 1.00 0.00 H new ATOM 0 HD3 LYS B 87 -6.030 15.825 -3.493 1.00 0.00 H new ATOM 0 HE2 LYS B 87 -6.636 17.733 -2.179 1.00 0.00 H new ATOM 0 HE3 LYS B 87 -5.123 17.707 -1.294 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 -5.365 19.415 -3.133 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 -3.939 18.494 -3.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 -5.188 18.132 -4.230 1.00 0.00 H new ATOM 2084 N GLU B 88 -3.163 11.393 -1.352 1.00 0.00 N ATOM 2085 CA GLU B 88 -2.582 10.109 -1.729 1.00 0.00 C ATOM 2086 C GLU B 88 -2.375 9.242 -0.496 1.00 0.00 C ATOM 2087 O GLU B 88 -2.492 8.018 -0.560 1.00 0.00 O ATOM 2088 CB GLU B 88 -1.259 10.312 -2.470 1.00 0.00 C ATOM 2089 CG GLU B 88 -1.415 11.053 -3.788 1.00 0.00 C ATOM 2090 CD GLU B 88 -0.088 11.422 -4.421 1.00 0.00 C ATOM 2091 OE1 GLU B 88 0.463 12.479 -4.060 1.00 0.00 O ATOM 2092 OE2 GLU B 88 0.394 10.671 -5.292 1.00 0.00 O ATOM 0 H GLU B 88 -2.538 12.191 -1.470 1.00 0.00 H new ATOM 0 HA GLU B 88 -3.274 9.600 -2.400 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -0.573 10.866 -1.829 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -0.804 9.340 -2.659 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -1.982 10.433 -4.482 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -1.997 11.960 -3.622 1.00 0.00 H new ATOM 2099 N ARG B 89 -2.077 9.886 0.628 1.00 0.00 N ATOM 2100 CA ARG B 89 -1.877 9.180 1.887 1.00 0.00 C ATOM 2101 C ARG B 89 -3.122 8.381 2.230 1.00 0.00 C ATOM 2102 O ARG B 89 -3.039 7.216 2.609 1.00 0.00 O ATOM 2103 CB ARG B 89 -1.563 10.169 3.015 1.00 0.00 C ATOM 2104 CG ARG B 89 -1.134 9.519 4.327 1.00 0.00 C ATOM 2105 CD ARG B 89 -2.323 9.147 5.210 1.00 0.00 C ATOM 2106 NE ARG B 89 -3.414 10.123 5.136 1.00 0.00 N ATOM 2107 CZ ARG B 89 -3.695 11.015 6.088 1.00 0.00 C ATOM 2108 NH1 ARG B 89 -2.956 11.098 7.186 1.00 0.00 N ATOM 2109 NH2 ARG B 89 -4.725 11.829 5.943 1.00 0.00 N ATOM 0 H ARG B 89 -1.969 10.898 0.692 1.00 0.00 H new ATOM 0 HA ARG B 89 -1.031 8.501 1.777 1.00 0.00 H new ATOM 0 HB2 ARG B 89 -0.772 10.841 2.682 1.00 0.00 H new ATOM 0 HB3 ARG B 89 -2.445 10.782 3.200 1.00 0.00 H new ATOM 0 HG2 ARG B 89 -0.551 8.624 4.112 1.00 0.00 H new ATOM 0 HG3 ARG B 89 -0.481 10.202 4.871 1.00 0.00 H new ATOM 0 HD2 ARG B 89 -2.698 8.167 4.913 1.00 0.00 H new ATOM 0 HD3 ARG B 89 -1.989 9.061 6.244 1.00 0.00 H new ATOM 0 HE ARG B 89 -3.998 10.120 4.300 1.00 0.00 H new ATOM 0 HH11 ARG B 89 -2.159 10.474 7.313 1.00 0.00 H new ATOM 0 HH12 ARG B 89 -3.185 11.786 7.904 1.00 0.00 H new ATOM 0 HH21 ARG B 89 -5.304 11.775 5.105 1.00 0.00 H new ATOM 0 HH22 ARG B 89 -4.942 12.512 6.669 1.00 