USER MOD reduce.3.24.130724 H: found=0, std=0, add=1111, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1112 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 52 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 136 HIS : no HE2:sc= -0.396 K(o=-0.4,f=-1.7!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 GLN : amide:sc= 0.402 K(o=0.4,f=-3.4!) USER MOD Single : A 29 THR OG1 : rot 80:sc= 1.21 USER MOD Single : A 30 TYR OH : rot 80:sc= 0.45 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 0:sc= 0.524 USER MOD Single : A 36 SER OG : rot 81:sc= 0.673 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -170:sc= -0.0117 (180deg=-0.119) USER MOD Single : A 45 THR OG1 : rot 140:sc= -0.0537 USER MOD Single : A 46 LYS NZ :NH3+ 142:sc= -0.562 (180deg=-2.66!) USER MOD Single : A 54 ASN : amide:sc= 0.731 K(o=0.73,f=-1.1) USER MOD Single : A 56 MET CE :methyl -163:sc= -0.133 (180deg=-0.535) USER MOD Single : A 62 TYR OH : rot 89:sc= -0.0218 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.00699) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 138:sc= 1.12 (180deg=0.14) USER MOD Single : A 78 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -18:sc= 0.886 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 158:sc= 0.867 (180deg=0.56) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.14 K(o=-0.14,f=-1.5) USER MOD Single : A 103 THR OG1 : rot -60:sc= -0.121 USER MOD Single : A 107 THR OG1 : rot 180:sc= -0.111 USER MOD Single : A 110 SER OG : rot 26:sc= 0.336 USER MOD Single : A 113 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 117 THR OG1 : rot -168:sc= 0.633 USER MOD Single : A 118 THR OG1 : rot -73:sc= 1.13 USER MOD Single : A 119 CYS SG : rot 15:sc= -3.51! USER MOD Single : A 125 GLN : amide:sc= -0.0377 K(o=-0.038,f=-3.5!) USER MOD Single : A 127 TYR OH : rot 15:sc= -0.431 USER MOD Single : A 134 ASN : amide:sc= 0.121 K(o=0.12,f=-2.2) USER MOD Single : A 135 LYS NZ :NH3+ -112:sc= 0.607 (180deg=-1.8!) USER MOD Single : A 139 ASN : amide:sc= -4.03! C(o=-4!,f=-6.1!) USER MOD Single : A 145 GLN : amide:sc= -0.0338 X(o=-0.034,f=-0.01) USER MOD Single : A 146 LYS NZ :NH3+ -159:sc= -0.121 (180deg=-0.548) USER MOD ----------------------------------------------------------------- ATOM 200 N ILE A 15 9.731 9.415 -16.060 1.00 0.00 N ATOM 201 CA ILE A 15 8.733 9.079 -15.028 1.00 0.00 C ATOM 202 C ILE A 15 9.099 7.746 -14.348 1.00 0.00 C ATOM 203 O ILE A 15 9.063 7.638 -13.131 1.00 0.00 O ATOM 204 CB ILE A 15 7.277 9.020 -15.643 1.00 0.00 C ATOM 205 CG1 ILE A 15 6.896 10.411 -16.258 1.00 0.00 C ATOM 206 CG2 ILE A 15 6.223 8.549 -14.600 1.00 0.00 C ATOM 207 CD1 ILE A 15 6.919 11.566 -15.272 1.00 0.00 C ATOM 0 HA ILE A 15 8.740 9.866 -14.273 1.00 0.00 H new ATOM 0 HB ILE A 15 7.277 8.277 -16.440 1.00 0.00 H new ATOM 0 HG12 ILE A 15 7.584 10.633 -17.074 1.00 0.00 H new ATOM 0 HG13 ILE A 15 5.899 10.341 -16.692 1.00 0.00 H new ATOM 0 HG21 ILE A 15 5.237 8.523 -15.065 1.00 0.00 H new ATOM 0 HG22 ILE A 15 6.483 7.552 -14.245 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.209 9.242 -13.759 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.643 12.487 -15.785 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.210 11.372 -14.467 1.00 0.00 H new ATOM 0 HD13 ILE A 15 7.921 11.669 -14.855 1.00 0.00 H new ATOM 219 N GLU A 16 9.508 6.763 -15.159 1.00 0.00 N ATOM 220 CA GLU A 16 9.900 5.418 -14.687 1.00 0.00 C ATOM 221 C GLU A 16 11.305 5.431 -14.054 1.00 0.00 C ATOM 222 O GLU A 16 11.653 4.519 -13.311 1.00 0.00 O ATOM 223 CB GLU A 16 9.833 4.415 -15.867 1.00 0.00 C ATOM 224 CG GLU A 16 8.424 4.234 -16.465 1.00 0.00 C ATOM 225 CD GLU A 16 8.423 3.401 -17.761 1.00 0.00 C ATOM 226 OE1 GLU A 16 8.670 3.971 -18.848 1.00 0.00 O ATOM 227 OE2 GLU A 16 8.182 2.176 -17.703 1.00 0.00 O ATOM 0 H GLU A 16 9.579 6.874 -16.170 1.00 0.00 H new ATOM 0 HA GLU A 16 9.201 5.104 -13.911 1.00 0.00 H new ATOM 0 HB2 GLU A 16 10.509 4.751 -16.654 1.00 0.00 H new ATOM 0 HB3 GLU A 16 10.198 3.446 -15.526 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.782 3.751 -15.728 1.00 0.00 H new ATOM 0 HG3 GLU A 16 7.993 5.214 -16.669 1.00 0.00 H new ATOM 234 N LYS A 17 12.099 6.475 -14.360 1.00 0.00 N ATOM 235 CA LYS A 17 13.456 6.665 -13.808 1.00 0.00 C ATOM 236 C LYS A 17 13.349 7.023 -12.319 1.00 0.00 C ATOM 237 O LYS A 17 13.830 6.286 -11.445 1.00 0.00 O ATOM 238 CB LYS A 17 14.165 7.808 -14.581 1.00 0.00 C ATOM 239 CG LYS A 17 15.678 7.964 -14.334 1.00 0.00 C ATOM 240 CD LYS A 17 16.253 9.281 -14.933 1.00 0.00 C ATOM 241 CE LYS A 17 15.811 9.552 -16.391 1.00 0.00 C ATOM 242 NZ LYS A 17 16.157 8.455 -17.329 1.00 0.00 N ATOM 0 H LYS A 17 11.816 7.216 -15.001 1.00 0.00 H new ATOM 0 HA LYS A 17 14.035 5.748 -13.915 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.007 7.649 -15.648 1.00 0.00 H new ATOM 0 HB3 LYS A 17 13.678 8.748 -14.324 1.00 0.00 H new ATOM 0 HG2 LYS A 17 15.871 7.943 -13.261 1.00 0.00 H new ATOM 0 HG3 LYS A 17 16.202 7.113 -14.769 1.00 0.00 H new ATOM 0 HD2 LYS A 17 15.943 10.119 -14.308 1.00 0.00 H new ATOM 0 HD3 LYS A 17 17.342 9.241 -14.895 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.733 9.710 -16.412 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.275 10.475 -16.737 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 15.833 8.701 -18.286 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 17.188 8.317 -17.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 15.693 7.576 -17.022 1.00 0.00 H new ATOM 256 N GLN A 18 12.666 8.162 -12.064 1.00 0.00 N ATOM 257 CA GLN A 18 12.402 8.681 -10.710 1.00 0.00 C ATOM 258 C GLN A 18 11.538 7.694 -9.894 1.00 0.00 C ATOM 259 O GLN A 18 11.707 7.569 -8.677 1.00 0.00 O ATOM 260 CB GLN A 18 11.726 10.079 -10.803 1.00 0.00 C ATOM 261 CG GLN A 18 10.377 10.100 -11.556 1.00 0.00 C ATOM 262 CD GLN A 18 9.868 11.507 -11.885 1.00 0.00 C ATOM 263 OE1 GLN A 18 9.142 12.115 -11.101 1.00 0.00 O ATOM 264 NE2 GLN A 18 10.242 12.027 -13.050 1.00 0.00 N ATOM 0 H GLN A 18 12.280 8.750 -12.803 1.00 0.00 H new ATOM 0 HA GLN A 18 13.351 8.789 -10.185 1.00 0.00 H new ATOM 0 HB2 GLN A 18 11.568 10.458 -9.793 1.00 0.00 H new ATOM 0 HB3 GLN A 18 12.412 10.766 -11.298 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.482 9.537 -12.483 1.00 0.00 H new ATOM 0 HG3 GLN A 18 9.628 9.586 -10.953 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.845 11.494 -13.676 1.00 0.00 H new ATOM 0 HE22 GLN A 18 9.926 12.959 -13.318 1.00 0.00 H new ATOM 273 N PHE A 19 10.634 6.986 -10.598 1.00 0.00 N ATOM 274 CA PHE A 19 9.739 5.982 -9.999 1.00 0.00 C ATOM 275 C PHE A 19 10.520 4.750 -9.509 1.00 0.00 C ATOM 276 O PHE A 19 10.319 4.304 -8.375 1.00 0.00 O ATOM 277 CB PHE A 19 8.641 5.571 -11.018 1.00 0.00 C ATOM 278 CG PHE A 19 7.781 4.382 -10.593 1.00 0.00 C ATOM 279 CD1 PHE A 19 6.944 4.486 -9.493 1.00 0.00 C ATOM 280 CD2 PHE A 19 7.822 3.164 -11.278 1.00 0.00 C ATOM 281 CE1 PHE A 19 6.174 3.417 -9.077 1.00 0.00 C ATOM 282 CE2 PHE A 19 7.047 2.095 -10.862 1.00 0.00 C ATOM 283 CZ PHE A 19 6.226 2.227 -9.759 1.00 0.00 C ATOM 0 H PHE A 19 10.505 7.097 -11.604 1.00 0.00 H new ATOM 0 HA PHE A 19 9.261 6.430 -9.128 1.00 0.00 H new ATOM 0 HB2 PHE A 19 7.990 6.427 -11.193 1.00 0.00 H new ATOM 0 HB3 PHE A 19 9.119 5.334 -11.969 1.00 0.00 H new ATOM 0 HD1 PHE A 19 6.893 5.419 -8.952 1.00 0.00 H new ATOM 0 HD2 PHE A 19 8.464 3.056 -12.140 1.00 0.00 H new ATOM 0 HE1 PHE A 19 5.531 3.518 -8.215 1.00 0.00 H new ATOM 0 HE2 PHE A 19 7.084 1.159 -11.399 1.00 0.00 H new ATOM 0 HZ PHE A 19 5.624 1.392 -9.433 1.00 0.00 H new ATOM 293 N ALA A 20 11.405 4.211 -10.367 1.00 0.00 N ATOM 294 CA ALA A 20 12.137 2.964 -10.076 1.00 0.00 C ATOM 295 C ALA A 20 13.062 3.136 -8.860 1.00 0.00 C ATOM 296 O ALA A 20 13.056 2.300 -7.949 1.00 0.00 O ATOM 297 CB ALA A 20 12.936 2.504 -11.305 1.00 0.00 C ATOM 0 H ALA A 20 11.632 4.622 -11.273 1.00 0.00 H new ATOM 0 HA ALA A 20 11.405 2.194 -9.834 1.00 0.00 H new ATOM 0 HB1 ALA A 20 13.468 1.583 -11.069 1.00 0.00 H new ATOM 0 HB2 ALA A 20 12.254 2.326 -12.137 1.00 0.00 H new ATOM 0 HB3 ALA A 20 13.653 3.276 -11.583 1.00 0.00 H new ATOM 303 N VAL A 21 13.823 4.252 -8.845 1.00 0.00 N ATOM 304 CA VAL A 21 14.791 4.540 -7.769 1.00 0.00 C ATOM 305 C VAL A 21 14.079 4.749 -6.410 1.00 0.00 C ATOM 306 O VAL A 21 14.468 4.142 -5.404 1.00 0.00 O ATOM 307 CB VAL A 21 15.735 5.763 -8.120 1.00 0.00 C ATOM 308 CG1 VAL A 21 14.941 7.056 -8.402 1.00 0.00 C ATOM 309 CG2 VAL A 21 16.794 6.000 -7.012 1.00 0.00 C ATOM 0 H VAL A 21 13.784 4.969 -9.569 1.00 0.00 H new ATOM 0 HA VAL A 21 15.432 3.663 -7.679 1.00 0.00 H new ATOM 0 HB VAL A 21 16.257 5.496 -9.039 1.00 0.00 H new ATOM 0 HG11 VAL A 21 15.633 7.864 -8.637 1.00 0.00 H new ATOM 0 HG12 VAL A 21 14.271 6.895 -9.247 1.00 0.00 H new ATOM 0 HG13 VAL A 21 14.357 7.324 -7.522 1.00 0.00 H new ATOM 0 HG21 VAL A 21 17.424 6.846 -7.286 1.00 0.00 H new ATOM 0 HG22 VAL A 21 16.292 6.212 -6.068 1.00 0.00 H new ATOM 0 HG23 VAL A 21 17.411 5.108 -6.902 1.00 0.00 H new ATOM 319 N VAL A 22 12.997 5.561 -6.399 1.00 0.00 N ATOM 320 CA VAL A 22 12.278 5.885 -5.151 1.00 0.00 C ATOM 321 C VAL A 22 11.548 4.646 -4.592 1.00 0.00 C ATOM 322 O VAL A 22 11.476 4.472 -3.377 1.00 0.00 O ATOM 323 CB VAL A 22 11.261 7.083 -5.320 1.00 0.00 C ATOM 324 CG1 VAL A 22 10.024 6.709 -6.174 1.00 0.00 C ATOM 325 CG2 VAL A 22 10.839 7.652 -3.941 1.00 0.00 C ATOM 0 H VAL A 22 12.607 5.999 -7.234 1.00 0.00 H new ATOM 0 HA VAL A 22 13.038 6.205 -4.438 1.00 0.00 H new ATOM 0 HB VAL A 22 11.788 7.863 -5.869 1.00 0.00 H new ATOM 0 HG11 VAL A 22 9.363 7.572 -6.254 1.00 0.00 H new ATOM 0 HG12 VAL A 22 10.347 6.406 -7.170 1.00 0.00 H new ATOM 0 HG13 VAL A 22 9.490 5.886 -5.700 1.00 0.00 H new ATOM 0 HG21 VAL A 22 10.139 8.475 -4.086 1.00 0.00 H new ATOM 0 HG22 VAL A 22 10.360 6.868 -3.355 1.00 0.00 H new ATOM 0 HG23 VAL A 22 11.720 8.014 -3.412 1.00 0.00 H new ATOM 335 N ALA A 23 11.044 3.776 -5.497 1.00 0.00 N ATOM 336 CA ALA A 23 10.260 2.593 -5.124 1.00 0.00 C ATOM 337 C ALA A 23 11.133 1.575 -4.379 1.00 0.00 C ATOM 338 O ALA A 23 10.812 1.179 -3.249 1.00 0.00 O ATOM 339 CB ALA A 23 9.633 1.962 -6.381 1.00 0.00 C ATOM 0 H ALA A 23 11.173 3.881 -6.503 1.00 0.00 H new ATOM 0 HA ALA A 23 9.459 2.900 -4.451 1.00 0.00 H new ATOM 0 HB1 ALA A 23 9.053 1.084 -6.097 1.00 0.00 H new ATOM 0 HB2 ALA A 23 8.980 2.688 -6.865 1.00 0.00 H new ATOM 0 HB3 ALA A 23 10.422 1.667 -7.072 1.00 0.00 H new ATOM 345 N VAL A 24 12.261 1.193 -5.009 1.00 0.00 N ATOM 346 CA VAL A 24 13.164 0.152 -4.483 1.00 0.00 C ATOM 347 C VAL A 24 13.774 0.571 -3.124 1.00 0.00 C ATOM 348 O VAL A 24 13.889 -0.255 -2.200 1.00 0.00 O ATOM 349 CB VAL A 24 14.299 -0.224 -5.519 1.00 0.00 C ATOM 350 CG1 VAL A 24 13.684 -0.806 -6.819 1.00 0.00 C ATOM 351 CG2 VAL A 24 15.233 0.979 -5.833 1.00 0.00 C ATOM 0 H VAL A 24 12.571 1.596 -5.893 1.00 0.00 H new ATOM 0 HA VAL A 24 12.560 -0.741 -4.322 1.00 0.00 H new ATOM 0 HB VAL A 24 14.918 -0.991 -5.055 1.00 0.00 H new ATOM 0 HG11 VAL A 24 14.482 -1.058 -7.518 1.00 0.00 H new ATOM 0 HG12 VAL A 24 13.113 -1.704 -6.581 1.00 0.00 H new ATOM 0 HG13 VAL A 24 13.025 -0.066 -7.273 1.00 0.00 H new ATOM 0 HG21 VAL A 24 15.995 0.671 -6.549 1.00 0.00 H new ATOM 0 HG22 VAL A 24 14.646 1.794 -6.256 1.00 0.00 H new ATOM 0 HG23 VAL A 24 15.713 1.316 -4.914 1.00 0.00 H new ATOM 361 N GLU A 25 14.118 1.877 -2.998 1.00 0.00 N ATOM 362 CA GLU A 25 14.677 2.435 -1.752 1.00 0.00 C ATOM 363 C GLU A 25 13.600 2.521 -0.658 1.00 0.00 C ATOM 364 O GLU A 25 13.879 2.244 0.499 1.00 0.00 O ATOM 365 CB GLU A 25 15.321 3.824 -1.997 1.00 0.00 C ATOM 366 CG GLU A 25 16.522 3.798 -2.961 1.00 0.00 C ATOM 367 CD GLU A 25 17.203 5.171 -3.138 1.00 0.00 C ATOM 368 OE1 GLU A 25 16.547 6.113 -3.630 1.00 0.00 O ATOM 369 OE2 GLU A 25 18.400 5.313 -2.788 1.00 0.00 O ATOM 0 H GLU A 25 14.016 2.560 -3.748 1.00 0.00 H new ATOM 0 HA GLU A 25 15.460 1.759 -1.409 1.00 0.00 H new ATOM 0 HB2 GLU A 25 14.563 4.499 -2.395 1.00 0.00 H new ATOM 0 HB3 GLU A 25 15.645 4.236 -1.041 1.00 0.00 H new ATOM 0 HG2 GLU A 25 17.257 3.082 -2.593 1.00 0.00 H new ATOM 0 HG3 GLU A 25 16.188 3.440 -3.935 1.00 0.00 H new ATOM 376 N GLN A 26 12.358 2.872 -1.051 1.00 0.00 N ATOM 377 CA GLN A 26 11.216 2.992 -0.112 1.00 0.00 C ATOM 378 C GLN A 26 10.896 1.631 0.539 1.00 0.00 C ATOM 379 O GLN A 26 10.522 1.565 1.718 1.00 0.00 O ATOM 380 CB GLN A 26 9.955 3.545 -0.838 1.00 0.00 C ATOM 381 CG GLN A 26 8.778 3.920 0.089 1.00 0.00 C ATOM 382 CD GLN A 26 9.097 5.091 1.020 1.00 0.00 C ATOM 383 OE1 GLN A 26 8.881 6.246 0.665 1.00 0.00 O ATOM 384 NE2 GLN A 26 9.631 4.801 2.202 1.00 0.00 N ATOM 0 H GLN A 26 12.116 3.079 -2.020 1.00 0.00 H new ATOM 0 HA GLN A 26 11.502 3.695 0.671 1.00 0.00 H new ATOM 0 HB2 GLN A 26 10.242 4.427 -1.410 1.00 0.00 H new ATOM 0 HB3 GLN A 26 9.610 2.799 -1.554 1.00 0.00 H new ATOM 0 HG2 GLN A 26 7.910 4.174 -0.520 1.00 0.00 H new ATOM 0 HG3 GLN A 26 8.504 3.052 0.688 1.00 0.00 H new ATOM 0 HE21 GLN A 26 9.796 3.829 2.462 1.00 0.00 H new ATOM 0 HE22 GLN A 26 9.876 5.551 2.849 1.00 0.00 H new ATOM 393 N ALA A 27 11.070 0.553 -0.249 1.00 0.00 N ATOM 394 CA ALA A 27 10.809 -0.828 0.191 1.00 0.00 C ATOM 395 C ALA A 27 11.823 -1.267 1.265 1.00 0.00 C ATOM 396 O ALA A 27 11.431 -1.718 2.353 1.00 0.00 O ATOM 397 CB ALA A 27 10.837 -1.789 -1.008 1.00 0.00 C ATOM 0 H ALA A 27 11.397 0.618 -1.213 1.00 0.00 H new ATOM 0 HA ALA A 27 9.815 -0.860 0.636 1.00 0.00 H new ATOM 0 HB1 ALA A 27 10.642 -2.805 -0.665 1.00 0.00 H new ATOM 0 HB2 ALA A 27 10.072 -1.496 -1.727 1.00 0.00 H new ATOM 0 HB3 ALA A 27 11.817 -1.748 -1.484 1.00 0.00 H new ATOM 403 N GLU A 28 13.133 -1.116 0.957 1.00 0.00 N ATOM 404 CA GLU A 28 14.217 -1.528 1.880 1.00 0.00 C ATOM 405 C GLU A 28 14.285 -0.606 3.121 1.00 0.00 C ATOM 406 O GLU A 28 14.772 -1.021 4.177 1.00 0.00 O ATOM 407 CB GLU A 28 15.585 -1.629 1.128 1.00 0.00 C ATOM 408 CG GLU A 28 16.145 -0.324 0.495 1.00 0.00 C ATOM 409 CD GLU A 28 16.911 0.584 1.481 1.00 0.00 C ATOM 410 OE1 GLU A 28 17.951 0.141 2.019 1.00 0.00 O ATOM 411 OE2 GLU A 28 16.501 1.741 1.708 1.00 0.00 O ATOM 0 H GLU A 28 13.464 -0.714 0.080 1.00 0.00 H new ATOM 0 HA GLU A 28 13.986 -2.526 2.252 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.328 -2.011 1.828 1.00 0.00 H new ATOM 0 HB3 GLU A 28 15.482 -2.371 0.336 1.00 0.00 H new ATOM 0 HG2 GLU A 28 16.810 -0.589 -0.327 1.00 0.00 H new ATOM 0 HG3 GLU A 28 15.318 0.242 0.066 1.00 0.00 H new ATOM 418 N THR A 29 13.793 0.644 2.968 1.00 0.00 N ATOM 419 CA THR A 29 13.627 1.599 4.085 1.00 0.00 C ATOM 420 C THR A 29 12.568 1.086 5.079 1.00 0.00 C ATOM 421 O THR A 29 12.844 0.983 6.272 1.00 0.00 O ATOM 422 CB THR A 29 13.244 3.033 3.567 1.00 0.00 C ATOM 423 OG1 THR A 29 14.345 3.582 2.831 1.00 0.00 O ATOM 424 CG2 THR A 29 12.859 4.012 4.700 1.00 0.00 C ATOM 0 H THR A 29 13.500 1.019 2.066 1.00 0.00 H new ATOM 0 HA THR A 29 14.585 1.677 4.599 1.00 0.00 H new ATOM 0 HB THR A 29 12.365 2.913 2.934 1.00 0.00 H new ATOM 0 HG1 THR A 29 14.353 3.207 1.926 1.00 0.00 H new ATOM 0 HG21 THR A 29 12.606 4.982 4.272 1.00 0.00 H new ATOM 0 HG22 THR A 29 11.999 3.620 5.243 1.00 0.00 H new ATOM 0 HG23 THR A 29 13.700 4.125 5.384 1.00 0.00 H new ATOM 432 N TYR A 30 11.376 0.718 4.552 1.00 0.00 N ATOM 433 CA TYR A 30 10.264 0.151 5.355 1.00 0.00 C ATOM 434 C TYR A 30 10.730 -1.102 6.130 1.00 0.00 C ATOM 435 O TYR A 30 10.372 -1.302 7.299 1.00 0.00 O ATOM 436 CB TYR A 30 9.058 -0.197 4.427 1.00 0.00 C ATOM 437 CG TYR A 30 7.909 -0.957 5.126 1.00 0.00 C ATOM 438 CD1 TYR A 30 6.905 -0.279 5.826 1.00 0.00 C ATOM 439 CD2 TYR A 30 7.851 -2.360 5.108 1.00 0.00 C ATOM 440 CE1 TYR A 30 5.897 -0.970 6.479 1.00 0.00 C ATOM 441 CE2 TYR A 30 6.843 -3.047 5.756 1.00 0.00 C ATOM 442 CZ TYR A 30 5.872 -2.351 6.438 1.00 0.00 C ATOM 443 OH TYR A 30 4.869 -3.041 7.087 1.00 0.00 O ATOM 0 H TYR A 30 11.157 0.805 3.560 1.00 0.00 H new ATOM 0 HA TYR A 30 9.945 0.898 6.082 1.00 0.00 H new ATOM 0 HB2 TYR A 30 8.662 0.727 4.006 1.00 0.00 H new ATOM 0 HB3 TYR A 30 9.420 -0.798 3.593 1.00 0.00 H new ATOM 0 HD1 TYR A 30 6.916 0.800 5.858 1.00 0.00 H new ATOM 0 HD2 TYR A 30 8.611 -2.914 4.576 1.00 0.00 H new ATOM 0 HE1 TYR A 30 5.133 -0.431 7.019 1.00 0.00 H new ATOM 0 HE2 TYR A 30 6.817 -4.126 5.727 1.00 0.00 H new ATOM 0 HH TYR A 30 4.060 -3.040 6.534 1.00 0.00 H new ATOM 453 N TRP A 31 11.580 -1.902 5.470 1.00 0.00 N ATOM 454 CA TRP A 31 12.025 -3.208 5.977 1.00 0.00 C ATOM 455 C TRP A 31 12.979 -2.981 7.161 1.00 0.00 C ATOM 456 O TRP A 31 12.845 -3.587 8.229 1.00 0.00 O ATOM 457 CB TRP A 31 12.721 -4.000 4.837 1.00 0.00 C ATOM 458 CG TRP A 31 13.244 -5.360 5.253 1.00 0.00 C ATOM 459 CD1 TRP A 31 14.449 -5.632 5.846 1.00 0.00 C ATOM 460 CD2 TRP A 31 12.577 -6.619 5.107 1.00 0.00 C ATOM 461 NE1 TRP A 31 14.558 -6.967 6.095 1.00 0.00 N ATOM 462 CE2 TRP A 31 13.431 -7.602 5.636 1.00 0.00 C ATOM 463 CE3 TRP A 31 11.342 -7.015 4.574 1.00 0.00 C ATOM 464 CZ2 TRP A 31 13.086 -8.948 5.662 1.00 0.00 C ATOM 465 CZ3 TRP A 31 11.002 -8.355 4.596 1.00 0.00 C ATOM 466 CH2 TRP A 31 11.875 -9.309 5.133 1.00 0.00 C ATOM 0 H TRP A 31 11.980 -1.659 4.564 1.00 0.00 H new ATOM 0 HA TRP A 31 11.172 -3.794 6.321 1.00 0.00 H new ATOM 0 HB2 TRP A 31 12.015 -4.130 4.017 1.00 0.00 H new ATOM 0 HB3 TRP A 31 13.550 -3.407 4.452 1.00 0.00 H new ATOM 0 HD1 TRP A 31 15.203 -4.895 6.082 1.00 0.00 H new ATOM 0 HE1 TRP A 31 15.350 -7.422 6.550 1.00 0.00 H new ATOM 0 HE3 TRP A 31 10.667 -6.285 4.153 1.00 0.00 H new ATOM 0 HZ2 TRP A 31 13.751 -9.686 6.086 1.00 0.00 H new ATOM 0 HZ3 TRP A 31 10.051 -8.670 4.194 1.00 0.00 H new ATOM 0 HH2 TRP A 31 11.588 -10.350 5.130 1.00 0.00 H new ATOM 477 N LYS A 32 13.926 -2.066 6.926 1.00 0.00 N ATOM 478 CA LYS A 32 14.922 -1.620 7.898 1.00 0.00 C ATOM 479 C LYS A 32 14.231 -1.044 9.163 1.00 0.00 C ATOM 480 O LYS A 32 14.639 -1.351 10.295 1.00 0.00 O ATOM 481 CB LYS A 32 15.851 -0.573 7.182 1.00 0.00 C ATOM 482 CG LYS A 32 16.364 0.609 8.026 1.00 0.00 C ATOM 483 CD LYS A 32 17.407 0.219 9.103 1.00 0.00 C ATOM 484 CE LYS A 32 18.719 -0.319 8.509 1.00 0.00 C ATOM 485 NZ LYS A 32 19.675 -0.724 9.571 1.00 0.00 N ATOM 0 H LYS A 32 14.021 -1.602 6.023 1.00 0.00 H new ATOM 0 HA LYS A 32 15.532 -2.453 8.246 1.00 0.00 H new ATOM 0 HB2 LYS A 32 16.716 -1.105 6.785 1.00 0.00 H new ATOM 0 HB3 LYS A 32 15.307 -0.167 6.329 1.00 0.00 H new ATOM 0 HG2 LYS A 32 16.806 1.350 7.360 1.00 0.00 H new ATOM 0 HG3 LYS A 32 15.515 1.086 8.515 1.00 0.00 H new ATOM 0 HD2 LYS A 32 17.626 1.090 9.720 1.00 0.00 H new ATOM 0 HD3 LYS A 32 16.976 -0.537 9.760 1.00 0.00 H new ATOM 0 HE2 LYS A 32 18.505 -1.173 7.867 1.00 0.00 H new ATOM 0 HE3 LYS A 32 19.175 0.446 7.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 20.548 -1.082 9.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 19.898 0.097 10.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 19.249 -1.472 10.155 1.00 0.00 H new ATOM 499 N LEU A 33 13.170 -0.241 8.948 1.00 0.00 N ATOM 500 CA LEU A 33 12.433 0.429 10.037 1.00 0.00 C ATOM 501 C LEU A 33 11.762 -0.596 10.964 1.00 0.00 C ATOM 502 O LEU A 33 11.808 -0.442 12.181 1.00 0.00 O ATOM 503 CB LEU A 33 11.380 1.423 9.466 1.00 0.00 C ATOM 504 CG LEU A 33 11.944 2.701 8.764 1.00 0.00 C ATOM 505 CD1 LEU A 33 10.806 3.585 8.203 1.00 0.00 C ATOM 506 CD2 LEU A 33 12.874 3.501 9.708 1.00 0.00 C ATOM 0 H LEU A 33 12.801 -0.039 8.019 1.00 0.00 H new ATOM 0 HA LEU A 33 13.154 0.996 10.626 1.00 0.00 H new ATOM 0 HB2 LEU A 33 10.756 0.887 8.751 1.00 0.00 H new ATOM 0 HB3 LEU A 33 10.730 1.739 10.282 1.00 0.00 H new ATOM 0 HG LEU A 33 12.547 2.372 7.918 1.00 0.00 H new ATOM 0 HD11 LEU A 33 11.233 4.465 7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.229 3.016 7.474 1.00 0.00 H new ATOM 0 HD13 LEU A 33 10.153 3.898 9.018 1.00 0.00 H new ATOM 0 HD21 LEU A 33 13.249 4.383 9.188 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.316 3.810 10.592 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.713 2.874 10.009 1.00 0.00 H new ATOM 518 N LEU A 34 11.159 -1.652 10.377 1.00 0.00 N ATOM 519 CA LEU A 34 10.460 -2.696 11.154 1.00 0.00 C ATOM 520 C LEU A 34 11.445 -3.634 11.885 1.00 0.00 C ATOM 521 O LEU A 34 11.237 -3.943 13.061 1.00 0.00 O ATOM 522 CB LEU A 34 9.440 -3.490 10.287 1.00 0.00 C ATOM 523 CG LEU A 34 8.001 -2.885 10.193 1.00 0.00 C ATOM 524 CD1 LEU A 34 7.994 -1.512 9.493 1.00 0.00 C ATOM 525 CD2 LEU A 34 7.024 -3.877 9.524 1.00 0.00 C ATOM 0 H LEU A 34 11.143 -1.803 9.368 1.00 0.00 H new ATOM 0 HA LEU A 34 9.886 -2.178 11.922 1.00 0.00 H new ATOM 0 HB2 LEU A 34 9.842 -3.578 9.278 1.00 0.00 H new ATOM 0 HB3 LEU A 34 9.362 -4.501 10.688 1.00 0.00 H new ATOM 0 HG LEU A 34 7.652 -2.715 11.212 1.00 0.00 H new ATOM 0 HD11 LEU A 34 6.974 -1.130 9.451 1.00 0.00 H new ATOM 0 HD12 LEU A 34 8.619 -0.815 10.052 1.00 0.00 H new ATOM 0 HD13 LEU A 34 8.384 -1.618 8.481 1.00 0.00 H new ATOM 0 HD21 LEU A 34 6.031 -3.430 9.472 1.00 0.00 H new ATOM 0 HD22 LEU A 34 7.372 -4.107 8.517 1.00 0.00 H new ATOM 0 HD23 LEU A 34 6.979 -4.795 10.111 1.00 0.00 H new ATOM 537 N THR A 35 12.532 -4.063 11.207 1.00 0.00 N ATOM 538 CA THR A 35 13.577 -4.925 11.832 1.00 0.00 C ATOM 539 C THR A 35 14.203 -4.256 13.089 1.00 0.00 C ATOM 540 O THR A 35 14.717 -4.946 13.979 1.00 0.00 O ATOM 541 CB THR A 35 14.715 -5.296 10.820 1.00 0.00 C ATOM 542 OG1 THR A 35 15.267 -4.102 10.244 1.00 0.00 O ATOM 543 CG2 THR A 35 14.223 -6.228 9.695 1.00 0.00 C ATOM 0 H THR A 35 12.714 -3.831 10.231 1.00 0.00 H new ATOM 0 HA THR A 35 13.069 -5.840 12.136 1.00 0.00 H new ATOM 0 HB THR A 35 15.480 -5.833 11.382 1.00 0.00 H new ATOM 0 HG1 THR A 35 14.812 -3.318 10.617 1.00 0.00 H new ATOM 0 HG21 THR A 35 15.050 -6.454 9.022 1.00 0.00 H new ATOM 0 HG22 THR A 35 13.845 -7.154 10.129 1.00 0.00 H new ATOM 0 HG23 THR A 35 13.426 -5.736 9.138 1.00 0.00 H new ATOM 551 N SER A 36 14.137 -2.909 13.144 1.00 0.00 N ATOM 552 CA SER A 36 14.589 -2.117 14.298 1.00 0.00 C ATOM 553 C SER A 36 13.452 -1.986 15.343 1.00 0.00 C ATOM 554 O SER A 36 13.589 -2.427 16.492 1.00 0.00 O ATOM 555 CB SER A 36 15.057 -0.720 13.810 1.00 0.00 C ATOM 556 OG SER A 36 16.049 -0.842 12.805 1.00 0.00 O ATOM 0 H SER A 36 13.766 -2.341 12.382 1.00 0.00 H new ATOM 0 HA SER A 36 15.426 -2.622 14.779 1.00 0.00 H new ATOM 0 HB2 SER A 36 14.205 -0.162 13.420 1.00 0.00 H new ATOM 0 HB3 SER A 36 15.453 -0.151 14.651 1.00 0.00 H new ATOM 0 HG SER A 36 15.620 -1.016 11.941 1.00 0.00 H new ATOM 562 N VAL A 37 12.321 -1.385 14.917 1.00 0.00 N ATOM 563 CA VAL A 37 11.173 -1.047 15.792 1.00 0.00 C ATOM 564 C VAL A 37 9.846 -1.544 15.164 1.00 0.00 C ATOM 565 O VAL A 37 9.731 -1.569 13.948 1.00 0.00 O ATOM 566 CB VAL A 37 11.083 0.509 16.064 1.00 0.00 C ATOM 567 CG1 VAL A 37 12.263 0.993 16.936 1.00 0.00 C ATOM 568 CG2 VAL A 37 10.984 1.326 14.745 1.00 0.00 C ATOM 0 H VAL A 37 12.175 -1.117 13.944 1.00 0.00 H new ATOM 0 HA VAL A 37 11.334 -1.550 16.745 1.00 0.00 H new ATOM 0 HB VAL A 37 10.162 0.685 16.619 1.00 0.00 H new ATOM 0 HG11 VAL A 37 12.174 2.066 17.106 1.00 0.00 H new ATOM 0 HG12 VAL A 37 12.246 0.471 17.893 1.00 0.00 H new ATOM 0 HG13 VAL A 37 13.203 0.783 16.425 1.00 0.00 H new ATOM 0 HG21 VAL A 37 10.924 2.389 14.979 1.00 0.00 H new ATOM 0 HG22 VAL A 37 11.867 1.138 14.134 1.00 0.00 H new ATOM 0 HG23 VAL A 37 10.092 1.025 14.196 1.00 0.00 H new ATOM 578 N PRO A 38 8.816 -1.930 15.996 1.00 0.00 N ATOM 579 CA PRO A 38 7.509 -2.421 15.482 1.00 0.00 C ATOM 580 C PRO A 38 6.783 -1.347 14.640 1.00 0.00 C ATOM 581 O PRO A 38 6.826 -0.165 14.975 1.00 0.00 O ATOM 582 CB PRO A 38 6.715 -2.799 16.767 1.00 0.00 C ATOM 583 CG PRO A 38 7.399 -2.074 17.891 1.00 0.00 C ATOM 584 CD PRO A 38 8.849 -1.920 17.481 1.00 0.00 C ATOM 0 HA PRO A 38 7.618 -3.268 14.804 1.00 0.00 H new ATOM 0 HB2 PRO A 38 5.670 -2.499 16.685 1.00 0.00 H new ATOM 0 HB3 PRO A 38 6.725 -3.876 16.932 1.00 0.00 H new ATOM 0 HG2 PRO A 38 6.939 -1.101 18.063 1.00 0.00 H new ATOM 0 HG3 PRO A 38 7.316 -2.635 18.822 1.00 0.00 H new ATOM 0 HD2 PRO A 38 9.273 -0.991 17.863 1.00 0.00 H new ATOM 0 HD3 PRO A 38 9.461 -2.734 17.870 1.00 0.00 H new ATOM 592 N GLY A 39 6.105 -1.779 13.556 1.00 0.00 N ATOM 593 CA GLY A 39 5.467 -0.857 12.599 1.00 0.00 C ATOM 594 C GLY A 39 4.347 0.015 13.190 1.00 0.00 C ATOM 595 O GLY A 39 3.922 0.993 12.562 1.00 0.00 O ATOM 0 H GLY A 39 5.986 -2.765 13.323 1.00 0.00 H new ATOM 0 HA2 GLY A 39 6.233 -0.205 12.180 1.00 0.00 H new ATOM 0 HA3 GLY A 39 5.057 -1.439 11.774 1.00 0.00 H new ATOM 599 N SER A 40 3.882 -0.352 14.402 1.00 0.00 N ATOM 600 CA SER A 40 2.762 0.304 15.101 1.00 0.00 C ATOM 601 C SER A 40 2.972 1.831 15.304 1.00 0.00 C ATOM 602 O SER A 40 2.074 2.617 14.973 1.00 0.00 O ATOM 603 CB SER A 40 2.515 -0.403 16.455 1.00 0.00 C ATOM 604 OG SER A 40 1.448 0.186 17.182 1.00 0.00 O ATOM 0 H SER A 40 4.283 -1.127 14.930 1.00 0.00 H new ATOM 0 HA SER A 40 1.882 0.208 14.465 1.00 0.00 H new ATOM 0 HB2 SER A 40 2.294 -1.456 16.278 1.00 0.00 H new ATOM 0 HB3 SER A 40 3.425 -0.365 17.054 1.00 0.00 H new ATOM 0 HG SER A 40 1.326 -0.292 18.029 1.00 0.00 H new ATOM 610 N LYS A 41 4.146 2.260 15.839 1.00 0.00 N ATOM 611 CA LYS A 41 4.401 3.712 16.091 1.00 0.00 C ATOM 612 C LYS A 41 4.673 4.472 14.780 1.00 0.00 C ATOM 613 O LYS A 41 4.567 5.706 14.736 1.00 0.00 O ATOM 614 CB LYS A 41 5.563 3.969 17.115 1.00 0.00 C ATOM 615 CG LYS A 41 7.013 3.928 16.555 1.00 0.00 C ATOM 616 CD LYS A 41 7.539 2.506 16.295 1.00 0.00 C ATOM 617 CE LYS A 41 7.778 1.707 17.590 1.00 0.00 C ATOM 618 NZ LYS A 41 8.827 2.316 18.455 1.00 0.00 N ATOM 0 H LYS A 41 4.915 1.643 16.100 1.00 0.00 H new ATOM 0 HA LYS A 41 3.486 4.096 16.542 1.00 0.00 H new ATOM 0 HB2 LYS A 41 5.403 4.945 17.572 1.00 0.00 H new ATOM 0 HB3 LYS A 41 5.485 3.228 17.910 1.00 0.00 H new ATOM 0 HG2 LYS A 41 7.049 4.494 15.624 1.00 0.00 H new ATOM 0 HG3 LYS A 41 7.678 4.428 17.259 1.00 0.00 H new ATOM 0 HD2 LYS A 41 6.825 1.969 15.670 1.00 0.00 H new ATOM 0 HD3 LYS A 41 8.472 2.566 15.734 1.00 0.00 H new ATOM 0 HE2 LYS A 41 6.845 1.641 18.149 1.00 0.00 H new ATOM 0 HE3 LYS A 41 8.069 0.688 17.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 9.069 1.658 19.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 9.676 2.511 17.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 8.470 3.205 18.860 1.00 0.00 H new ATOM 632 N LEU A 42 5.035 3.726 13.722 1.00 0.00 N ATOM 633 CA LEU A 42 5.351 4.296 12.410 1.00 0.00 C ATOM 634 C LEU A 42 4.052 4.728 11.703 1.00 0.00 C ATOM 635 O LEU A 42 3.243 3.886 11.291 1.00 0.00 O ATOM 636 CB LEU A 42 6.147 3.267 11.557 1.00 0.00 C ATOM 637 CG LEU A 42 7.507 2.783 12.171 1.00 0.00 C ATOM 638 CD1 LEU A 42 8.155 1.685 11.298 1.00 0.00 C ATOM 639 CD2 LEU A 42 8.478 3.970 12.398 1.00 0.00 C ATOM 0 H LEU A 42 5.115 2.710 13.757 1.00 0.00 H new ATOM 0 HA LEU A 42 5.978 5.178 12.538 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.515 2.395 11.389 1.00 0.00 H new ATOM 0 HB3 LEU A 42 6.347 3.709 10.581 1.00 0.00 H new ATOM 0 HG LEU A 42 7.292 2.345 13.146 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.096 1.370 11.749 1.00 0.00 H new ATOM 0 HD12 LEU A 42 7.482 0.831 11.229 1.00 0.00 H new ATOM 0 HD13 LEU A 42 8.345 2.079 10.300 1.00 0.00 H new ATOM 0 HD21 LEU A 42 9.411 3.601 12.824 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.683 4.460 11.446 1.00 0.00 H new ATOM 0 HD23 LEU A 42 8.024 4.685 13.084 1.00 0.00 H new ATOM 651 N ARG A 43 3.849 6.051 11.652 1.00 0.00 N ATOM 652 CA ARG A 43 2.734 6.679 10.929 1.00 0.00 C ATOM 653 C ARG A 43 3.073 6.756 9.440 1.00 0.00 C ATOM 654 O ARG A 43 4.087 7.354 9.059 1.00 0.00 O ATOM 655 CB ARG A 43 2.434 8.097 11.511 1.00 0.00 C ATOM 656 CG ARG A 43 1.410 8.165 12.683 1.00 0.00 C ATOM 657 CD ARG A 43 1.753 7.300 13.927 1.00 0.00 C ATOM 658 NE ARG A 43 1.625 5.846 13.681 1.00 0.00 N ATOM 659 CZ ARG A 43 0.480 5.185 13.441 1.00 0.00 C ATOM 660 NH1 ARG A 43 -0.702 5.764 13.611 1.00 0.00 N ATOM 661 NH2 ARG A 43 0.531 3.923 13.052 1.00 0.00 N ATOM 0 H ARG A 43 4.460 6.723 12.116 1.00 0.00 H new ATOM 0 HA ARG A 43 1.836 6.074 11.054 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.373 8.531 11.853 1.00 0.00 H new ATOM 0 HB3 ARG A 43 2.068 8.728 10.701 1.00 0.00 H new ATOM 0 HG2 ARG A 43 1.317 9.204 13.000 1.00 0.00 H new ATOM 0 HG3 ARG A 43 0.434 7.857 12.307 1.00 0.00 H new ATOM 0 HD2 ARG A 43 2.772 7.520 14.244 1.00 0.00 H new ATOM 0 HD3 ARG A 43 1.096 7.582 14.750 1.00 0.00 H new ATOM 0 HE ARG A 43 2.484 5.296 13.695 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -0.755 6.731 13.930 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -1.558 5.242 13.422 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.433 3.461 12.937 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -0.332 