0.00 H new ATOM 2123 N ASP B 90 -4.275 9.022 2.088 1.00 0.00 N ATOM 2124 CA ASP B 90 -5.549 8.381 2.384 1.00 0.00 C ATOM 2125 C ASP B 90 -5.837 7.266 1.395 1.00 0.00 C ATOM 2126 O ASP B 90 -6.372 6.228 1.773 1.00 0.00 O ATOM 2127 CB ASP B 90 -6.687 9.400 2.379 1.00 0.00 C ATOM 2128 CG ASP B 90 -6.807 10.119 3.705 1.00 0.00 C ATOM 2129 OD1 ASP B 90 -7.528 9.621 4.592 1.00 0.00 O ATOM 2130 OD2 ASP B 90 -6.156 11.167 3.872 1.00 0.00 O ATOM 0 H ASP B 90 -4.354 9.988 1.769 1.00 0.00 H new ATOM 0 HA ASP B 90 -5.479 7.948 3.382 1.00 0.00 H new ATOM 0 HB2 ASP B 90 -6.519 10.128 1.585 1.00 0.00 H new ATOM 0 HB3 ASP B 90 -7.626 8.894 2.154 1.00 0.00 H new ATOM 2135 N ALA B 91 -5.463 7.471 0.135 1.00 0.00 N ATOM 2136 CA ALA B 91 -5.679 6.465 -0.890 1.00 0.00 C ATOM 2137 C ALA B 91 -4.923 5.191 -0.539 1.00 0.00 C ATOM 2138 O ALA B 91 -5.484 4.100 -0.561 1.00 0.00 O ATOM 2139 CB ALA B 91 -5.250 6.989 -2.252 1.00 0.00 C ATOM 0 H ALA B 91 -5.011 8.323 -0.196 1.00 0.00 H new ATOM 0 HA ALA B 91 -6.743 6.235 -0.937 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -5.419 6.221 -3.007 1.00 0.00 H new ATOM 0 HB2 ALA B 91 -5.832 7.877 -2.500 1.00 0.00 H new ATOM 0 HB3 ALA B 91 -4.191 7.245 -2.226 1.00 0.00 H new ATOM 2145 N VAL B 92 -3.651 5.346 -0.193 1.00 0.00 N ATOM 2146 CA VAL B 92 -2.816 4.211 0.184 1.00 0.00 C ATOM 2147 C VAL B 92 -3.279 3.628 1.514 1.00 0.00 C ATOM 2148 O VAL B 92 -3.270 2.417 1.714 1.00 0.00 O ATOM 2149 CB VAL B 92 -1.330 4.617 0.312 1.00 0.00 C ATOM 2150 CG1 VAL B 92 -0.454 3.399 0.558 1.00 0.00 C ATOM 2151 CG2 VAL B 92 -0.865 5.362 -0.924 1.00 0.00 C ATOM 0 H VAL B 92 -3.174 6.247 -0.165 1.00 0.00 H new ATOM 0 HA VAL B 92 -2.912 3.465 -0.605 1.00 0.00 H new ATOM 0 HB VAL B 92 -1.239 5.284 1.169 1.00 0.00 H new ATOM 0 HG11 VAL B 92 0.587 3.711 0.644 1.00 0.00 H new ATOM 0 HG12 VAL B 92 -0.764 2.909 1.481 1.00 0.00 H new ATOM 0 HG13 VAL B 92 -0.556 2.703 -0.275 1.00 0.00 H new ATOM 0 HG21 VAL B 92 0.184 5.637 -0.810 1.00 0.00 H new ATOM 0 HG22 VAL B 92 -0.979 4.722 -1.799 1.00 0.00 H new ATOM 0 HG23 VAL B 92 -1.465 6.263 -1.053 1.00 0.00 H new ATOM 2161 N LYS B 93 -3.707 4.507 2.407 1.00 0.00 N ATOM 2162 CA LYS B 93 -4.161 4.111 3.730 1.00 0.00 C ATOM 2163 C LYS B 93 -5.420 3.260 3.647 1.00 0.00 C ATOM 2164 O LYS B 93 -5.452 2.137 4.145 1.00 0.00 O ATOM 2165 CB LYS B 93 -4.421 5.360 4.580 1.00 0.00 C ATOM 2166 CG LYS B 93 -4.792 5.064 6.020 1.00 0.00 C ATOM 2167 CD LYS B 93 -6.227 5.466 6.325 1.00 0.00 C ATOM 2168 CE LYS B 93 -6.419 6.966 6.212 1.00 0.00 C ATOM 2169 NZ LYS B 93 -7.779 7.317 5.716 1.00 0.00 N ATOM 0 H LYS B 93 -3.749 5.512 2.235 1.00 