3.411 12.867 1.00 0.00 H new ATOM 675 N LEU A 44 2.223 6.127 8.616 1.00 0.00 N ATOM 676 CA LEU A 44 2.359 6.142 7.155 1.00 0.00 C ATOM 677 C LEU A 44 2.059 7.559 6.632 1.00 0.00 C ATOM 678 O LEU A 44 2.756 8.077 5.751 1.00 0.00 O ATOM 679 CB LEU A 44 1.415 5.078 6.510 1.00 0.00 C ATOM 680 CG LEU A 44 1.822 3.573 6.669 1.00 0.00 C ATOM 681 CD1 LEU A 44 3.234 3.307 6.108 1.00 0.00 C ATOM 682 CD2 LEU A 44 1.672 3.070 8.126 1.00 0.00 C ATOM 0 H LEU A 44 1.420 5.592 8.946 1.00 0.00 H new ATOM 0 HA LEU A 44 3.380 5.880 6.877 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.420 5.206 6.936 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.337 5.297 5.445 1.00 0.00 H new ATOM 0 HG LEU A 44 1.120 2.991 6.072 1.00 0.00 H new ATOM 0 HD11 LEU A 44 3.483 2.254 6.235 1.00 0.00 H new ATOM 0 HD12 LEU A 44 3.258 3.561 5.048 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.960 3.919 6.644 1.00 0.00 H new ATOM 0 HD21 LEU A 44 1.967 2.022 8.181 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.310 3.661 8.783 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.634 3.172 8.441 1.00 0.00 H new ATOM 694 N THR A 45 1.008 8.166 7.204 1.00 0.00 N ATOM 695 CA THR A 45 0.633 9.573 6.972 1.00 0.00 C ATOM 696 C THR A 45 0.129 10.198 8.282 1.00 0.00 C ATOM 697 O THR A 45 0.039 9.531 9.318 1.00 0.00 O ATOM 698 CB THR A 45 -0.494 9.704 5.887 1.00 0.00 C ATOM 699 OG1 THR A 45 -1.594 8.847 6.230 1.00 0.00 O ATOM 700 CG2 THR A 45 -0.001 9.373 4.476 1.00 0.00 C ATOM 0 H THR A 45 0.383 7.686 7.852 1.00 0.00 H new ATOM 0 HA THR A 45 1.521 10.094 6.614 1.00 0.00 H new ATOM 0 HB THR A 45 -0.813 10.746 5.877 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.438 9.307 6.041 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.823 9.481 3.769 1.00 0.00 H new ATOM 0 HG22 THR A 45 0.804 10.055 4.203 1.00 0.00 H new ATOM 0 HG23 THR A 45 0.367 8.347 4.451 1.00 0.00 H new ATOM 708 N LYS A 46 -0.222 11.495 8.203 1.00 0.00 N ATOM 709 CA LYS A 46 -0.927 12.223 9.275 1.00 0.00 C ATOM 710 C LYS A 46 -2.461 12.120 9.083 1.00 0.00 C ATOM 711 O LYS A 46 -3.223 12.915 9.645 1.00 0.00 O ATOM 712 CB LYS A 46 -0.442 13.705 9.311 1.00 0.00 C ATOM 713 CG LYS A 46 1.079 13.862 9.575 1.00 0.00 C ATOM 714 CD LYS A 46 1.558 15.330 9.757 1.00 0.00 C ATOM 715 CE LYS A 46 1.539 16.176 8.462 1.00 0.00 C ATOM 716 NZ LYS A 46 0.167 16.490 7.990 1.00 0.00 N ATOM 0 H LYS A 46 -0.023 12.072 7.386 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.693 11.769 10.238 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -0.687 14.180 8.361 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -0.992 14.239 10.086 1.00 0.00 H new ATOM 0 HG2 LYS A 46 1.339 13.296 10.469 1.00 0.00 H new ATOM 0 HG3 LYS A 46 1.626 13.416 8.745 1.00 0.00 H new ATOM 0 HD2 LYS A 46 0.927 15.815 10.502 1.00 0.00 H new ATOM 0 HD3 LYS A 46 2.573 15.321 10.155 1.00 0.00 H new ATOM 0 HE2 LYS A 46 2.079 17.107 8.636 1.00 0.00 H new ATOM 0 HE3 LYS A 46 2.073 15.640 7.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 0.143 17.458 7.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -0.105 15.819 7.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -0.500 16.413 8.784 1.00 0.00 H new ATOM 730 N PHE A 47 -2.890 11.098 8.304 1.00 0.00 N ATOM 731 CA PHE A 47 -4.304 10.754 8.064 1.00 0.00 C ATOM 732 C PHE A 47 -4.479 9.215 8.092 1.00 0.00 C ATOM 733 O PHE A 47 -5.529 8.713 7.697 1.00 0.00 O ATOM 734 CB PHE A 47 -4.772 11.309 6.676 1.00 0.00 C ATOM 735 CG PHE A 47 -4.642 12.820 6.517 1.00 0.00 C ATOM 736 CD1 PHE A 47 -5.594 13.677 7.062 1.00 0.00 C ATOM 737 CD2 PHE A 47 -3.565 13.386 5.838 1.00 0.00 C ATOM 738 CE1 PHE A 47 -5.473 15.047 6.938 1.00 0.00 C ATOM 739 CE2 PHE A 47 -3.443 14.757 5.717 1.00 0.00 C ATOM 740 CZ PHE A 47 -4.400 15.585 6.264 1.00 0.00 C ATOM 0 H PHE A 47 -2.244 10.478 7.816 1.00 0.00 H new ATOM 0 HA PHE A 47 -4.912 11.205 8.848 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -4.191 10.824 5.891 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.814 11.029 6.521 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -6.441 13.264 7.590 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -2.815 12.744 5.400 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.220 15.696 7.370 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -2.598 15.180 5.194 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.308 16.656 6.164 1.00 0.00 H new ATOM 750 N ASP A 48 -3.452 8.473 8.587 1.00 0.00 N ATOM 751 CA ASP A 48 -3.346 6.997 8.388 1.00 0.00 C ATOM 752 C ASP A 48 -4.587 6.219 8.895 1.00 0.00 C ATOM 753 O ASP A 48 -5.062 5.285 8.231 1.00 0.00 O ATOM 754 CB ASP A 48 -2.039 6.421 9.022 1.00 0.00 C ATOM 755 CG ASP A 48 -2.015 6.425 10.566 1.00 0.00 C ATOM 756 OD1 ASP A 48 -1.581 7.431 11.153 1.00 0.00 O ATOM 757 OD2 ASP A 48 -2.420 5.413 11.197 1.00 0.00 O ATOM 0 H ASP A 48 -2.684 8.871 9.127 1.00 0.00 H new ATOM 0 HA ASP A 48 -3.302 6.850 7.309 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.902 5.398 8.673 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -1.189 6.998 8.657 1.00 0.00 H new ATOM 762 N ASP A 49 -5.133 6.652 10.039 1.00 0.00 N ATOM 763 CA ASP A 49 -6.254 5.971 10.713 1.00 0.00 C ATOM 764 C ASP A 49 -7.547 6.049 9.871 1.00 0.00 C ATOM 765 O ASP A 49 -8.241 5.037 9.691 1.00 0.00 O ATOM 766 CB ASP A 49 -6.461 6.582 12.122 1.00 0.00 C ATOM 767 CG ASP A 49 -7.566 5.898 12.953 1.00 0.00 C ATOM 768 OD1 ASP A 49 -7.431 4.698 13.261 1.00 0.00 O ATOM 769 OD2 ASP A 49 -8.551 6.564 13.333 1.00 0.00 O ATOM 0 H ASP A 49 -4.811 7.487 10.527 1.00 0.00 H new ATOM 0 HA ASP A 49 -6.009 4.914 10.821 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -5.521 6.525 12.672 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -6.705 7.639 12.015 1.00 0.00 H new ATOM 774 N GLU A 50 -7.830 7.249 9.325 1.00 0.00 N ATOM 775 CA GLU A 50 -9.047 7.502 8.525 1.00 0.00 C ATOM 776 C GLU A 50 -8.909 6.948 7.087 1.00 0.00 C ATOM 777 O GLU A 50 -9.917 6.652 6.449 1.00 0.00 O ATOM 778 CB GLU A 50 -9.407 9.017 8.521 1.00 0.00 C ATOM 779 CG GLU A 50 -8.413 9.936 7.781 1.00 0.00 C ATOM 780 CD GLU A 50 -8.621 11.430 8.086 1.00 0.00 C ATOM 781 OE1 GLU A 50 -9.575 12.027 7.554 1.00 0.00 O ATOM 782 OE2 GLU A 50 -7.841 12.013 8.876 1.00 0.00 O ATOM 0 H GLU A 50 -7.226 8.065 9.425 1.00 0.00 H new ATOM 0 HA GLU A 50 -9.870 6.966 8.997 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -10.391 9.137 8.068 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -9.488 9.356 9.554 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -7.396 9.655 8.055 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -8.510 9.775 6.707 1.00 0.00 H new ATOM 789 N ILE A 51 -7.657 6.800 6.583 1.00 0.00 N ATOM 790 CA ILE A 51 -7.401 6.151 5.268 1.00 0.00 C ATOM 791 C ILE A 51 -7.807 4.662 5.331 1.00 0.00 C ATOM 792 O ILE A 51 -8.452 4.140 4.412 1.00 0.00 O ATOM 793 CB ILE A 51 -5.895 6.289 4.810 1.00 0.00 C ATOM 794 CG1 ILE A 51 -5.517 7.791 4.610 1.00 0.00 C ATOM 795 CG2 ILE A 51 -5.603 5.476 3.512 1.00 0.00 C ATOM 796 CD1 ILE A 51 -4.064 8.040 4.236 1.00 0.00 C ATOM 0 H ILE A 51 -6.814 7.118 7.062 1.00 0.00 H new ATOM 0 HA ILE A 51 -8.008 6.667 4.525 1.00 0.00 H new ATOM 0 HB ILE A 51 -5.275 5.871 5.604 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -6.155 8.211 3.832 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.738 8.332 5.530 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -4.557 5.599 3.233 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -5.809 4.421 3.690 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -6.239 5.839 2.705 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.897 9.111 4.118 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -3.415 7.656 5.023 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -3.838 7.532 3.298 1.00 0.00 H new ATOM 808 N TYR A 52 -7.434 4.016 6.454 1.00 0.00 N ATOM 809 CA TYR A 52 -7.806 2.626 6.774 1.00 0.00 C ATOM 810 C TYR A 52 -9.339 2.461 6.795 1.00 0.00 C ATOM 811 O TYR A 52 -9.889 1.526 6.194 1.00 0.00 O ATOM 812 CB TYR A 52 -7.199 2.238 8.151 1.00 0.00 C ATOM 813 CG TYR A 52 -7.659 0.878 8.698 1.00 0.00 C ATOM 814 CD1 TYR A 52 -7.054 -0.302 8.283 1.00 0.00 C ATOM 815 CD2 TYR A 52 -8.707 0.779 9.621 1.00 0.00 C ATOM 816 CE1 TYR A 52 -7.473 -1.529 8.762 1.00 0.00 C ATOM 817 CE2 TYR A 52 -9.125 -0.445 10.102 1.00 0.00 C ATOM 818 CZ TYR A 52 -8.505 -1.596 9.668 1.00 0.00 C ATOM 819 OH TYR A 52 -8.917 -2.820 10.138 1.00 0.00 O ATOM 0 H TYR A 52 -6.858 4.453 7.173 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.410 1.964 6.004 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -6.113 2.230 8.064 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -7.455 3.011 8.876 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -6.241 -0.260 7.573 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -9.198 1.678 9.963 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -6.990 -2.434 8.425 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -9.934 -0.500 10.815 1.00 0.00 H new ATOM 0 HH TYR A 52 -9.654 -2.696 10.771 1.00 0.00 H new ATOM 829 N GLU A 53 -10.014 3.382 7.512 1.00 0.00 N ATOM 830 CA GLU A 53 -11.473 3.339 7.701 1.00 0.00 C ATOM 831 C GLU A 53 -12.209 3.519 6.363 1.00 0.00 C ATOM 832 O GLU A 53 -13.059 2.707 6.028 1.00 0.00 O ATOM 833 CB GLU A 53 -11.923 4.387 8.751 1.00 0.00 C ATOM 834 CG GLU A 53 -11.361 4.109 10.156 1.00 0.00 C ATOM 835 CD GLU A 53 -11.820 5.124 11.213 1.00 0.00 C ATOM 836 OE1 GLU A 53 -11.295 6.257 11.224 1.00 0.00 O ATOM 837 OE2 GLU A 53 -12.707 4.797 12.037 1.00 0.00 O ATOM 0 H GLU A 53 -9.563 4.172 7.973 1.00 0.00 H new ATOM 0 HA GLU A 53 -11.739 2.354 8.086 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -11.604 5.378 8.427 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -13.012 4.402 8.798 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -11.664 3.110 10.468 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -10.272 4.112 10.110 1.00 0.00 H new ATOM 844 N ASN A 54 -11.827 4.539 5.568 1.00 0.00 N ATOM 845 CA ASN A 54 -12.429 4.774 4.229 1.00 0.00 C ATOM 846 C ASN A 54 -12.132 3.611 3.269 1.00 0.00 C ATOM 847 O ASN A 54 -12.897 3.369 2.338 1.00 0.00 O ATOM 848 CB ASN A 54 -11.966 6.122 3.603 1.00 0.00 C ATOM 849 CG ASN A 54 -12.741 7.327 4.139 1.00 0.00 C ATOM 850 OD1 ASN A 54 -13.777 7.710 3.590 1.00 0.00 O ATOM 851 ND2 ASN A 54 -12.249 7.935 5.207 1.00 0.00 N ATOM 0 H ASN A 54 -11.107 5.214 5.824 1.00 0.00 H new ATOM 0 HA ASN A 54 -13.507 4.833 4.381 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -10.904 6.263 3.802 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -12.084 6.073 2.521 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -12.729 8.745 5.599 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -11.390 7.593 5.638 1.00 0.00 H new ATOM 858 N PHE A 55 -11.032 2.879 3.504 1.00 0.00 N ATOM 859 CA PHE A 55 -10.707 1.699 2.692 1.00 0.00 C ATOM 860 C PHE A 55 -11.720 0.568 2.973 1.00 0.00 C ATOM 861 O PHE A 55 -12.126 -0.123 2.054 1.00 0.00 O ATOM 862 CB PHE A 55 -9.234 1.236 2.925 1.00 0.00 C ATOM 863 CG PHE A 55 -8.635 0.309 1.841 1.00 0.00 C ATOM 864 CD1 PHE A 55 -9.237 0.143 0.589 1.00 0.00 C ATOM 865 CD2 PHE A 55 -7.457 -0.389 2.080 1.00 0.00 C ATOM 866 CE1 PHE A 55 -8.683 -0.684 -0.371 1.00 0.00 C ATOM 867 CE2 PHE A 55 -6.904 -1.219 1.115 1.00 0.00 C ATOM 868 CZ PHE A 55 -7.517 -1.365 -0.106 1.00 0.00 C ATOM 0 H PHE A 55 -10.359 3.082 4.243 1.00 0.00 H new ATOM 0 HA PHE A 55 -10.786 1.968 1.639 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.604 2.122 3.006 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -9.184 0.720 3.884 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -10.153 0.671 0.368 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -6.963 -0.283 3.034 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -9.166 -0.796 -1.330 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -5.988 -1.752 1.325 1.00 0.00 H new ATOM 0 HZ PHE A 55 -7.085 -2.012 -0.855 1.00 0.00 H new ATOM 878 N MET A 56 -12.152 0.404 4.243 1.00 0.00 N ATOM 879 CA MET A 56 -13.140 -0.648 4.612 1.00 0.00 C ATOM 880 C MET A 56 -14.606 -0.183 4.423 1.00 0.00 C ATOM 881 O MET A 56 -15.518 -1.019 4.404 1.00 0.00 O ATOM 882 CB MET A 56 -12.893 -1.169 6.059 1.00 0.00 C ATOM 883 CG MET A 56 -13.090 -0.144 7.173 1.00 0.00 C ATOM 884 SD MET A 56 -12.796 -0.814 8.824 1.00 0.00 S ATOM 885 CE MET A 56 -14.055 -2.088 8.932 1.00 0.00 C ATOM 0 H MET A 56 -11.839 0.977 5.026 1.00 0.00 H new ATOM 0 HA MET A 56 -12.987 -1.477 3.922 1.00 0.00 H new ATOM 0 HB2 MET A 56 -13.561 -2.010 6.242 1.00 0.00 H new ATOM 0 HB3 MET A 56 -11.874 -1.552 6.119 1.00 0.00 H new ATOM 0 HG2 MET A 56 -12.418 0.697 7.005 1.00 0.00 H new ATOM 0 HG3 MET A 56 -14.107 0.245 7.123 1.00 0.00 H new ATOM 0 HE1 MET A 56 -14.195 -2.373 9.975 1.00 0.00 H new ATOM 0 HE2 MET A 56 -14.994 -1.707 8.530 1.00 0.00 H new ATOM 0 HE3 MET A 56 -13.741 -2.959 8.357 1.00 0.00 H new ATOM 895 N GLU A 57 -14.835 1.142 4.305 1.00 0.00 N ATOM 896 CA GLU A 57 -16.168 1.693 3.971 1.00 0.00 C ATOM 897 C GLU A 57 -16.453 1.509 2.469 1.00 0.00 C ATOM 898 O GLU A 57 -17.494 0.970 2.079 1.00 0.00 O ATOM 899 CB GLU A 57 -16.258 3.197 4.349 1.00 0.00 C ATOM 900 CG GLU A 57 -15.999 3.516 5.835 1.00 0.00 C ATOM 901 CD GLU A 57 -17.077 2.997 6.802 1.00 0.00 C ATOM 902 OE1 GLU A 57 -16.971 1.841 7.286 1.00 0.00 O ATOM 903 OE2 GLU A 57 -18.032 3.748 7.097 1.00 0.00 O ATOM 0 H GLU A 57 -14.114 1.852 4.436 1.00 0.00 H new ATOM 0 HA GLU A 57 -16.917 1.150 4.548 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -15.540 3.751 3.744 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -17.249 3.564 4.082 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -15.038 3.090 6.122 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -15.916 4.597 5.951 1.00 0.00 H new ATOM 910 N ARG A 58 -15.500 1.967 1.632 1.00 0.00 N ATOM 911 CA ARG A 58 -15.642 1.951 0.158 1.00 0.00 C ATOM 912 C ARG A 58 -15.281 0.565 -0.417 1.00 0.00 C ATOM 913 O ARG A 58 -15.738 0.205 -1.504 1.00 0.00 O ATOM 914 CB ARG A 58 -14.784 3.071 -0.509 1.00 0.00 C ATOM 915 CG ARG A 58 -15.294 4.532 -0.307 1.00 0.00 C ATOM 916 CD ARG A 58 -15.238 5.018 1.157 1.00 0.00 C ATOM 917 NE ARG A 58 -15.580 6.444 1.320 1.00 0.00 N ATOM 918 CZ ARG A 58 -16.724 6.913 1.847 1.00 0.00 C ATOM 919 NH1 ARG A 58 -17.746 6.097 2.097 1.00 0.00 N ATOM 920 NH2 ARG A 58 -16.851 8.205 2.078 1.00 0.00 N ATOM 0 H ARG A 58 -14.614 2.357 1.954 1.00 0.00 H new ATOM 0 HA ARG A 58 -16.688 2.153 -0.074 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -13.768 3.004 -0.119 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -14.729 2.871 -1.579 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -14.698 5.203 -0.925 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -16.322 4.600 -0.663 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -15.923 4.418 1.757 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -14.236 4.846 1.550 1.00 0.00 H new ATOM 0 HE ARG A 58 -14.892 7.130 1.007 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -17.667 5.102 1.888 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -18.608 6.467 2.497 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -16.084 8.840 1.857 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -17.716 8.569 2.478 1.00 0.00 H new ATOM 934 N PHE A 59 -14.447 -0.205 0.311 1.00 0.00 N ATOM 935 CA PHE A 59 -14.116 -1.607 -0.044 1.00 0.00 C ATOM 936 C PHE A 59 -14.358 -2.519 1.193 1.00 0.00 C ATOM 937 O PHE A 59 -13.402 -2.909 1.875 1.00 0.00 O ATOM 938 CB PHE A 59 -12.635 -1.755 -0.537 1.00 0.00 C ATOM 939 CG PHE A 59 -12.226 -0.896 -1.737 1.00 0.00 C ATOM 940 CD1 PHE A 59 -11.976 0.475 -1.592 1.00 0.00 C ATOM 941 CD2 PHE A 59 -12.051 -1.462 -2.999 1.00 0.00 C ATOM 942 CE1 PHE A 59 -11.571 1.242 -2.669 1.00 0.00 C ATOM 943 CE2 PHE A 59 -11.650 -0.686 -4.073 1.00 0.00 C ATOM 944 CZ PHE A 59 -11.408 0.663 -3.905 1.00 0.00 C ATOM 0 H PHE A 59 -13.984 0.122 1.159 1.00 0.00 H new ATOM 0 HA PHE A 59 -14.763 -1.909 -0.867 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -11.973 -1.516 0.295 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -12.463 -2.801 -0.791 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -12.101 0.939 -0.625 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -12.230 -2.518 -3.140 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -11.382 2.297 -2.539 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -11.526 -1.138 -5.046 1.00 0.00 H new ATOM 0 HZ PHE A 59 -11.091 1.263 -4.745 1.00 0.00 H new ATOM 954 N PRO A 60 -15.647 -2.861 1.526 1.00 0.00 N ATOM 955 CA PRO A 60 -15.958 -3.828 2.614 1.00 0.00 C ATOM 956 C PRO A 60 -15.622 -5.286 2.223 1.00 0.00 C ATOM 957 O PRO A 60 -15.800 -6.211 3.021 1.00 0.00 O ATOM 958 CB PRO A 60 -17.476 -3.619 2.849 1.00 0.00 C ATOM 959 CG PRO A 60 -18.001 -3.150 1.525 1.00 0.00 C ATOM 960 CD PRO A 60 -16.892 -2.317 0.911 1.00 0.00 C ATOM 0 HA PRO A 60 -15.362 -3.657 3.511 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -17.960 -4.544 3.163 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -17.659 -2.883 3.632 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -18.256 -3.994 0.884 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -18.909 -2.560 1.651 1.00 0.00 H new ATOM 0 HD2 PRO A 60 -16.875 -2.413 -0.175 1.00 0.00 H new ATOM 0 HD3 PRO A 60 -17.018 -1.258 1.135 1.00 0.00 H new ATOM 968 N GLU A 61 -15.159 -5.470 0.978 1.00 0.00 N ATOM 969 CA GLU A 61 -14.649 -6.752 0.481 1.00 0.00 C ATOM 970 C GLU A 61 -13.201 -7.010 0.959 1.00 0.00 C ATOM 971 O GLU A 61 -12.797 -8.163 1.117 1.00 0.00 O ATOM 972 CB GLU A 61 -14.721 -6.768 -1.066 1.00 0.00 C ATOM 973 CG GLU A 61 -13.907 -5.653 -1.766 1.00 0.00 C ATOM 974 CD GLU A 61 -14.076 -5.664 -3.289 1.00 0.00 C ATOM 975 OE1 GLU A 61 -15.122 -5.184 -3.769 1.00 0.00 O ATOM 976 OE2 GLU A 61 -13.187 -6.176 -4.009 1.00 0.00 O ATOM 0 H GLU A 61 -15.129 -4.724 0.283 1.00 0.00 H new ATOM 0 HA GLU A 61 -15.271 -7.552 0.884 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -14.366 -7.735 -1.422 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -15.765 -6.680 -1.368 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -14.218 -4.683 -1.377 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -12.852 -5.771 -1.521 1.00 0.00 H new ATOM 983 N TYR A 62 -12.440 -5.922 1.191 1.00 0.00 N ATOM 984 CA TYR A 62 -11.001 -5.991 1.530 1.00 0.00 C ATOM 985 C TYR A 62 -10.801 -6.304 3.038 1.00 0.00 C ATOM 986 O TYR A 62 -9.808 -6.919 3.411 1.00 0.00 O ATOM 987 CB TYR A 62 -10.270 -4.647 1.112 1.00 0.00 C ATOM 988 CG TYR A 62 -9.657 -3.849 2.285 1.00 0.00 C ATOM 989 CD1 TYR A 62 -10.423 -2.942 3.024 1.00 0.00 C ATOM 990 CD2 TYR A 62 -8.337 -4.062 2.698 1.00 0.00 C ATOM 991 CE1 TYR A 62 -9.897 -2.278 4.112 1.00 0.00 C ATOM 992 CE2 TYR A 62 -7.814 -3.387 3.783 1.00 0.00 C ATOM 993 CZ TYR A 62 -8.603 -2.503 4.489 1.00 0.00 C ATOM 994 OH TYR A 62 -8.083 -1.823 5.565 1.00 0.00 O ATOM 0 H TYR A 62 -12.804 -4.970 1.149 1.00 0.00 H new ATOM 0 HA TYR A 62 -10.550 -6.807 0.966 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -9.479 -4.886 0.402 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -10.984 -4.009 0.591 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -11.448 -2.758 2.737 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -7.718 -4.765 2.160 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -10.508 -1.580 4.666 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -6.788 -3.551 4.079 1.00 0.00 H new ATOM 0 HH TYR A 62 -8.260 -2.327 6.387 1.00 0.00 H new ATOM 1004 N LYS A 63 -11.753 -5.847 3.884 1.00 0.00 N ATOM 1005 CA LYS A 63 -11.579 -5.758 5.367 1.00 0.00 C ATOM 1006 C LYS A 63 -11.272 -7.119 6.039 1.00 0.00 C ATOM 1007 O LYS A 63 -10.775 -7.165 7.174 1.00 0.00 O ATOM 1008 CB LYS A 63 -12.834 -5.108 5.998 1.00 0.00 C ATOM 1009 CG LYS A 63 -14.130 -5.932 5.825 1.00 0.00 C ATOM 1010 CD LYS A 63 -15.381 -5.210 6.370 1.00 0.00 C ATOM 1011 CE LYS A 63 -16.660 -6.049 6.221 1.00 0.00 C ATOM 1012 NZ LYS A 63 -17.842 -5.333 6.760 1.00 0.00 N ATOM 0 H LYS A 63 -12.668 -5.527 3.565 1.00 0.00 H new ATOM 0 HA LYS A 63 -10.703 -5.135 5.547 1.00 0.00 H new ATOM 0 HB2 LYS A 63 -12.654 -4.955 7.062 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -12.981 -4.123 5.554 1.00 0.00 H new ATOM 0 HG2 LYS A 63 -14.276 -6.152 4.767 1.00 0.00 H new ATOM 0 HG3 LYS A 63 -14.017 -6.888 6.336 1.00 0.00 H new ATOM 0 HD2 LYS A 63 -15.228 -4.971 7.422 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -15.508 -4.264 5.844 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -16.823 -6.283 5.169 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -16.538 -6.998 6.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 -18.689 -5.925 6.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 -17.695 -5.132 7.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 -17.972 -4.439 6.244 1.00 0.00 H new ATOM 1026 N ASP A 64 -11.596 -8.207 5.326 1.00 0.00 N ATOM 1027 CA ASP A 64 -11.229 -9.583 5.699 1.00 0.00 C ATOM 1028 C ASP A 64 -9.704 -9.727 5.768 1.00 0.00 C ATOM 1029 O ASP A 64 -9.008 -9.231 4.885 1.00 0.00 O ATOM 1030 CB ASP A 64 -11.807 -10.576 4.656 1.00 0.00 C ATOM 1031 CG ASP A 64 -13.344 -10.594 4.634 1.00 0.00 C ATOM 1032 OD1 ASP A 64 -13.955 -9.582 4.212 1.00 0.00 O ATOM 1033 OD2 ASP A 64 -13.952 -11.607 5.047 1.00 0.00 O ATOM 0 H ASP A 64 -12.130 -8.156 4.458 1.00 0.00 H new ATOM 0 HA ASP A 64 -11.645 -9.807 6.681 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -11.438 -10.310 3.665 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -11.440 -11.579 4.875 1.00 0.00 H new ATOM 1038 N VAL A 65 -9.209 -10.420 6.812 1.00 0.00 N ATOM 1039 CA VAL A 65 -7.761 -10.622 7.060 1.00 0.00 C ATOM 1040 C VAL A 65 -7.044 -11.164 5.804 1.00 0.00 C ATOM 1041 O VAL A 65 -5.948 -10.707 5.462 1.00 0.00 O ATOM 1042 CB VAL A 65 -7.523 -11.616 8.262 1.00 0.00 C ATOM 1043 CG1 VAL A 65 -6.011 -11.874 8.521 1.00 0.00 C ATOM 1044 CG2 VAL A 65 -8.227 -11.124 9.551 1.00 0.00 C ATOM 0 H VAL A 65 -9.804 -10.860 7.514 1.00 0.00 H new ATOM 0 HA VAL A 65 -7.344 -9.647 7.312 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.969 -12.568 7.974 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -5.898 -12.564 9.357 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -5.558 -12.307 7.629 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -5.517 -10.932 8.758 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.043 -11.832 10.359 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.835 -10.146 9.829 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.300 -11.048 9.373 1.00 0.00 H new ATOM 1054 N GLU A 66 -7.708 -12.109 5.108 1.00 0.00 N ATOM 1055 CA GLU A 66 -7.165 -12.752 3.897 1.00 0.00 C ATOM 1056 C GLU A 66 -7.156 -11.801 2.683 1.00 0.00 C ATOM 1057 O GLU A 66 -6.360 -11.972 1.765 1.00 0.00 O ATOM 1058 CB GLU A 66 -7.942 -14.046 3.581 1.00 0.00 C ATOM 1059 CG GLU A 66 -7.888 -15.094 4.711 1.00 0.00 C ATOM 1060 CD GLU A 66 -8.491 -16.447 4.309 1.00 0.00 C ATOM 1061 OE1 GLU A 66 -7.752 -17.311 3.790 1.00 0.00 O ATOM 1062 OE2 GLU A 66 -9.708 -16.648 4.484 1.00 0.00 O ATOM 0 H GLU A 66 -8.634 -12.447 5.370 1.00 0.00 H new ATOM 0 HA GLU A 66 -6.126 -13.008 4.102 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -8.983 -13.794 3.381 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -7.540 -14.487 2.669 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -6.851 -15.241 5.013 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -8.421 -14.710 5.580 1.00 0.00 H new ATOM 1069 N ARG A 67 -8.035 -10.802 2.683 1.00 0.00 N ATOM 1070 CA ARG A 67 -8.086 -9.778 1.617 1.00 0.00 C ATOM 1071 C ARG A 67 -7.194 -8.556 1.956 1.00 0.00 C ATOM 1072 O ARG A 67 -6.917 -7.723 1.086 1.00 0.00 O ATOM 1073 CB ARG A 67 -9.559 -9.367 1.382 1.00 0.00 C ATOM 1074 CG ARG A 67 -10.452 -10.476 0.779 1.00 0.00 C ATOM 1075 CD ARG A 67 -10.015 -10.862 -0.648 1.00 0.00 C ATOM 1076 NE ARG A 67 -10.124 -9.720 -1.578 1.00 0.00 N ATOM 1077 CZ ARG A 67 -9.260 -9.422 -2.567 1.00 0.00 C ATOM 1078 NH1 ARG A 67 -8.163 -10.149 -2.769 1.00 0.00 N ATOM 1079 NH2 ARG A 67 -9.493 -8.379 -3.353 1.00 0.00 N ATOM 0 H ARG A 67 -8.734 -10.671 3.414 1.00 0.00 H new ATOM 0 HA ARG A 67 -7.686 -10.201 0.696 1.00 0.00 H new ATOM 0 HB2 ARG A 67 -9.989 -9.050 2.332 1.00 0.00 H new ATOM 0 HB3 ARG A 67 -9.579 -8.503 0.718 1.00 0.00 H new ATOM 0 HG2 ARG A 67 -10.416 -11.357 1.419 1.00 0.00 H new ATOM 0 HG3 ARG A 67 -11.488 -10.137 0.761 1.00 0.00 H new ATOM 0 HD2 ARG A 67 -8.986 -11.220 -0.630 1.00 0.00 H new ATOM 0 HD3 ARG A 67 -10.632 -11.685 -1.008 1.00 0.00 H new ATOM 0 HE ARG A 67 -10.926 -9.101 -1.461 1.00 0.00 H new ATOM 0 HH11 ARG A 67 -7.964 -10.949 -2.169 1.00 0.00 H new ATOM 0 HH12 ARG A 67 -7.522 -9.906 -3.524 1.00 0.00 H new ATOM 0 HH21 ARG A 67 -10.324 -7.806 -3.207 1.00 0.00 H new ATOM 0 HH22 ARG A 67 -8.841 -8.150 -4.103 1.00 0.00 H new ATOM 1093 N VAL A 68 -6.764 -8.468 3.229 1.00 0.00 N ATOM 1094 CA VAL A 68 -5.814 -7.445 3.704 1.00 0.00 C ATOM 1095 C VAL A 68 -4.368 -7.894 3.413 1.00 0.00 C ATOM 1096 O VAL A 68 -3.533 -7.086 2.969 1.00 0.00 O ATOM 1097 CB VAL A 68 -5.996 -7.163 5.248 1.00 0.00 C ATOM 1098 CG1 VAL A 68 -4.889 -6.237 5.806 1.00 0.00 C ATOM 1099 CG2 VAL A 68 -7.383 -6.560 5.552 1.00 0.00 C ATOM 0 H VAL A 68 -7.068 -9.109 3.961 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.019 -6.518 3.168 1.00 0.00 H new ATOM 0 HB VAL A 68 -5.914 -8.128 5.747 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -5.055 -6.071 6.870 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -3.915 -6.705 5.659 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -4.915 -5.282 5.282 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -7.474 -6.379 6.623 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -7.497 -5.619 5.014 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.160 -7.256 5.234 1.00 0.00 H new ATOM 1109 N LYS A 69 -4.085 -9.197 3.668 1.00 0.00 N ATOM 1110 CA LYS A 69 -2.721 -9.749 3.549 1.00 0.00 C ATOM 1111 C LYS A 69 -2.215 -9.690 2.106 1.00 0.00 C ATOM 1112 O LYS A 69 -1.153 -9.127 1.854 1.00 0.00 O ATOM 1113 CB LYS A 69 -2.607 -11.208 4.106 1.00 0.00 C ATOM 1114 CG LYS A 69 -3.606 -12.210 3.504 1.00 0.00 C ATOM 1115 CD LYS A 69 -3.412 -13.665 3.994 1.00 0.00 C ATOM 1116 CE LYS A 69 -2.110 -14.299 3.483 1.00 0.00 C ATOM 1117 NZ LYS A 69 -1.959 -15.704 3.942 1.00 0.00 N ATOM 0 H LYS A 69 -4.786 -9.880 3.957 1.00 0.00 H new ATOM 0 HA LYS A 69 -2.086 -9.115 4.167 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -1.596 -11.572 3.926 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.748 -11.181 5.187 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -4.619 -11.888 3.747 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -3.516 -12.188 2.418 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.414 -13.679 5.084 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -4.258 -14.269 3.666 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -2.095 -14.270 2.393 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -1.260 -13.711 3.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.068 -16.095 3.575 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.947 -15.730 4.982 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.756 -16.272 3.591 1.00 0.00 H new ATOM 1131 N LYS A 70 -2.997 -10.213 1.141 1.00 0.00 N ATOM 1132 CA LYS A 70 -2.503 -10.382 -0.229 1.00 0.00 C ATOM 1133 C LYS A 70 -3.503 -9.892 -1.274 1.00 0.00 C ATOM 1134 O LYS A 70 -4.710 -9.784 -1.025 1.00 0.00 O ATOM 1135 CB LYS A 70 -2.048 -11.862 -0.513 1.00 0.00 C ATOM 1136 CG LYS A 70 -3.104 -12.832 -1.093 1.00 0.00 C ATOM 1137 CD LYS A 70 -4.267 -13.130 -0.129 1.00 0.00 C ATOM 1138 CE LYS A 70 -5.420 -13.881 -0.809 1.00 0.00 C ATOM 1139 NZ LYS A 70 -4.991 -15.200 -1.325 1.00 0.00 N ATOM 0 H LYS A 70 -3.959 -10.520 1.287 1.00 0.00 H new ATOM 0 HA LYS A 70 -1.620 -9.749 -0.317 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -1.206 -11.829 -1.204 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -1.678 -12.286 0.421 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -3.506 -12.409 -2.013 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -2.616 -13.769 -1.360 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -3.897 -13.721 0.709 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -4.642 -12.193 0.283 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -6.234 -14.017 -0.097 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -5.811 -13.280 -1.630 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.809 -15.697 -1.