0.00 H new ATOM 0 HA LYS B 93 -3.381 3.510 4.197 1.00 0.00 H new ATOM 0 HB2 LYS B 93 -3.529 5.987 4.568 1.00 0.00 H new ATOM 0 HB3 LYS B 93 -5.223 5.938 4.121 1.00 0.00 H new ATOM 0 HG2 LYS B 93 -4.662 4.000 6.218 1.00 0.00 H new ATOM 0 HG3 LYS B 93 -4.115 5.597 6.687 1.00 0.00 H new ATOM 0 HD2 LYS B 93 -6.902 4.959 5.636 1.00 0.00 H new ATOM 0 HD3 LYS B 93 -6.492 5.139 7.330 1.00 0.00 H new ATOM 0 HE2 LYS B 93 -6.258 7.427 7.187 1.00 0.00 H new ATOM 0 HE3 LYS B 93 -5.669 7.378 5.537 1.00 0.00 H new ATOM 0 HZ1 LYS B 93 -7.831 8.341 5.540 1.00 0.00 H new ATOM 0 HZ2 LYS B 93 -7.969 6.804 4.832 1.00 0.00 H new ATOM 0 HZ3 LYS B 93 -8.488 7.052 6.429 1.00 0.00 H new ATOM 2183 N ASP B 94 -6.437 3.795 2.992 1.00 0.00 N ATOM 2184 CA ASP B 94 -7.719 3.114 2.850 1.00 0.00 C ATOM 2185 C ASP B 94 -7.617 1.865 1.986 1.00 0.00 C ATOM 2186 O ASP B 94 -8.279 0.860 2.251 1.00 0.00 O ATOM 2187 CB ASP B 94 -8.763 4.067 2.273 1.00 0.00 C ATOM 2188 CG ASP B 94 -9.522 4.809 3.356 1.00 0.00 C ATOM 2189 OD1 ASP B 94 -8.912 5.658 4.042 1.00 0.00 O ATOM 2190 OD2 ASP B 94 -10.728 4.521 3.541 1.00 0.00 O ATOM 0 H ASP B 94 -6.400 4.711 2.544 1.00 0.00 H new ATOM 0 HA ASP B 94 -8.027 2.796 3.846 1.00 0.00 H new ATOM 0 HB2 ASP B 94 -8.273 4.787 1.617 1.00 0.00 H new ATOM 0 HB3 ASP B 94 -9.466 3.504 1.659 1.00 0.00 H new ATOM 2195 N LEU B 95 -6.772 1.913 0.976 1.00 0.00 N ATOM 2196 CA LEU B 95 -6.609 0.773 0.085 1.00 0.00 C ATOM 2197 C LEU B 95 -5.844 -0.331 0.789 1.00 0.00 C ATOM 2198 O LEU B 95 -6.029 -1.508 0.491 1.00 0.00 O ATOM 2199 CB LEU B 95 -5.901 1.174 -1.210 1.00 0.00 C ATOM 2200 CG LEU B 95 -6.095 0.206 -2.381 1.00 0.00 C ATOM 2201 CD1 LEU B 95 -7.570 0.086 -2.738 1.00 0.00 C ATOM 2202 CD2 LEU B 95 -5.290 0.661 -3.588 1.00 0.00 C ATOM 0 H LEU B 95 -6.190 2.720 0.750 1.00 0.00 H new ATOM 0 HA LEU B 95 -7.600 0.406 -0.181 1.00 0.00 H new ATOM 0 HB2 LEU B 95 -6.257 2.160 -1.510 1.00 0.00 H new ATOM 0 HB3 LEU B 95 -4.834 1.268 -1.009 1.00 0.00 H new ATOM 0 HG LEU B 95 -5.734 -0.777 -2.077 1.00 0.00 H new ATOM 0 HD11 LEU B 95 -7.687 -0.606 -3.572 1.00 0.00 H new ATOM 0 HD12 LEU B 95 -8.124 -0.287 -1.876 1.00 0.00 H new ATOM 0 HD13 LEU B 95 -7.957 1.065 -3.022 1.00 0.00 H new ATOM 0 HD21 LEU B 95 -5.440 -0.039 -4.410 1.00 0.00 H new ATOM 0 HD22 LEU B 95 -5.620 1.654 -3.892 1.00 0.00 H new ATOM 0 HD23 LEU B 95 -4.232 0.694 -3.328 1.00 0.00 H new ATOM 2214 N LEU B 96 -4.984 0.042 1.728 1.00 0.00 N ATOM 2215 CA LEU B 96 -4.241 -0.949 2.474 1.00 0.00 C ATOM 2216 C LEU B 96 -5.194 -1.731 3.359 1.00 0.00 C ATOM 2217 O LEU B 96 -5.263 -2.944 3.242 1.00 0.00 O ATOM 2218 CB LEU B 96 -3.118 -0.328 3.278 1.00 0.00 C ATOM 2219 CG LEU B 96 -1.789 -0.255 2.535 1.00 0.00 C ATOM 2220 CD1 LEU B 96 -0.693 0.230 3.458 1.00 0.00 C ATOM 2221 CD2 LEU B 96 -1.425 -1.608 1.948 1.00 0.00 C ATOM 0 H LEU B 96 -4.790 1.010 1.984 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.769 -1.633 1.769 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -3.412 0.679 3.575 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -2.979 -0.903 4.193 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.895 0.457 1.716 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.249 0.276 2.912 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.945 1.222 3.832 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.592 -0.459 4.297 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.473 -1.532 1.422 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -1.339 -2.341 2.750 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -2.201 -1.922 1.250 1.00 0.00 H new ATOM 2233 N GLN B 97 -5.930 -1.050 4.247 1.00 0.00 N ATOM 2234 CA GLN B 97 -6.930 -1.726 5.076 1.00 0.00 C ATOM 2235 C GLN B 97 -7.878 -2.557 4.207 1.00 0.00 C ATOM 2236 O GLN B 97 -8.543 -3.472 4.689 1.00 0.00 O ATOM 2237 CB GLN B 97 -7.725 -0.704 5.888 1.00 0.00 C ATOM 2238 CG GLN B 97 -7.845 0.640 5.215 1.00 0.00 C ATOM 2239 CD GLN B 97 -7.978 1.790 6.190 1.00 0.00 C ATOM 2240 OE1 GLN B 97 -8.506 2.847 5.858 1.00 0.00 O ATOM 2241 NE2 GLN B 97 -7.537 1.585 7.403 1.00 0.00 N ATOM 0 H GLN B 97 -5.852 -0.046 4.407 1.00 0.00 H new ATOM 0 HA GLN B 97 -6.410 -2.395 5.762 1.00 0.00 H new ATOM 0 HB2 GLN B 97 -8.724 -1.098 6.074 1.00 0.00 H new ATOM 0 HB3 GLN B 97 -7.248 -0.573 6.859 1.00 0.00 H new ATOM 0 HG2 GLN B 97 -6.968 0.804 4.588 1.00 0.00 H new ATOM 0 HG3 GLN B 97 -8.712 0.631 4.554 1.00 0.00 H new ATOM 0 HE21 GLN B 97 -7.103 0.694 7.644 1.00 0.00 H new ATOM 0 HE22 GLN B 97 -7.627 2.316 8.109 1.00 0.00 H new ATOM 2250 N GLN B 98 -7.963 -2.198 2.934 1.00 0.00 N ATOM 2251 CA GLN B 98 -8.789 -2.917 1.979 1.00 0.00 C ATOM 2252 C GLN B 98 -8.102 -4.190 1.465 1.00 0.00 C ATOM 2253 O GLN B 98 -8.716 -5.254 1.419 1.00 0.00 O ATOM 2254 CB GLN B 98 -9.130 -1.996 0.801 1.00 0.00 C ATOM 2255 CG GLN B 98 -10.402 -1.195 1.008 1.00 0.00 C ATOM 2256 CD GLN B 98 -10.947 -1.343 2.411 1.00 0.00 C ATOM 2257 OE1 GLN B 98 -10.606 -0.575 3.310 1.00 0.00 O ATOM 2258 NE2 GLN B 98 -11.791 -2.334 2.609 1.00 0.00 N ATOM 0 H GLN B 98 -7.463 -1.403 2.537 1.00 0.00 H new ATOM 0 HA GLN B 98 -9.701 -3.223 2.491 1.00 0.00 H new ATOM 0 HB2 GLN B 98 -8.300 -1.309 0.635 1.00 0.00 H new ATOM 0 HB3 GLN B 98 -9.232 -2.597 -0.103 1.00 0.00 H new ATOM 0 HG2 