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -4.267 -15.067 -2.060 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -4.595 -15.765 -0.547 1.00 0.00 H new ATOM 1153 N PHE A 71 -2.934 -9.588 -2.427 1.00 0.00 N ATOM 1154 CA PHE A 71 -3.625 -9.287 -3.664 1.00 0.00 C ATOM 1155 C PHE A 71 -2.749 -9.816 -4.811 1.00 0.00 C ATOM 1156 O PHE A 71 -1.569 -10.141 -4.610 1.00 0.00 O ATOM 1157 CB PHE A 71 -3.879 -7.752 -3.803 1.00 0.00 C ATOM 1158 CG PHE A 71 -2.614 -6.884 -3.761 1.00 0.00 C ATOM 1159 CD1 PHE A 71 -1.861 -6.652 -4.916 1.00 0.00 C ATOM 1160 CD2 PHE A 71 -2.184 -6.290 -2.574 1.00 0.00 C ATOM 1161 CE1 PHE A 71 -0.719 -5.875 -4.884 1.00 0.00 C ATOM 1162 CE2 PHE A 71 -1.039 -5.508 -2.545 1.00 0.00 C ATOM 1163 CZ PHE A 71 -0.313 -5.293 -3.701 1.00 0.00 C ATOM 0 H PHE A 71 -1.920 -9.543 -2.529 1.00 0.00 H new ATOM 0 HA PHE A 71 -4.605 -9.764 -3.685 1.00 0.00 H new ATOM 0 HB2 PHE A 71 -4.398 -7.568 -4.744 1.00 0.00 H new ATOM 0 HB3 PHE A 71 -4.547 -7.435 -3.002 1.00 0.00 H new ATOM 0 HD1 PHE A 71 -2.178 -7.089 -5.851 1.00 0.00 H new ATOM 0 HD2 PHE A 71 -2.750 -6.441 -1.667 1.00 0.00 H new ATOM 0 HE1 PHE A 71 -0.144 -5.723 -5.785 1.00 0.00 H new ATOM 0 HE2 PHE A 71 -0.713 -5.065 -1.615 1.00 0.00 H new ATOM 0 HZ PHE A 71 0.570 -4.671 -3.678 1.00 0.00 H new ATOM 1173 N THR A 72 -3.322 -9.903 -5.995 1.00 0.00 N ATOM 1174 CA THR A 72 -2.576 -10.177 -7.220 1.00 0.00 C ATOM 1175 C THR A 72 -2.589 -8.895 -8.075 1.00 0.00 C ATOM 1176 O THR A 72 -3.399 -7.989 -7.833 1.00 0.00 O ATOM 1177 CB THR A 72 -3.198 -11.393 -7.988 1.00 0.00 C ATOM 1178 OG1 THR A 72 -3.524 -12.439 -7.052 1.00 0.00 O ATOM 1179 CG2 THR A 72 -2.240 -11.969 -9.055 1.00 0.00 C ATOM 0 H THR A 72 -4.325 -9.786 -6.141 1.00 0.00 H new ATOM 0 HA THR A 72 -1.547 -10.451 -6.989 1.00 0.00 H new ATOM 0 HB THR A 72 -4.091 -11.029 -8.495 1.00 0.00 H new ATOM 0 HG1 THR A 72 -3.915 -13.198 -7.533 1.00 0.00 H new ATOM 0 HG21 THR A 72 -2.719 -12.809 -9.558 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.002 -11.196 -9.786 1.00 0.00 H new ATOM 0 HG23 THR A 72 -1.322 -12.309 -8.575 1.00 0.00 H new ATOM 1187 N GLU A 73 -1.672 -8.799 -9.038 1.00 0.00 N ATOM 1188 CA GLU A 73 -1.593 -7.648 -9.947 1.00 0.00 C ATOM 1189 C GLU A 73 -2.858 -7.564 -10.834 1.00 0.00 C ATOM 1190 O GLU A 73 -3.443 -6.494 -10.978 1.00 0.00 O ATOM 1191 CB GLU A 73 -0.296 -7.729 -10.794 1.00 0.00 C ATOM 1192 CG GLU A 73 -0.126 -9.023 -11.615 1.00 0.00 C ATOM 1193 CD GLU A 73 1.229 -9.086 -12.335 1.00 0.00 C ATOM 1194 OE1 GLU A 73 1.338 -8.572 -13.469 1.00 0.00 O ATOM 1195 OE2 GLU A 73 2.197 -9.620 -11.753 1.00 0.00 O ATOM 0 H GLU A 73 -0.964 -9.512 -9.212 1.00 0.00 H new ATOM 0 HA GLU A 73 -1.552 -6.731 -9.360 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -0.274 -6.879 -11.477 1.00 0.00 H new ATOM 0 HB3 GLU A 73 0.561 -7.625 -10.128 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -0.224 -9.885 -10.954 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.928 -9.092 -12.350 1.00 0.00 H new ATOM 1202 N GLU A 74 -3.310 -8.736 -11.331 1.00 0.00 N ATOM 1203 CA GLU A 74 -4.419 -8.863 -12.314 1.00 0.00 C ATOM 1204 C GLU A 74 -5.765 -8.314 -11.778 1.00 0.00 C ATOM 1205 O GLU A 74 -6.547 -7.738 -12.541 1.00 0.00 O ATOM 1206 CB GLU A 74 -4.591 -10.348 -12.744 1.00 0.00 C ATOM 1207 CG GLU A 74 -4.800 -11.322 -11.569 1.00 0.00 C ATOM 1208 CD GLU A 74 -5.185 -12.739 -12.010 1.00 0.00 C ATOM 1209 OE1 GLU A 74 -6.394 -13.022 -12.156 1.00 0.00 O ATOM 1210 OE2 GLU A 74 -4.285 -13.577 -12.222 1.00 0.00 O ATOM 0 H GLU A 74 -2.912 -9.635 -11.060 1.00 0.00 H new ATOM 0 HA GLU A 74 -4.143 -8.255 -13.176 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -5.443 -10.423 -13.420 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -3.710 -10.657 -13.306 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -3.884 -11.370 -10.980 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -5.579 -10.929 -10.916 1.00 0.00 H new ATOM 1217 N GLU A 75 -6.015 -8.482 -10.460 1.00 0.00 N ATOM 1218 CA GLU A 75 -7.286 -8.054 -9.821 1.00 0.00 C ATOM 1219 C GLU A 75 -7.309 -6.528 -9.593 1.00 0.00 C ATOM 1220 O GLU A 75 -8.357 -5.958 -9.281 1.00 0.00 O ATOM 1221 CB GLU A 75 -7.524 -8.823 -8.491 1.00 0.00 C ATOM 1222 CG GLU A 75 -6.444 -8.590 -7.426 1.00 0.00 C ATOM 1223 CD GLU A 75 -6.703 -9.350 -6.117 1.00 0.00 C ATOM 1224 OE1 GLU A 75 -6.353 -10.552 -6.033 1.00 0.00 O ATOM 1225 OE2 GLU A 75 -7.239 -8.751 -5.162 1.00 0.00 O ATOM 0 H GLU A 75 -5.353 -8.912 -9.814 1.00 0.00 H new ATOM 0 HA GLU A 75 -8.102 -8.299 -10.501 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -8.491 -8.528 -8.082 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -7.581 -9.890 -8.707 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -5.477 -8.893 -7.828 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -6.380 -7.523 -7.211 1.00 0.00 H new ATOM 1232 N LEU A 76 -6.134 -5.883 -9.742 1.00 0.00 N ATOM 1233 CA LEU A 76 -5.995 -4.414 -9.743 1.00 0.00 C ATOM 1234 C LEU A 76 -6.105 -3.906 -11.193 1.00 0.00 C ATOM 1235 O LEU A 76 -6.597 -2.806 -11.448 1.00 0.00 O ATOM 1236 CB LEU A 76 -4.617 -3.995 -9.160 1.00 0.00 C ATOM 1237 CG LEU A 76 -4.200 -4.654 -7.812 1.00 0.00 C ATOM 1238 CD1 LEU A 76 -2.795 -4.178 -7.390 1.00 0.00 C ATOM 1239 CD2 LEU A 76 -5.248 -4.407 -6.701 1.00 0.00 C ATOM 0 H LEU A 76 -5.248 -6.372 -9.866 1.00 0.00 H new ATOM 0 HA LEU A 76 -6.782 -3.982 -9.126 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -3.851 -4.221 -9.901 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -4.619 -2.914 -9.024 1.00 0.00 H new ATOM 0 HG LEU A 76 -4.159 -5.732 -7.965 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -2.520 -4.648 -6.446 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -2.072 -4.454 -8.157 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -2.799 -3.095 -7.268 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -4.919 -4.883 -5.778 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -5.359 -3.335 -6.537 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -6.206 -4.828 -7.005 1.00 0.00 H new ATOM 1251 N LYS A 77 -5.631 -4.759 -12.133 1.00 0.00 N ATOM 1252 CA LYS A 77 -5.515 -4.434 -13.567 1.00 0.00 C ATOM 1253 C LYS A 77 -6.841 -4.583 -14.330 1.00 0.00 C ATOM 1254 O LYS A 77 -6.880 -4.344 -15.550 1.00 0.00 O ATOM 1255 CB LYS A 77 -4.410 -5.280 -14.228 1.00 0.00 C ATOM 1256 CG LYS A 77 -3.013 -5.005 -13.654 1.00 0.00 C ATOM 1257 CD LYS A 77 -1.909 -5.629 -14.508 1.00 0.00 C ATOM 1258 CE LYS A 77 -0.511 -5.440 -13.908 1.00 0.00 C ATOM 1259 NZ LYS A 77 0.532 -6.130 -14.702 1.00 0.00 N ATOM 0 H LYS A 77 -5.316 -5.703 -11.909 1.00 0.00 H new ATOM 0 HA LYS A 77 -5.242 -3.380 -13.624 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.646 -6.337 -14.102 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.401 -5.081 -15.300 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.854 -3.929 -13.587 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.954 -5.400 -12.640 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.107 -6.694 -14.627 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -1.934 -5.187 -15.504 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -0.281 -4.376 -13.854 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.500 -5.821 -12.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.368 -5.517 -14.785 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.799 -7.017 -14.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.163 -6.341 -15.651 1.00 0.00 H new ATOM 1273 N THR A 78 -7.922 -4.971 -13.633 1.00 0.00 N ATOM 1274 CA THR A 78 -9.266 -4.959 -14.221 1.00 0.00 C ATOM 1275 C THR A 78 -9.800 -3.515 -14.217 1.00 0.00 C ATOM 1276 O THR A 78 -9.457 -2.729 -13.316 1.00 0.00 O ATOM 1277 CB THR A 78 -10.260 -5.928 -13.488 1.00 0.00 C ATOM 1278 OG1 THR A 78 -11.553 -5.882 -14.123 1.00 0.00 O ATOM 1279 CG2 THR A 78 -10.416 -5.619 -11.987 1.00 0.00 C ATOM 0 H THR A 78 -7.889 -5.295 -12.666 1.00 0.00 H new ATOM 0 HA THR A 78 -9.191 -5.326 -15.244 1.00 0.00 H new ATOM 0 HB THR A 78 -9.831 -6.927 -13.567 1.00 0.00 H new ATOM 0 HG1 THR A 78 -12.166 -6.491 -13.661 1.00 0.00 H new ATOM 0 HG21 THR A 78 -11.116 -6.325 -11.541 1.00 0.00 H new ATOM 0 HG22 THR A 78 -9.448 -5.708 -11.495 1.00 0.00 H new ATOM 0 HG23 THR A 78 -10.795 -4.605 -11.862 1.00 0.00 H new ATOM 1287 N LYS A 79 -10.612 -3.183 -15.241 1.00 0.00 N ATOM 1288 CA LYS A 79 -11.186 -1.829 -15.432 1.00 0.00 C ATOM 1289 C LYS A 79 -11.868 -1.321 -14.155 1.00 0.00 C ATOM 1290 O LYS A 79 -11.622 -0.194 -13.721 1.00 0.00 O ATOM 1291 CB LYS A 79 -12.217 -1.838 -16.596 1.00 0.00 C ATOM 1292 CG LYS A 79 -12.923 -0.478 -16.836 1.00 0.00 C ATOM 1293 CD LYS A 79 -14.083 -0.574 -17.849 1.00 0.00 C ATOM 1294 CE LYS A 79 -14.866 0.746 -17.970 1.00 0.00 C ATOM 1295 NZ LYS A 79 -16.048 0.612 -18.858 1.00 0.00 N ATOM 0 H LYS A 79 -10.891 -3.847 -15.963 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.363 -1.157 -15.675 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -11.709 -2.137 -17.513 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -12.974 -2.595 -16.389 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -13.306 -0.101 -15.888 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -12.192 0.246 -17.196 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -13.687 -0.849 -18.826 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -14.763 -1.370 -17.545 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -15.191 1.067 -16.980 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -14.208 1.524 -18.357 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -16.547 1.523 -18.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -15.737 0.331 -19.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -16.689 -0.112 -18.475 1.00 0.00 H new ATOM 1309 N GLU A 80 -12.683 -2.204 -13.552 1.00 0.00 N ATOM 1310 CA GLU A 80 -13.472 -1.902 -12.349 1.00 0.00 C ATOM 1311 C GLU A 80 -12.567 -1.409 -11.205 1.00 0.00 C ATOM 1312 O GLU A 80 -12.838 -0.375 -10.604 1.00 0.00 O ATOM 1313 CB GLU A 80 -14.263 -3.163 -11.908 1.00 0.00 C ATOM 1314 CG GLU A 80 -15.103 -3.826 -13.023 1.00 0.00 C ATOM 1315 CD GLU A 80 -16.152 -2.889 -13.658 1.00 0.00 C ATOM 1316 OE1 GLU A 80 -17.276 -2.783 -13.116 1.00 0.00 O ATOM 1317 OE2 GLU A 80 -15.862 -2.252 -14.705 1.00 0.00 O ATOM 0 H GLU A 80 -12.812 -3.157 -13.891 1.00 0.00 H new ATOM 0 HA GLU A 80 -14.175 -1.104 -12.588 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -13.559 -3.898 -11.518 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -14.926 -2.890 -11.087 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -14.433 -4.186 -13.803 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -15.611 -4.698 -12.611 1.00 0.00 H new ATOM 1324 N ALA A 81 -11.459 -2.137 -10.968 1.00 0.00 N ATOM 1325 CA ALA A 81 -10.517 -1.840 -9.872 1.00 0.00 C ATOM 1326 C ALA A 81 -9.735 -0.541 -10.133 1.00 0.00 C ATOM 1327 O ALA A 81 -9.557 0.257 -9.217 1.00 0.00 O ATOM 1328 CB ALA A 81 -9.558 -3.006 -9.657 1.00 0.00 C ATOM 0 H ALA A 81 -11.192 -2.946 -11.530 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.104 -1.697 -8.964 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -8.871 -2.767 -8.845 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.125 -3.901 -9.402 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -8.991 -3.184 -10.571 1.00 0.00 H new ATOM 1334 N LYS A 82 -9.279 -0.349 -11.391 1.00 0.00 N ATOM 1335 CA LYS A 82 -8.532 0.868 -11.811 1.00 0.00 C ATOM 1336 C LYS A 82 -9.364 2.134 -11.556 1.00 0.00 C ATOM 1337 O LYS A 82 -8.865 3.131 -11.006 1.00 0.00 O ATOM 1338 CB LYS A 82 -8.147 0.787 -13.314 1.00 0.00 C ATOM 1339 CG LYS A 82 -7.073 -0.267 -13.632 1.00 0.00 C ATOM 1340 CD LYS A 82 -6.740 -0.345 -15.139 1.00 0.00 C ATOM 1341 CE LYS A 82 -5.579 -1.302 -15.419 1.00 0.00 C ATOM 1342 NZ LYS A 82 -5.312 -1.480 -16.866 1.00 0.00 N ATOM 0 H LYS A 82 -9.415 -1.025 -12.142 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.620 0.920 -11.216 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -9.042 0.565 -13.896 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -7.789 1.764 -13.639 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -6.165 -0.034 -13.075 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -7.415 -1.243 -13.289 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -7.622 -0.674 -15.689 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -6.487 0.649 -15.507 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -4.679 -0.925 -14.933 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -5.799 -2.272 -14.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.517 -2.138 -16.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -6.159 -1.866 -17.330 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.073 -0.561 -17.291 1.00 0.00 H new ATOM 1356 N GLU A 83 -10.641 2.064 -11.971 1.00 0.00 N ATOM 1357 CA GLU A 83 -11.628 3.123 -11.715 1.00 0.00 C ATOM 1358 C GLU A 83 -11.780 3.327 -10.200 1.00 0.00 C ATOM 1359 O GLU A 83 -11.670 4.442 -9.724 1.00 0.00 O ATOM 1360 CB GLU A 83 -12.997 2.783 -12.364 1.00 0.00 C ATOM 1361 CG GLU A 83 -12.964 2.698 -13.902 1.00 0.00 C ATOM 1362 CD GLU A 83 -14.348 2.433 -14.529 1.00 0.00 C ATOM 1363 OE1 GLU A 83 -14.851 1.292 -14.434 1.00 0.00 O ATOM 1364 OE2 GLU A 83 -14.948 3.370 -15.106 1.00 0.00 O ATOM 0 H GLU A 83 -11.016 1.272 -12.493 1.00 0.00 H new ATOM 0 HA GLU A 83 -11.273 4.049 -12.167 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -13.348 1.831 -11.966 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -13.724 3.539 -12.069 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -12.564 3.630 -14.302 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -12.280 1.904 -14.200 1.00 0.00 H new ATOM 1371 N ARG A 84 -11.955 2.221 -9.454 1.00 0.00 N ATOM 1372 CA ARG A 84 -12.114 2.243 -7.977 1.00 0.00 C ATOM 1373 C ARG A 84 -10.933 2.929 -7.265 1.00 0.00 C ATOM 1374 O ARG A 84 -11.133 3.579 -6.243 1.00 0.00 O ATOM 1375 CB ARG A 84 -12.286 0.810 -7.417 1.00 0.00 C ATOM 1376 CG ARG A 84 -13.668 0.176 -7.660 1.00 0.00 C ATOM 1377 CD ARG A 84 -13.721 -1.288 -7.209 1.00 0.00 C ATOM 1378 NE ARG A 84 -15.066 -1.862 -7.341 1.00 0.00 N ATOM 1379 CZ ARG A 84 -15.464 -3.007 -6.771 1.00 0.00 C ATOM 1380 NH1 ARG A 84 -14.608 -3.742 -6.074 1.00 0.00 N ATOM 1381 NH2 ARG A 84 -16.712 -3.400 -6.907 1.00 0.00 N ATOM 0 H ARG A 84 -11.991 1.283 -9.853 1.00 0.00 H new ATOM 0 HA ARG A 84 -13.013 2.826 -7.777 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -11.526 0.169 -7.863 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -12.096 0.831 -6.344 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -14.427 0.747 -7.125 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -13.912 0.237 -8.721 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -13.018 -1.874 -7.801 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -13.399 -1.358 -6.170 1.00 0.00 H new ATOM 0 HE ARG A 84 -15.745 -1.353 -7.907 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -13.640 -3.436 -5.970 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -14.917 -4.613 -5.642 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -17.369 -2.834 -7.444 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -17.022 -4.271 -6.476 1.00 0.00 H new ATOM 1395 N TRP A 85 -9.707 2.765 -7.808 1.00 0.00 N ATOM 1396 CA TRP A 85 -8.493 3.411 -7.259 1.00 0.00 C ATOM 1397 C TRP A 85 -8.492 4.920 -7.546 1.00 0.00 C ATOM 1398 O TRP A 85 -7.891 5.693 -6.798 1.00 0.00 O ATOM 1399 CB TRP A 85 -7.192 2.751 -7.801 1.00 0.00 C ATOM 1400 CG TRP A 85 -6.982 1.320 -7.339 1.00 0.00 C ATOM 1401 CD1 TRP A 85 -6.754 0.216 -8.123 1.00 0.00 C ATOM 1402 CD2 TRP A 85 -6.973 0.847 -5.977 1.00 0.00 C ATOM 1403 NE1 TRP A 85 -6.634 -0.903 -7.341 1.00 0.00 N ATOM 1404 CE2 TRP A 85 -6.756 -0.540 -6.023 1.00 0.00 C ATOM 1405 CE3 TRP A 85 -7.134 1.463 -4.723 1.00 0.00 C ATOM 1406 CZ2 TRP A 85 -6.694 -1.322 -4.874 1.00 0.00 C ATOM 1407 CZ3 TRP A 85 -7.069 0.684 -3.583 1.00 0.00 C ATOM 1408 CH2 TRP A 85 -6.852 -0.694 -3.667 1.00 0.00 C ATOM 0 H TRP A 85 -9.531 2.188 -8.630 1.00 0.00 H new ATOM 0 HA TRP A 85 -8.513 3.266 -6.179 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -7.215 2.770 -8.891 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -6.337 3.351 -7.490 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -6.680 0.228 -9.200 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -6.479 -1.851 -7.683 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.306 2.527 -4.652 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -6.527 -2.387 -4.932 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -7.188 1.147 -2.614 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -6.808 -1.277 -2.759 1.00 0.00 H new ATOM 1419 N ARG A 86 -9.152 5.319 -8.645 1.00 0.00 N ATOM 1420 CA ARG A 86 -9.352 6.740 -8.997 1.00 0.00 C ATOM 1421 C ARG A 86 -10.417 7.385 -8.084 1.00 0.00 C ATOM 1422 O ARG A 86 -10.214 8.496 -7.604 1.00 0.00 O ATOM 1423 CB ARG A 86 -9.753 6.880 -10.485 1.00 0.00 C ATOM 1424 CG ARG A 86 -10.017 8.327 -10.951 1.00 0.00 C ATOM 1425 CD ARG A 86 -10.325 8.407 -12.452 1.00 0.00 C ATOM 1426 NE ARG A 86 -10.441 9.796 -12.934 1.00 0.00 N ATOM 1427 CZ ARG A 86 -10.197 10.201 -14.192 1.00 0.00 C ATOM 1428 NH1 ARG A 86 -9.858 9.325 -15.135 1.00 0.00 N ATOM 1429 NH2 ARG A 86 -10.298 11.487 -14.495 1.00 0.00 N ATOM 0 H ARG A 86 -9.563 4.669 -9.316 1.00 0.00 H new ATOM 0 HA ARG A 86 -8.409 7.265 -8.844 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -8.962 6.453 -11.102 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -10.650 6.287 -10.662 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -10.853 8.741 -10.388 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -9.146 8.943 -10.727 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -9.538 7.898 -13.008 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -11.255 7.876 -12.657 1.00 0.00 H new ATOM 0 HE ARG A 86 -10.729 10.505 -12.260 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -9.781 8.334 -14.906 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -9.675 9.645 -16.086 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -10.559 12.161 -13.776 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -10.114 11.802 -15.447 1.00 0.00 H new ATOM 1443 N LYS A 87 -11.554 6.683 -7.859 1.00 0.00 N ATOM 1444 CA LYS A 87 -12.595 7.112 -6.881 1.00 0.00 C ATOM 1445 C LYS A 87 -11.991 7.191 -5.468 1.00 0.00 C ATOM 1446 O LYS A 87 -12.334 8.078 -4.682 1.00 0.00 O ATOM 1447 CB LYS A 87 -13.839 6.159 -6.852 1.00 0.00 C ATOM 1448 CG LYS A 87 -14.844 6.288 -8.027 1.00 0.00 C ATOM 1449 CD LYS A 87 -14.272 5.810 -9.373 1.00 0.00 C ATOM 1450 CE LYS A 87 -15.310 5.715 -10.493 1.00 0.00 C ATOM 1451 NZ LYS A 87 -15.912 7.025 -10.814 1.00 0.00 N ATOM 0 H LYS A 87 -11.778 5.813 -8.342 1.00 0.00 H new ATOM 0 HA LYS A 87 -12.940 8.093 -7.208 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -13.479 5.131 -6.824 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -14.379 6.333 -5.922 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.739 5.711 -7.795 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.151 7.330 -8.120 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.480 6.493 -9.682 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.813 4.831 -9.234 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.840 5.305 -11.387 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.096 5.019 -10.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.608 6.909 -11.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -16.385 7.406 -9.970 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.168 7.683 -11.121 1.00 0.00 H new ATOM 1465 N PHE A 88 -11.082 6.253 -5.172 1.00 0.00 N ATOM 1466 CA PHE A 88 -10.404 6.165 -3.873 1.00 0.00 C ATOM 1467 C PHE A 88 -9.430 7.352 -3.718 1.00 0.00 C ATOM 1468 O PHE A 88 -9.326 7.939 -2.647 1.00 0.00 O ATOM 1469 CB PHE A 88 -9.676 4.801 -3.763 1.00 0.00 C ATOM 1470 CG PHE A 88 -9.286 4.386 -2.357 1.00 0.00 C ATOM 1471 CD1 PHE A 88 -10.241 4.342 -1.341 1.00 0.00 C ATOM 1472 CD2 PHE A 88 -7.985 4.012 -2.055 1.00 0.00 C ATOM 1473 CE1 PHE A 88 -9.897 3.937 -0.071 1.00 0.00 C ATOM 1474 CE2 PHE A 88 -7.642 3.615 -0.783 1.00 0.00 C ATOM 1475 CZ PHE A 88 -8.593 3.576 0.208 1.00 0.00 C ATOM 0 H PHE A 88 -10.795 5.530 -5.831 1.00 0.00 H new ATOM 0 HA PHE A 88 -11.130 6.223 -3.062 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -10.319 4.029 -4.187 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.776 4.838 -4.376 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -11.260 4.629 -1.553 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.231 4.033 -2.828 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -10.646 3.902 0.706 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.623 3.333 -0.563 1.00 0.00 H new ATOM 0 HZ PHE A 88 -8.321 3.263 1.205 1.00 0.00 H new ATOM 1485 N PHE A 89 -8.752 7.709 -4.831 1.00 0.00 N ATOM 1486 CA PHE A 89 -7.914 8.917 -4.925 1.00 0.00 C ATOM 1487 C PHE A 89 -8.755 10.191 -4.686 1.00 0.00 C ATOM 1488 O PHE A 89 -8.343 11.051 -3.913 1.00 0.00 O ATOM 1489 CB PHE A 89 -7.182 8.969 -6.313 1.00 0.00 C ATOM 1490 CG PHE A 89 -6.849 10.379 -6.836 1.00 0.00 C ATOM 1491 CD1 PHE A 89 -5.982 11.224 -6.141 1.00 0.00 C ATOM 1492 CD2 PHE A 89 -7.433 10.869 -8.011 1.00 0.00 C ATOM 1493 CE1 PHE A 89 -5.711 12.498 -6.598 1.00 0.00 C ATOM 1494 CE2 PHE A 89 -7.153 12.145 -8.466 1.00 0.00 C ATOM 1495 CZ PHE A 89 -6.295 12.957 -7.758 1.00 0.00 C ATOM 0 H PHE A 89 -8.773 7.162 -5.692 1.00 0.00 H new ATOM 0 HA PHE A 89 -7.155 8.873 -4.144 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -6.255 8.401 -6.236 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -7.805 8.465 -7.052 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -5.516 10.875 -5.231 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.112 10.242 -8.570 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -5.039 13.137 -6.044 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -7.608 12.505 -9.377 1.00 0.00 H new ATOM 0 HZ PHE A 89 -6.080 13.954 -8.113 1.00 0.00 H new ATOM 1505 N THR A 90 -9.926 10.303 -5.352 1.00 0.00 N ATOM 1506 CA THR A 90 -10.759 11.529 -5.295 1.00 0.00 C ATOM 1507 C THR A 90 -11.289 11.810 -3.864 1.00 0.00 C ATOM 1508 O THR A 90 -11.754 12.916 -3.571 1.00 0.00 O ATOM 1509 CB THR A 90 -11.933 11.520 -6.333 1.00 0.00 C ATOM 1510 OG1 THR A 90 -12.816 10.420 -6.081 1.00 0.00 O ATOM 1511 CG2 THR A 90 -11.419 11.453 -7.793 1.00 0.00 C ATOM 0 H THR A 90 -10.316 9.562 -5.934 1.00 0.00 H new ATOM 0 HA THR A 90 -10.094 12.347 -5.573 1.00 0.00 H new ATOM 0 HB THR A 90 -12.474 12.458 -6.212 1.00 0.00 H new ATOM 0 HG1 THR A 90 -12.363 9.760 -5.515 1.00 0.00 H new ATOM 0 HG21 THR A 90 -12.267 11.449 -8.478 1.00 0.00 H new ATOM 0 HG22 THR A 90 -10.791 12.320 -7.998 1.00 0.00 H new ATOM 0 HG23 THR A 90 -10.836 10.542 -7.932 1.00 0.00 H new ATOM 1519 N ILE A 91 -11.234 10.786 -2.995 1.00 0.00 N ATOM 1520 CA ILE A 91 -11.492 10.927 -1.547 1.00 0.00 C ATOM 1521 C ILE A 91 -10.309 11.662 -0.868 1.00 0.00 C ATOM 1522 O ILE A 91 -10.498 12.629 -0.121 1.00 0.00 O ATOM 1523 CB ILE A 91 -11.688 9.506 -0.887 1.00 0.00 C ATOM 1524 CG1 ILE A 91 -12.856 8.733 -1.580 1.00 0.00 C ATOM 1525 CG2 ILE A 91 -11.914 9.592 0.648 1.00 0.00 C ATOM 1526 CD1 ILE A 91 -12.992 7.279 -1.155 1.00 0.00 C ATOM 0 H ILE A 91 -11.008 9.832 -3.276 1.00 0.00 H new ATOM 0 HA ILE A 91 -12.403 11.510 -1.409 1.00 0.00 H new ATOM 0 HB ILE A 91 -10.762 8.951 -1.039 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -13.792 9.249 -1.368 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -12.709 8.770 -2.659 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -12.043 8.589 1.054 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -11.051 10.064 1.117 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -12.807 10.183 0.852 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -13.827 6.821 -1.686 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -12.073 6.743 -1.393 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -13.173 7.229 -0.081 1.00 0.00 H new ATOM 1538 N PHE A 92 -9.080 11.203 -1.183 1.00 0.00 N ATOM 1539 CA PHE A 92 -7.842 11.614 -0.483 1.00 0.00 C ATOM 1540 C PHE A 92 -7.029 12.652 -1.273 1.00 0.00 C ATOM 1541 O PHE A 92 -5.918 12.985 -0.875 1.00 0.00 O ATOM 1542 CB PHE A 92 -6.957 10.389 -0.173 1.00 0.00 C ATOM 1543 CG PHE A 92 -7.654 9.305 0.631 1.00 0.00 C ATOM 1544 CD1 PHE A 92 -7.993 9.495 1.969 1.00 0.00 C ATOM 1545 CD2 PHE A 92 -7.972 8.097 0.043 1.00 0.00 C ATOM 1546 CE1 PHE A 92 -8.630 8.495 2.681 1.00 0.00 C ATOM 1547 CE2 PHE A 92 -8.599 7.108 0.748 1.00 0.00 C ATOM 1548 CZ PHE A 92 -8.931 7.301 2.068 1.00 0.00 C ATOM 0 H PHE A 92 -8.916 10.533 -1.934 1.00 0.00 H new ATOM 0 HA PHE A 92 -8.158 12.084 0.449 1.00 0.00 H new ATOM 0 HB2 PHE A 92 -6.607 9.961 -1.112 1.00 0.00 H new ATOM 0 HB3 PHE A 92 -6.075 10.721 0.374 1.00 0.00 H new ATOM 0 HD1 PHE A 92 -7.756 10.431 2.454 1.00 0.00 H new ATOM 0 HD2 PHE A 92 -7.720 7.930 -0.994 1.00 0.00 H new ATOM 0 HE1 PHE A 92 -8.891 8.651 3.717 1.00 0.00 H new ATOM 0 HE2 PHE A 92 -8.835 6.171 0.266 1.00 0.00 H new ATOM 0 HZ PHE A 92 -9.427 6.518 2.622 1.00 0.00 H new ATOM 1558 N GLU A 93 -7.584 13.171 -2.375 1.00 0.00 N ATOM 1559 CA GLU A 93 -6.964 14.285 -3.134 1.00 0.00 C ATOM 1560 C GLU A 93 -6.951 15.580 -2.284 1.00 0.00 C ATOM 1561 O GLU A 93 -6.191 16.511 -2.552 1.00 0.00 O ATOM 1562 CB GLU A 93 -7.729 14.524 -4.456 1.00 0.00 C ATOM 1563 CG GLU A 93 -9.218 14.864 -4.274 1.00 0.00 C ATOM 1564 CD GLU A 93 -9.858 15.427 -5.550 1.00 0.00 C ATOM 1565 OE1 GLU A 93 -9.798 16.651 -5.764 1.00 0.00 O ATOM 1566 OE2 GLU A 93 -10.407 14.652 -6.358 1.00 0.00 O ATOM 0 H GLU A 93 -8.465 12.841 -2.769 1.00 0.00 H new ATOM 0 HA GLU A 93 -5.935 14.012 -3.367 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -7.247 15.337 -4.999 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -7.645 13.632 -5.077 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -9.756 13.967 -3.968 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -9.325 15.590 -3.468 1.00 0.00 H new ATOM 1573 N LYS A 94 -7.808 15.594 -1.252 1.00 0.00 N ATOM 1574 CA LYS A 94 -8.009 16.733 -0.350 1.00 0.00 C ATOM 1575 C LYS A 94 -6.943 16.782 0.770 1.00 0.00 C ATOM 1576 O LYS A 94 -6.834 17.793 1.482 1.00 0.00 O ATOM 1577 CB LYS A 94 -9.426 16.614 0.278 1.00 0.00 C ATOM 1578 CG LYS A 94 -10.575 16.353 -0.740 1.00 0.00 C ATOM 1579 CD LYS A 94 -10.766 17.493 -1.765 1.00 0.00 C ATOM 1580 CE LYS A 94 -11.176 18.820 -1.107 1.00 0.00 C ATOM 1581 NZ LYS A 94 -11.405 19.883 -2.107 1.00 0.00 N ATOM 0 H LYS A 94 -8.394 14.793 -1.018 1.00 0.00 H new ATOM 0 HA LYS A 94 -7.913 17.654 -0.925 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -9.417 15.805 1.008 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -9.644 17.533 0.822 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -10.371 15.425 -1.275 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -11.507 16.207 -0.194 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -9.838 17.638 -2.318 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -11.526 17.201 -2.489 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -12.084 18.670 -0.522 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -10.398 19.136 -0.412 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -11.680 20.762 -1.623 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -10.532 20.044 -2.648 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -12.165 19.592 -2.755 1.00 0.00 H new ATOM 1595 N LYS A 95 -6.151 15.696 0.921 1.00 0.00 N ATOM 1596 CA LYS A 95 -5.295 15.504 2.105 1.00 0.00 C ATOM 1597 C LYS A 95 -3.937 14.857 1.748 1.00 0.00 C ATOM 1598 O LYS A 95 -2.888 15.291 2.234 1.00 0.00 O ATOM 1599 CB LYS A 95 -6.087 14.674 3.155 1.00 0.00 C ATOM 1600 CG LYS A 95 -6.659 13.307 2.659 1.00 0.00 C ATOM 1601 CD LYS A 95 -8.149 13.094 3.036 1.00 0.00 C ATOM 1602 CE LYS A 95 -8.402 13.100 4.551 1.00 0.00 C ATOM 1603 NZ LYS A 95 -9.849 13.030 4.861 1.00 0.00 N ATOM 0 H LYS A 95 -6.090 14.942 0.236 1.00 0.00 H new ATOM 0 HA LYS A 95 -5.045 16.476 2.530 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -5.433 14.484 4.006 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -6.916 15.281 3.519 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -6.553 13.248 1.576 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -6.065 12.497 3.082 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -8.749 13.877 2.572 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -8.489 12.145 2.622 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -7.889 12.254 5.010 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -7.979 14.004 4.