GLN B 98 -10.204 -0.142 0.806 1.00 0.00 H new ATOM 0 HG3 GLN B 98 -11.155 -1.521 0.291 1.00 0.00 H new ATOM 0 HE21 GLN B 98 -12.047 -2.948 1.836 1.00 0.00 H new ATOM 0 HE22 GLN B 98 -12.189 -2.488 3.536 1.00 0.00 H new ATOM 2267 N LEU B 99 -6.839 -4.072 1.069 1.00 0.00 N ATOM 2268 CA LEU B 99 -6.085 -5.202 0.519 1.00 0.00 C ATOM 2269 C LEU B 99 -5.350 -6.042 1.574 1.00 0.00 C ATOM 2270 O LEU B 99 -5.334 -7.268 1.482 1.00 0.00 O ATOM 2271 CB LEU B 99 -5.084 -4.687 -0.513 1.00 0.00 C ATOM 2272 CG LEU B 99 -5.716 -4.107 -1.775 1.00 0.00 C ATOM 2273 CD1 LEU B 99 -4.738 -3.190 -2.491 1.00 0.00 C ATOM 2274 CD2 LEU B 99 -6.173 -5.221 -2.700 1.00 0.00 C ATOM 0 H LEU B 99 -6.310 -3.201 1.118 1.00 0.00 H new ATOM 0 HA LEU B 99 -6.818 -5.866 0.062 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -4.464 -3.921 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -4.421 -5.505 -0.797 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.587 -3.520 -1.484 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -5.208 -2.787 -3.388 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.456 -2.371 -1.829 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -3.848 -3.754 -2.770 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.621 -4.790 -3.595 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -5.317 -5.834 -2.982 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -6.909 -5.840 -2.188 1.00 0.00 H new ATOM 2286 N LEU B 100 -4.751 -5.375 2.558 1.00 0.00 N ATOM 2287 CA LEU B 100 -3.960 -6.026 3.616 1.00 0.00 C ATOM 2288 C LEU B 100 -4.595 -7.312 4.181 1.00 0.00 C ATOM 2289 O LEU B 100 -3.956 -8.365 4.150 1.00 0.00 O ATOM 2290 CB LEU B 100 -3.652 -5.034 4.754 1.00 0.00 C ATOM 2291 CG LEU B 100 -2.448 -4.119 4.503 1.00 0.00 C ATOM 2292 CD1 LEU B 100 -2.318 -3.051 5.590 1.00 0.00 C ATOM 2293 CD2 LEU B 100 -1.175 -4.943 4.415 1.00 0.00 C ATOM 0 H LEU B 100 -4.797 -4.360 2.650 1.00 0.00 H new ATOM 0 HA LEU B 100 -3.032 -6.338 3.137 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -4.532 -4.414 4.924 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -3.477 -5.598 5.670 1.00 0.00 H new ATOM 0 HG LEU B 100 -2.608 -3.607 3.554 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -1.454 -2.421 5.379 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -3.219 -2.438 5.607 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -2.188 -3.532 6.559 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -0.326 -4.283 4.237 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -1.025 -5.482 5.350 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -1.259 -5.656 3.595 1.00 0.00 H new