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -9.980 12.668 5.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -10.266 13.980 4.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -10.318 12.393 4.186 1.00 0.00 H new ATOM 1617 N ILE A 96 -3.973 13.798 0.938 1.00 0.00 N ATOM 1618 CA ILE A 96 -2.759 13.148 0.404 1.00 0.00 C ATOM 1619 C ILE A 96 -2.391 13.794 -0.940 1.00 0.00 C ATOM 1620 O ILE A 96 -3.045 13.562 -1.965 1.00 0.00 O ATOM 1621 CB ILE A 96 -2.928 11.584 0.249 1.00 0.00 C ATOM 1622 CG1 ILE A 96 -3.511 10.955 1.560 1.00 0.00 C ATOM 1623 CG2 ILE A 96 -1.581 10.909 -0.149 1.00 0.00 C ATOM 1624 CD1 ILE A 96 -2.741 11.273 2.838 1.00 0.00 C ATOM 0 H ILE A 96 -4.841 13.361 0.629 1.00 0.00 H new ATOM 0 HA ILE A 96 -1.951 13.299 1.120 1.00 0.00 H new ATOM 0 HB ILE A 96 -3.639 11.400 -0.557 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -4.539 11.297 1.681 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.548 9.872 1.438 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -1.728 9.834 -0.248 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -1.236 11.317 -1.099 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -0.835 11.103 0.622 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -3.227 10.790 3.686 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -1.719 10.905 2.748 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -2.726 12.352 2.995 1.00 0.00 H new ATOM 1636 N GLU A 97 -1.361 14.645 -0.892 1.00 0.00 N ATOM 1637 CA GLU A 97 -0.877 15.428 -2.039 1.00 0.00 C ATOM 1638 C GLU A 97 -0.118 14.520 -3.020 1.00 0.00 C ATOM 1639 O GLU A 97 -0.452 14.434 -4.207 1.00 0.00 O ATOM 1640 CB GLU A 97 0.047 16.566 -1.530 1.00 0.00 C ATOM 1641 CG GLU A 97 -0.581 17.437 -0.424 1.00 0.00 C ATOM 1642 CD GLU A 97 0.427 18.385 0.248 1.00 0.00 C ATOM 1643 OE1 GLU A 97 1.239 17.910 1.079 1.00 0.00 O ATOM 1644 OE2 GLU A 97 0.429 19.596 -0.058 1.00 0.00 O ATOM 0 H GLU A 97 -0.828 14.814 -0.039 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.727 15.864 -2.564 1.00 0.00 H new ATOM 0 HB2 GLU A 97 0.971 16.128 -1.152 1.00 0.00 H new ATOM 0 HB3 GLU A 97 0.317 17.204 -2.371 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -1.393 18.025 -0.851 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -1.021 16.789 0.334 1.00 0.00 H new ATOM 1651 N ASP A 98 0.898 13.825 -2.478 1.00 0.00 N ATOM 1652 CA ASP A 98 1.782 12.924 -3.243 1.00 0.00 C ATOM 1653 C ASP A 98 1.201 11.499 -3.271 1.00 0.00 C ATOM 1654 O ASP A 98 1.817 10.549 -2.772 1.00 0.00 O ATOM 1655 CB ASP A 98 3.213 12.930 -2.628 1.00 0.00 C ATOM 1656 CG ASP A 98 3.892 14.304 -2.694 1.00 0.00 C ATOM 1657 OD1 ASP A 98 4.476 14.638 -3.751 1.00 0.00 O ATOM 1658 OD2 ASP A 98 3.846 15.054 -1.692 1.00 0.00 O ATOM 0 H ASP A 98 1.132 13.873 -1.486 1.00 0.00 H new ATOM 0 HA ASP A 98 1.848 13.282 -4.271 1.00 0.00 H new ATOM 0 HB2 ASP A 98 3.156 12.609 -1.588 1.00 0.00 H new ATOM 0 HB3 ASP A 98 3.830 12.201 -3.153 1.00 0.00 H new ATOM 1663 N TYR A 99 -0.010 11.367 -3.840 1.00 0.00 N ATOM 1664 CA TYR A 99 -0.691 10.061 -3.982 1.00 0.00 C ATOM 1665 C TYR A 99 0.041 9.195 -5.035 1.00 0.00 C ATOM 1666 O TYR A 99 0.132 7.979 -4.900 1.00 0.00 O ATOM 1667 CB TYR A 99 -2.192 10.258 -4.368 1.00 0.00 C ATOM 1668 CG TYR A 99 -2.460 10.558 -5.861 1.00 0.00 C ATOM 1669 CD1 TYR A 99 -2.137 11.797 -6.431 1.00 0.00 C ATOM 1670 CD2 TYR A 99 -3.024 9.584 -6.704 1.00 0.00 C ATOM 1671 CE1 TYR A 99 -2.367 12.050 -7.775 1.00 0.00 C ATOM 1672 CE2 TYR A 99 -3.254 9.838 -8.043 1.00 0.00 C ATOM 1673 CZ TYR A 99 -2.928 11.069 -8.572 1.00 0.00 C ATOM 1674 OH TYR A 99 -3.165 11.320 -9.905 1.00 0.00 O ATOM 0 H TYR A 99 -0.543 12.153 -4.212 1.00 0.00 H new ATOM 0 HA TYR A 99 -0.659 9.543 -3.023 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.742 9.358 -4.092 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -2.598 11.075 -3.772 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -1.701 12.568 -5.813 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -3.283 8.618 -6.297 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -2.109 13.010 -8.198 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -3.687 9.075 -8.673 1.00 0.00 H new ATOM 0 HH TYR A 99 -3.561 10.527 -10.322 1.00 0.00 H new ATOM 1684 N ASN A 100 0.552 9.870 -6.083 1.00 0.00 N ATOM 1685 CA ASN A 100 1.327 9.261 -7.174 1.00 0.00 C ATOM 1686 C ASN A 100 2.773 9.767 -7.068 1.00 0.00 C ATOM 1687 O ASN A 100 3.240 10.576 -7.871 1.00 0.00 O ATOM 1688 CB ASN A 100 0.667 9.597 -8.552 1.00 0.00 C ATOM 1689 CG ASN A 100 1.401 9.010 -9.775 1.00 0.00 C ATOM 1690 OD1 ASN A 100 1.191 7.861 -10.151 1.00 0.00 O ATOM 1691 ND2 ASN A 100 2.249 9.804 -10.415 1.00 0.00 N ATOM 0 H ASN A 100 0.433 10.877 -6.194 1.00 0.00 H new ATOM 0 HA ASN A 100 1.335 8.174 -7.095 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -0.359 9.228 -8.549 1.00 0.00 H new ATOM 0 HB3 ASN A 100 0.616 10.680 -8.661 1.00 0.00 H new ATOM 0 HD21 ASN A 100 2.744 9.463 -11.239 1.00 0.00 H new ATOM 0 HD22 ASN A 100 2.407 10.755 -10.083 1.00 0.00 H new ATOM 1698 N PHE A 101 3.435 9.365 -5.979 1.00 0.00 N ATOM 1699 CA PHE A 101 4.858 9.676 -5.733 1.00 0.00 C ATOM 1700 C PHE A 101 5.734 8.500 -6.215 1.00 0.00 C ATOM 1701 O PHE A 101 6.902 8.683 -6.581 1.00 0.00 O ATOM 1702 CB PHE A 101 5.066 9.966 -4.222 1.00 0.00 C ATOM 1703 CG PHE A 101 6.424 10.554 -3.846 1.00 0.00 C ATOM 1704 CD1 PHE A 101 6.710 11.897 -4.088 1.00 0.00 C ATOM 1705 CD2 PHE A 101 7.405 9.775 -3.229 1.00 0.00 C ATOM 1706 CE1 PHE A 101 7.932 12.436 -3.734 1.00 0.00 C ATOM 1707 CE2 PHE A 101 8.627 10.318 -2.878 1.00 0.00 C ATOM 1708 CZ PHE A 101 8.889 11.649 -3.128 1.00 0.00 C ATOM 0 H PHE A 101 3.004 8.813 -5.238 1.00 0.00 H new ATOM 0 HA PHE A 101 5.154 10.564 -6.292 1.00 0.00 H new ATOM 0 HB2 PHE A 101 4.288 10.654 -3.892 1.00 0.00 H new ATOM 0 HB3 PHE A 101 4.926 9.037 -3.669 1.00 0.00 H new ATOM 0 HD1 PHE A 101 5.967 12.524 -4.558 1.00 0.00 H new ATOM 0 HD2 PHE A 101 7.206 8.734 -3.023 1.00 0.00 H new ATOM 0 HE1 PHE A 101 8.139 13.477 -3.933 1.00 0.00 H new ATOM 0 HE2 PHE A 101 9.377 9.700 -2.408 1.00 0.00 H new ATOM 0 HZ PHE A 101 9.842 12.074 -2.850 1.00 0.00 H new ATOM 1718 N GLY A 102 5.134 7.294 -6.218 1.00 0.00 N ATOM 1719 CA GLY A 102 5.782 6.080 -6.698 1.00 0.00 C ATOM 1720 C GLY A 102 6.355 5.253 -5.565 1.00 0.00 C ATOM 1721 O GLY A 102 7.254 5.715 -4.852 1.00 0.00 O ATOM 0 H GLY A 102 4.182 7.145 -5.884 1.00 0.00 H new ATOM 0 HA2 GLY A 102 5.061 5.481 -7.255 1.00 0.00 H new ATOM 0 HA3 GLY A 102 6.580 6.345 -7.392 1.00 0.00 H new ATOM 1725 N THR A 103 5.802 4.043 -5.345 1.00 0.00 N ATOM 1726 CA THR A 103 6.232 3.163 -4.245 1.00 0.00 C ATOM 1727 C THR A 103 6.211 1.672 -4.647 1.00 0.00 C ATOM 1728 O THR A 103 5.426 1.251 -5.505 1.00 0.00 O ATOM 1729 CB THR A 103 5.357 3.409 -2.974 1.00 0.00 C ATOM 1730 OG1 THR A 103 5.344 4.810 -2.682 1.00 0.00 O ATOM 1731 CG2 THR A 103 5.882 2.661 -1.742 1.00 0.00 C ATOM 0 H THR A 103 5.054 3.654 -5.919 1.00 0.00 H new ATOM 0 HA THR A 103 7.267 3.415 -4.013 1.00 0.00 H new ATOM 0 HB THR A 103 4.356 3.035 -3.191 1.00 0.00 H new ATOM 0 HG1 THR A 103 6.259 5.118 -2.516 1.00 0.00 H new ATOM 0 HG21 THR A 103 5.237 2.868 -0.888 1.00 0.00 H new ATOM 0 HG22 THR A 103 5.887 1.589 -1.942 1.00 0.00 H new ATOM 0 HG23 THR A 103 6.896 2.993 -1.519 1.00 0.00 H new ATOM 1739 N LEU A 104 7.099 0.894 -4.009 1.00 0.00 N ATOM 1740 CA LEU A 104 7.171 -0.565 -4.138 1.00 0.00 C ATOM 1741 C LEU A 104 6.365 -1.177 -2.971 1.00 0.00 C ATOM 1742 O LEU A 104 6.679 -0.916 -1.802 1.00 0.00 O ATOM 1743 CB LEU A 104 8.673 -0.989 -4.087 1.00 0.00 C ATOM 1744 CG LEU A 104 9.101 -2.316 -4.777 1.00 0.00 C ATOM 1745 CD1 LEU A 104 8.499 -3.557 -4.104 1.00 0.00 C ATOM 1746 CD2 LEU A 104 8.799 -2.264 -6.280 1.00 0.00 C ATOM 0 H LEU A 104 7.802 1.273 -3.375 1.00 0.00 H new ATOM 0 HA LEU A 104 6.751 -0.917 -5.080 1.00 0.00 H new ATOM 0 HB2 LEU A 104 9.259 -0.183 -4.529 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.962 -1.054 -3.038 1.00 0.00 H new ATOM 0 HG LEU A 104 10.180 -2.414 -4.655 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.832 -4.453 -4.628 1.00 0.00 H new ATOM 0 HD12 LEU A 104 8.825 -3.602 -3.065 1.00 0.00 H new ATOM 0 HD13 LEU A 104 7.411 -3.499 -4.140 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.105 -3.201 -6.745 1.00 0.00 H new ATOM 0 HD22 LEU A 104 7.730 -2.116 -6.431 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.347 -1.438 -6.733 1.00 0.00 H new ATOM 1758 N LEU A 105 5.333 -1.979 -3.287 1.00 0.00 N ATOM 1759 CA LEU A 105 4.511 -2.679 -2.277 1.00 0.00 C ATOM 1760 C LEU A 105 4.505 -4.172 -2.598 1.00 0.00 C ATOM 1761 O LEU A 105 4.475 -4.557 -3.762 1.00 0.00 O ATOM 1762 CB LEU A 105 3.061 -2.125 -2.264 1.00 0.00 C ATOM 1763 CG LEU A 105 2.054 -2.782 -1.259 1.00 0.00 C ATOM 1764 CD1 LEU A 105 2.486 -2.584 0.215 1.00 0.00 C ATOM 1765 CD2 LEU A 105 0.616 -2.270 -1.505 1.00 0.00 C ATOM 0 H LEU A 105 5.043 -2.162 -4.248 1.00 0.00 H new ATOM 0 HA LEU A 105 4.938 -2.514 -1.288 1.00 0.00 H new ATOM 0 HB2 LEU A 105 3.109 -1.058 -2.046 1.00 0.00 H new ATOM 0 HB3 LEU A 105 2.651 -2.227 -3.269 1.00 0.00 H new ATOM 0 HG LEU A 105 2.064 -3.856 -1.444 1.00 0.00 H new ATOM 0 HD11 LEU A 105 1.758 -3.056 0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 105 3.465 -3.038 0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 105 2.540 -1.518 0.438 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -0.064 -2.741 -0.795 1.00 0.00 H new ATOM 0 HD22 LEU A 105 0.587 -1.188 -1.373 1.00 0.00 H new ATOM 0 HD23 LEU A 105 0.310 -2.520 -2.521 1.00 0.00 H new ATOM 1777 N ARG A 106 4.551 -5.010 -1.561 1.00 0.00 N ATOM 1778 CA ARG A 106 4.510 -6.469 -1.720 1.00 0.00 C ATOM 1779 C ARG A 106 3.065 -6.927 -1.999 1.00 0.00 C ATOM 1780 O ARG A 106 2.109 -6.334 -1.471 1.00 0.00 O ATOM 1781 CB ARG A 106 5.103 -7.142 -0.455 1.00 0.00 C ATOM 1782 CG ARG A 106 4.258 -6.978 0.830 1.00 0.00 C ATOM 1783 CD ARG A 106 5.101 -7.047 2.115 1.00 0.00 C ATOM 1784 NE ARG A 106 5.876 -5.811 2.275 1.00 0.00 N ATOM 1785 CZ ARG A 106 5.378 -4.656 2.757 1.00 0.00 C ATOM 1786 NH1 ARG A 106 4.175 -4.621 3.327 1.00 0.00 N ATOM 1787 NH2 ARG A 106 6.082 -3.546 2.672 1.00 0.00 N ATOM 0 H ARG A 106 4.617 -4.701 -0.591 1.00 0.00 H new ATOM 0 HA ARG A 106 5.116 -6.771 -2.574 1.00 0.00 H new ATOM 0 HB2 ARG A 106 5.231 -8.206 -0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 106 6.096 -6.730 -0.274 1.00 0.00 H new ATOM 0 HG2 ARG A 106 3.736 -6.022 0.795 1.00 0.00 H new ATOM 0 HG3 ARG A 106 3.496 -7.757 0.859 1.00 0.00 H new ATOM 0 HD2 ARG A 106 4.452 -7.193 2.978 1.00 0.00 H new ATOM 0 HD3 ARG A 106 5.773 -7.904 2.073 1.00 0.00 H new ATOM 0 HE ARG A 106 6.859 -5.828 2.003 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.621 -5.474 3.402 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.807 -3.741 3.689 1.00 0.00 H new ATOM 0 HH21 ARG A 106 7.006 -3.560 2.241 1.00 0.00 H new ATOM 0 HH22 ARG A 106 5.703 -2.672 3.038 1.00 0.00 H new ATOM 1801 N THR A 107 2.917 -7.960 -2.851 1.00 0.00 N ATOM 1802 CA THR A 107 1.609 -8.542 -3.189 1.00 0.00 C ATOM 1803 C THR A 107 0.972 -9.161 -1.942 1.00 0.00 C ATOM 1804 O THR A 107 -0.174 -8.873 -1.616 1.00 0.00 O ATOM 1805 CB THR A 107 1.727 -9.621 -4.310 1.00 0.00 C ATOM 1806 OG1 THR A 107 2.599 -10.682 -3.888 1.00 0.00 O ATOM 1807 CG2 THR A 107 2.251 -9.028 -5.623 1.00 0.00 C ATOM 0 H THR A 107 3.701 -8.412 -3.322 1.00 0.00 H new ATOM 0 HA THR A 107 0.978 -7.736 -3.564 1.00 0.00 H new ATOM 0 HB THR A 107 0.725 -10.011 -4.489 1.00 0.00 H new ATOM 0 HG1 THR A 107 2.664 -11.354 -4.598 1.00 0.00 H new ATOM 0 HG21 THR A 107 2.318 -9.813 -6.376 1.00 0.00 H new ATOM 0 HG22 THR A 107 1.570 -8.251 -5.969 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.239 -8.598 -5.459 1.00 0.00 H new ATOM 1815 N ASP A 108 1.773 -9.980 -1.235 1.00 0.00 N ATOM 1816 CA ASP A 108 1.380 -10.640 0.017 1.00 0.00 C ATOM 1817 C ASP A 108 2.200 -10.085 1.188 1.00 0.00 C ATOM 1818 O ASP A 108 3.420 -9.955 1.089 1.00 0.00 O ATOM 1819 CB ASP A 108 1.535 -12.182 -0.093 1.00 0.00 C ATOM 1820 CG ASP A 108 1.332 -12.918 1.251 1.00 0.00 C ATOM 1821 OD1 ASP A 108 0.333 -12.637 1.954 1.00 0.00 O ATOM 1822 OD2 ASP A 108 2.178 -13.757 1.627 1.00 0.00 O ATOM 0 H ASP A 108 2.725 -10.203 -1.525 1.00 0.00 H new ATOM 0 HA ASP A 108 0.327 -10.428 0.203 1.00 0.00 H new ATOM 0 HB2 ASP A 108 0.815 -12.561 -0.818 1.00 0.00 H new ATOM 0 HB3 ASP A 108 2.528 -12.413 -0.479 1.00 0.00 H new ATOM 1827 N ALA A 109 1.502 -9.822 2.307 1.00 0.00 N ATOM 1828 CA ALA A 109 2.061 -9.183 3.508 1.00 0.00 C ATOM 1829 C ALA A 109 3.128 -10.070 4.154 1.00 0.00 C ATOM 1830 O ALA A 109 4.198 -9.596 4.543 1.00 0.00 O ATOM 1831 CB ALA A 109 0.944 -8.895 4.519 1.00 0.00 C ATOM 0 H ALA A 109 0.513 -10.053 2.402 1.00 0.00 H new ATOM 0 HA ALA A 109 2.528 -8.245 3.208 1.00 0.00 H new ATOM 0 HB1 ALA A 109 1.368 -8.422 5.405 1.00 0.00 H new ATOM 0 HB2 ALA A 109 0.209 -8.228 4.069 1.00 0.00 H new ATOM 0 HB3 ALA A 109 0.461 -9.830 4.803 1.00 0.00 H new ATOM 1837 N SER A 110 2.805 -11.373 4.228 1.00 0.00 N ATOM 1838 CA SER A 110 3.666 -12.396 4.836 1.00 0.00 C ATOM 1839 C SER A 110 4.642 -13.015 3.798 1.00 0.00 C ATOM 1840 O SER A 110 5.242 -14.065 4.052 1.00 0.00 O ATOM 1841 CB SER A 110 2.771 -13.462 5.516 1.00 0.00 C ATOM 1842 OG SER A 110 1.742 -13.930 4.648 1.00 0.00 O ATOM 0 H SER A 110 1.929 -11.747 3.863 1.00 0.00 H new ATOM 0 HA SER A 110 4.298 -11.936 5.595 1.00 0.00 H new ATOM 0 HB2 SER A 110 3.387 -14.303 5.834 1.00 0.00 H new ATOM 0 HB3 SER A 110 2.322 -13.038 6.414 1.00 0.00 H new ATOM 0 HG SER A 110 2.027 -13.825 3.716 1.00 0.00 H new ATOM 1848 N ALA A 111 4.793 -12.346 2.633 1.00 0.00 N ATOM 1849 CA ALA A 111 5.789 -12.707 1.601 1.00 0.00 C ATOM 1850 C ALA A 111 6.907 -11.657 1.566 1.00 0.00 C ATOM 1851 O ALA A 111 6.683 -10.481 1.891 1.00 0.00 O ATOM 1852 CB ALA A 111 5.125 -12.840 0.223 1.00 0.00 C ATOM 0 H ALA A 111 4.225 -11.537 2.382 1.00 0.00 H new ATOM 0 HA ALA A 111 6.222 -13.674 1.857 1.00 0.00 H new ATOM 0 HB1 ALA A 111 5.878 -13.106 -0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 111 4.362 -13.617 0.260 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.664 -11.891 -0.052 1.00 0.00 H new ATOM 1858 N GLU A 112 8.102 -12.097 1.160 1.00 0.00 N ATOM 1859 CA GLU A 112 9.321 -11.267 1.160 1.00 0.00 C ATOM 1860 C GLU A 112 9.393 -10.331 -0.077 1.00 0.00 C ATOM 1861 O GLU A 112 8.459 -10.262 -0.887 1.00 0.00 O ATOM 1862 CB GLU A 112 10.596 -12.175 1.300 1.00 0.00 C ATOM 1863 CG GLU A 112 10.567 -13.539 0.561 1.00 0.00 C ATOM 1864 CD GLU A 112 10.295 -13.445 -0.951 1.00 0.00 C ATOM 1865 OE1 GLU A 112 11.208 -13.056 -1.710 1.00 0.00 O ATOM 1866 OE2 GLU A 112 9.171 -13.769 -1.379 1.00 0.00 O ATOM 0 H GLU A 112 8.257 -13.046 0.819 1.00 0.00 H new ATOM 0 HA GLU A 112 9.283 -10.608 2.027 1.00 0.00 H new ATOM 0 HB2 GLU A 112 11.456 -11.611 0.939 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.762 -12.366 2.360 1.00 0.00 H new ATOM 0 HG2 GLU A 112 11.523 -14.040 0.714 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.801 -14.167 1.016 1.00 0.00 H new ATOM 1873 N TYR A 113 10.534 -9.623 -0.197 1.00 0.00 N ATOM 1874 CA TYR A 113 10.787 -8.617 -1.245 1.00 0.00 C ATOM 1875 C TYR A 113 11.337 -9.280 -2.530 1.00 0.00 C ATOM 1876 O TYR A 113 12.476 -9.040 -2.945 1.00 0.00 O ATOM 1877 CB TYR A 113 11.728 -7.485 -0.691 1.00 0.00 C ATOM 1878 CG TYR A 113 13.008 -7.974 0.034 1.00 0.00 C ATOM 1879 CD1 TYR A 113 12.966 -8.384 1.372 1.00 0.00 C ATOM 1880 CD2 TYR A 113 14.252 -8.037 -0.613 1.00 0.00 C ATOM 1881 CE1 TYR A 113 14.100 -8.837 2.029 1.00 0.00 C ATOM 1882 CE2 TYR A 113 15.388 -8.495 0.045 1.00 0.00 C ATOM 1883 CZ TYR A 113 15.306 -8.893 1.367 1.00 0.00 C ATOM 1884 OH TYR A 113 16.434 -9.359 2.025 1.00 0.00 O ATOM 0 H TYR A 113 11.319 -9.737 0.444 1.00 0.00 H new ATOM 0 HA TYR A 113 9.845 -8.146 -1.525 1.00 0.00 H new ATOM 0 HB2 TYR A 113 12.025 -6.845 -1.522 1.00 0.00 H new ATOM 0 HB3 TYR A 113 11.155 -6.866 -0.001 1.00 0.00 H new ATOM 0 HD1 TYR A 113 12.028 -8.347 1.905 1.00 0.00 H new ATOM 0 HD2 TYR A 113 14.328 -7.723 -1.644 1.00 0.00 H new ATOM 0 HE1 TYR A 113 14.037 -9.146 3.062 1.00 0.00 H new ATOM 0 HE2 TYR A 113 16.333 -8.540 -0.476 1.00 0.00 H new ATOM 0 HH TYR A 113 17.201 -9.335 1.416 1.00 0.00 H new ATOM 1894 N GLY A 114 10.509 -10.141 -3.145 1.00 0.00 N ATOM 1895 CA GLY A 114 10.853 -10.822 -4.406 1.00 0.00 C ATOM 1896 C GLY A 114 9.981 -10.337 -5.559 1.00 0.00 C ATOM 1897 O GLY A 114 8.877 -9.852 -5.322 1.00 0.00 O ATOM 0 H GLY A 114 9.586 -10.384 -2.785 1.00 0.00 H new ATOM 0 HA2 GLY A 114 11.902 -10.644 -4.642 1.00 0.00 H new ATOM 0 HA3 GLY A 114 10.732 -11.898 -4.284 1.00 0.00 H new ATOM 1901 N GLN A 115 10.464 -10.521 -6.806 1.00 0.00 N ATOM 1902 CA GLN A 115 9.817 -9.996 -8.041 1.00 0.00 C ATOM 1903 C GLN A 115 8.305 -10.334 -8.125 1.00 0.00 C ATOM 1904 O GLN A 115 7.475 -9.457 -8.375 1.00 0.00 O ATOM 1905 CB GLN A 115 10.547 -10.560 -9.296 1.00 0.00 C ATOM 1906 CG GLN A 115 9.988 -10.054 -10.654 1.00 0.00 C ATOM 1907 CD GLN A 115 10.630 -10.700 -11.885 1.00 0.00 C ATOM 1908 OE1 GLN A 115 11.041 -11.862 -11.860 1.00 0.00 O ATOM 1909 NE2 GLN A 115 10.728 -9.952 -12.978 1.00 0.00 N ATOM 0 H GLN A 115 11.321 -11.042 -6.992 1.00 0.00 H new ATOM 0 HA GLN A 115 9.900 -8.910 -8.005 1.00 0.00 H new ATOM 0 HB2 GLN A 115 11.603 -10.298 -9.233 1.00 0.00 H new ATOM 0 HB3 GLN A 115 10.486 -11.648 -9.276 1.00 0.00 H new ATOM 0 HG2 GLN A 115 8.914 -10.238 -10.681 1.00 0.00 H new ATOM 0 HG3 GLN A 115 10.128 -8.975 -10.711 1.00 0.00 H new ATOM 0 HE21 GLN A 115 10.380 -8.993 -12.973 1.00 0.00 H new ATOM 0 HE22 GLN A 115 11.151 -10.336 -13.823 1.00 0.00 H new ATOM 1918 N PHE A 116 7.973 -11.611 -7.886 1.00 0.00 N ATOM 1919 CA PHE A 116 6.597 -12.145 -8.034 1.00 0.00 C ATOM 1920 C PHE A 116 5.747 -11.867 -6.781 1.00 0.00 C ATOM 1921 O PHE A 116 4.508 -11.787 -6.853 1.00 0.00 O ATOM 1922 CB PHE A 116 6.660 -13.665 -8.315 1.00 0.00 C ATOM 1923 CG PHE A 116 7.508 -14.022 -9.531 1.00 0.00 C ATOM 1924 CD1 PHE A 116 6.983 -13.923 -10.819 1.00 0.00 C ATOM 1925 CD2 PHE A 116 8.837 -14.429 -9.389 1.00 0.00 C ATOM 1926 CE1 PHE A 116 7.755 -14.233 -11.922 1.00 0.00 C ATOM 1927 CE2 PHE A 116 9.606 -14.736 -10.494 1.00 0.00 C ATOM 1928 CZ PHE A 116 9.066 -14.634 -11.759 1.00 0.00 C ATOM 0 H PHE A 116 8.649 -12.312 -7.583 1.00 0.00 H new ATOM 0 HA PHE A 116 6.120 -11.638 -8.873 1.00 0.00 H new ATOM 0 HB2 PHE A 116 7.063 -14.172 -7.439 1.00 0.00 H new ATOM 0 HB3 PHE A 116 5.648 -14.042 -8.464 1.00 0.00 H new ATOM 0 HD1 PHE A 116 5.961 -13.600 -10.956 1.00 0.00 H new ATOM 0 HD2 PHE A 116 9.269 -14.504 -8.402 1.00 0.00 H new ATOM 0 HE1 PHE A 116 7.332 -14.162 -12.913 1.00 0.00 H new ATOM 0 HE2 PHE A 116 10.630 -15.056 -10.368 1.00 0.00 H new ATOM 0 HZ PHE A 116 9.670 -14.868 -12.623 1.00 0.00 H new ATOM 1938 N THR A 117 6.432 -11.716 -5.638 1.00 0.00 N ATOM 1939 CA THR A 117 5.803 -11.425 -4.345 1.00 0.00 C ATOM 1940 C THR A 117 5.727 -9.902 -4.092 1.00 0.00 C ATOM 1941 O THR A 117 5.387 -9.470 -2.981 1.00 0.00 O ATOM 1942 CB THR A 117 6.579 -12.146 -3.197 1.00 0.00 C ATOM 1943 OG1 THR A 117 7.977 -11.855 -3.298 1.00 0.00 O ATOM 1944 CG2 THR A 117 6.393 -13.673 -3.231 1.00 0.00 C ATOM 0 H THR A 117 7.448 -11.794 -5.587 1.00 0.00 H new ATOM 0 HA THR A 117 4.781 -11.804 -4.365 1.00 0.00 H new ATOM 0 HB THR A 117 6.171 -11.774 -2.257 1.00 0.00 H new ATOM 0 HG1 THR A 117 8.479 -12.452 -2.704 1.00 0.00 H new ATOM 0 HG21 THR A 117 6.953 -14.126 -2.413 1.00 0.00 H new ATOM 0 HG22 THR A 117 5.335 -13.913 -3.124 1.00 0.00 H new ATOM 0 HG23 THR A 117 6.759 -14.063 -4.181 1.00 0.00 H new ATOM 1952 N THR A 118 6.029 -9.091 -5.136 1.00 0.00 N ATOM 1953 CA THR A 118 5.899 -7.620 -5.104 1.00 0.00 C ATOM 1954 C THR A 118 5.260 -7.111 -6.412 1.00 0.00 C ATOM 1955 O THR A 118 5.332 -7.774 -7.453 1.00 0.00 O ATOM 1956 CB THR A 118 7.271 -6.892 -4.887 1.00 0.00 C ATOM 1957 OG1 THR A 118 8.188 -7.229 -5.940 1.00 0.00 O ATOM 1958 CG2 THR A 118 7.910 -7.232 -3.522 1.00 0.00 C ATOM 0 H THR A 118 6.372 -9.446 -6.029 1.00 0.00 H new ATOM 0 HA THR A 118 5.260 -7.385 -4.252 1.00 0.00 H new ATOM 0 HB THR A 118 7.065 -5.822 -4.901 1.00 0.00 H new ATOM 0 HG1 THR A 118 8.501 -8.150 -5.819 1.00 0.00 H new ATOM 0 HG21 THR A 118 8.858 -6.703 -3.422 1.00 0.00 H new ATOM 0 HG22 THR A 118 7.238 -6.928 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 118 8.086 -8.306 -3.460 1.00 0.00 H new ATOM 1966 N CYS A 119 4.613 -5.938 -6.327 1.00 0.00 N ATOM 1967 CA CYS A 119 4.040 -5.216 -7.473 1.00 0.00 C ATOM 1968 C CYS A 119 4.259 -3.703 -7.296 1.00 0.00 C ATOM 1969 O CYS A 119 4.267 -3.177 -6.171 1.00 0.00 O ATOM 1970 CB CYS A 119 2.530 -5.540 -7.648 1.00 0.00 C ATOM 1971 SG CYS A 119 2.204 -7.197 -8.296 1.00 0.00 S ATOM 0 H CYS A 119 4.471 -5.455 -5.440 1.00 0.00 H new ATOM 0 HA CYS A 119 4.549 -5.545 -8.379 1.00 0.00 H new ATOM 0 HB2 CYS A 119 2.032 -5.433 -6.684 1.00 0.00 H new ATOM 0 HB3 CYS A 119 2.086 -4.805 -8.319 1.00 0.00 H new ATOM 0 HG CYS A 119 3.281 -7.919 -8.203 1.00 0.00 H new ATOM 1977 N PHE A 120 4.458 -3.023 -8.429 1.00 0.00 N ATOM 1978 CA PHE A 120 4.643 -1.570 -8.493 1.00 0.00 C ATOM 1979 C PHE A 120 3.278 -0.876 -8.317 1.00 0.00 C ATOM 1980 O PHE A 120 2.320 -1.200 -9.035 1.00 0.00 O ATOM 1981 CB PHE A 120 5.270 -1.191 -9.858 1.00 0.00 C ATOM 1982 CG PHE A 120 6.609 -1.873 -10.152 1.00 0.00 C ATOM 1983 CD1 PHE A 120 7.792 -1.412 -9.570 1.00 0.00 C ATOM 1984 CD2 PHE A 120 6.691 -2.958 -11.030 1.00 0.00 C ATOM 1985 CE1 PHE A 120 9.005 -2.022 -9.843 1.00 0.00 C ATOM 1986 CE2 PHE A 120 7.906 -3.563 -11.303 1.00 0.00 C ATOM 1987 CZ PHE A 120 9.063 -3.090 -10.718 1.00 0.00 C ATOM 0 H PHE A 120 4.496 -3.474 -9.343 1.00 0.00 H new ATOM 0 HA PHE A 120 5.312 -1.244 -7.696 1.00 0.00 H new ATOM 0 HB2 PHE A 120 4.566 -1.445 -10.650 1.00 0.00 H new ATOM 0 HB3 PHE A 120 5.412 -0.111 -9.891 1.00 0.00 H new ATOM 0 HD1 PHE A 120 7.760 -0.568 -8.897 1.00 0.00 H new ATOM 0 HD2 PHE A 120 5.794 -3.330 -11.502 1.00 0.00 H new ATOM 0 HE1 PHE A 120 9.907 -1.662 -9.371 1.00 0.00 H new ATOM 0 HE2 PHE A 120 7.948 -4.407 -11.975 1.00 0.00 H new ATOM 0 HZ PHE A 120 10.012 -3.554 -10.944 1.00 0.00 H new ATOM 1997 N VAL A 121 3.183 0.043 -7.337 1.00 0.00 N ATOM 1998 CA VAL A 121 1.939 0.792 -7.031 1.00 0.00 C ATOM 1999 C VAL A 121 2.255 2.287 -6.823 1.00 0.00 C ATOM 2000 O VAL A 121 3.416 2.717 -6.900 1.00 0.00 O ATOM 2001 CB VAL A 121 1.199 0.227 -5.743 1.00 0.00 C ATOM 2002 CG1 VAL A 121 0.765 -1.256 -5.919 1.00 0.00 C ATOM 2003 CG2 VAL A 121 2.070 0.416 -4.471 1.00 0.00 C ATOM 0 H VAL A 121 3.966 0.291 -6.732 1.00 0.00 H new ATOM 0 HA VAL A 121 1.272 0.666 -7.884 1.00 0.00 H new ATOM 0 HB VAL A 121 0.286 0.809 -5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 121 0.264 -1.598 -5.014 1.00 0.00 H new ATOM 0 HG12 VAL A 121 0.082 -1.337 -6.765 1.00 0.00 H new ATOM 0 HG13 VAL A 121 1.645 -1.873 -6.102 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.539 0.021 -3.605 1.00 0.00 H new ATOM 0 HG22 VAL A 121 3.013 -0.117 -4.593 1.00 0.00 H new ATOM 0 HG23 VAL A 121 2.270 1.477 -4.321 1.00 0.00 H new ATOM 2013 N VAL A 122 1.198 3.074 -6.584 1.00 0.00 N ATOM 2014 CA VAL A 122 1.314 4.469 -6.130 1.00 0.00 C ATOM 2015 C VAL A 122 1.266 4.522 -4.589 1.00 0.00 C ATOM 2016 O VAL A 122 0.947 3.523 -3.935 1.00 0.00 O ATOM 2017 CB VAL A 122 0.190 5.378 -6.760 1.00 0.00 C ATOM 2018 CG1 VAL A 122 0.265 5.365 -8.307 1.00 0.00 C ATOM 2019 CG2 VAL A 122 -1.228 4.985 -6.262 1.00 0.00 C ATOM 0 H VAL A 122 0.234 2.761 -6.700 1.00 0.00 H new ATOM 0 HA VAL A 122 2.273 4.862 -6.469 1.00 0.00 H new ATOM 0 HB VAL A 122 0.374 6.397 -6.421 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -0.521 6.000 -8.715 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.237 5.740 -8.627 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.132 4.346 -8.669 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -1.969 5.638 -6.722 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -1.436 3.951 -6.535 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.275 5.090 -5.178 1.00 0.00 H new ATOM 2029 N ARG A 123 1.574 5.701 -4.027 1.00 0.00 N ATOM 2030 CA ARG A 123 1.566 5.929 -2.568 1.00 0.00 C ATOM 2031 C ARG A 123 0.180 5.676 -1.954 1.00 0.00 C ATOM 2032 O ARG A 123 0.104 5.176 -0.847 1.00 0.00 O ATOM 2033 CB ARG A 123 2.033 7.373 -2.226 1.00 0.00 C ATOM 2034 CG ARG A 123 3.556 7.559 -2.113 1.00 0.00 C ATOM 2035 CD ARG A 123 4.142 6.917 -0.840 1.00 0.00 C ATOM 2036 NE ARG A 123 5.578 7.210 -0.674 1.00 0.00 N ATOM 2037 CZ ARG A 123 6.087 8.348 -0.159 1.00 0.00 C ATOM 2038 NH1 ARG A 123 5.295 9.338 0.247 1.00 0.00 N ATOM 2039 NH2 ARG A 123 7.395 8.476 -0.032 1.00 0.00 N ATOM 0 H ARG A 123 1.836 6.525 -4.568 1.00 0.00 H new ATOM 0 HA ARG A 123 2.266 5.214 -2.135 1.00 0.00 H new ATOM 0 HB2 ARG A 123 1.656 8.051 -2.992 1.00 0.00 H new ATOM 0 HB3 ARG A 123 1.576 7.672 -1.283 1.00 0.00 H new ATOM 0 HG2 ARG A 123 4.037 7.123 -2.989 1.00 0.00 H new ATOM 0 HG3 ARG A 123 3.789 8.624 -2.118 1.00 0.00 H new ATOM 0 HD2 ARG A 123 3.597 7.280 0.031 1.00 0.00 H new ATOM 0 HD3 ARG A 123 3.996 5.838 -0.880 1.00 0.00 H new ATOM 0 HE ARG A 123 6.240 6.494 -0.973 1.00 0.00 H new ATOM 0 HH11 ARG A 123 4.282 9.244 0.172 1.00 0.00 H new ATOM 0 HH12 ARG A 123 5.701 10.190 0.634 1.00 0.00 H new ATOM 0 HH21 ARG A 123 8.012 7.718 -0.322 1.00 0.00 H new ATOM 0 HH22 ARG A 123 7.788 9.333 0.356 1.00 0.00 H new ATOM 2053 N LEU A 124 -0.897 6.020 -2.682 1.00 0.00 N ATOM 2054 CA LEU A 124 -2.278 5.879 -2.167 1.00 0.00 C ATOM 2055 C LEU A 124 -2.608 4.380 -1.924 1.00 0.00 C ATOM 2056 O LEU A 124 -3.099 4.016 -0.851 1.00 0.00 O ATOM 2057 CB LEU A 124 -3.316 6.543 -3.141 1.00 0.00 C ATOM 2058 CG LEU A 124 -4.551 7.250 -2.475 1.00 0.00 C ATOM 2059 CD1 LEU A 124 -5.379 6.296 -1.608 1.00 0.00 C ATOM 2060 CD2 LEU A 124 -4.100 8.476 -1.661 1.00 0.00 C ATOM 0 H LEU A 124 -0.842 6.398 -3.628 1.00 0.00 H new ATOM 0 HA LEU A 124 -2.348 6.403 -1.214 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -2.790 7.278 -3.750 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -3.688 5.774 -3.819 1.00 0.00 H new ATOM 0 HG LEU A 124 -5.201 7.583 -3.284 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -6.219 6.837 -1.172 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -5.754 5.478 -2.223 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -4.754 5.894 -0.811 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -4.970 8.952 -1.208 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -3.410 8.160 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -3.600 9.186 -2.320 1.00 0.00 H new ATOM 2072 N GLN A 125 -2.299 3.528 -2.928 1.00 0.00 N ATOM 2073 CA GLN A 125 -2.513 2.062 -2.839 1.00 0.00 C ATOM 2074 C GLN A 125 -1.595 1.446 -1.770 1.00 0.00 C ATOM 2075 O GLN A 125 -2.009 0.535 -1.044 1.00 0.00 O ATOM 2076 CB GLN A 125 -2.250 1.380 -4.203 1.00 0.00 C ATOM 2077 CG GLN A 125 -3.139 1.873 -5.351 1.00 0.00 C ATOM 2078 CD GLN A 125 -2.783 1.211 -6.682 1.00 0.00 C ATOM 2079 OE1 GLN A 125 -1.911 1.688 -7.405 1.00 0.00 O ATOM 2080 NE2 GLN A 125 -3.456 0.118 -7.019 1.00 0.00 N ATOM 0 H GLN A 125 -1.898 3.832 -3.815 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.553 1.895 -2.558 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -1.207 1.537 -4.477 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -2.391 0.305 -4.089 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -4.183 1.669 -5.113 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -3.040 2.954 -5.447 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -4.174 -0.252 -6.395 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -3.256 -0.353 -7.902 1.00 0.00 H new ATOM 2089 N PHE A 126 -0.350 1.968 -1.694 1.00 0.00 N ATOM 2090 CA PHE A 126 0.640 1.548 -0.690 1.00 0.00 C ATOM 2091 C PHE A 126 0.080 1.742 0.723 1.00 0.00 C ATOM 2092 O PHE A 126 -0.078 0.774 1.444 1.00 0.00 O ATOM 2093 CB PHE A 126 1.970 2.330 -0.854 1.00 0.00 C ATOM 2094 CG PHE A 126 3.013 2.038 0.232 1.00 0.00 C ATOM 2095 CD1 PHE A 126 3.701 0.826 0.252 1.00 0.00 C ATOM 2096 CD2 PHE A 126 3.317 2.980 1.224 1.00 0.00 C ATOM 2097 CE1 PHE A 126 4.644 0.557 1.228 1.00 0.00 C ATOM 2098 CE2 PHE A 126 4.261 2.708 2.202 1.00 0.00 C ATOM 2099 CZ PHE A 126 4.930 1.500 2.198 1.00 0.00 C ATOM 0 H PHE A 126 -0.009 2.691 -2.328 1.00 0.00 H new ATOM 0 HA PHE A 126 0.849 0.490 -0.845 1.00 0.00 H new ATOM 0 HB2 PHE A 126 2.400 2.092 -1.827 1.00 0.00 H new ATOM 0 HB3 PHE A 126 1.752 3.398 -0.854 1.00 0.00 H new ATOM 0 HD1 PHE A 126 3.495 0.085 -0.506 1.00 0.00 H new ATOM 0 HD2 PHE A 126 2.808 3.933 1.227 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.158 -0.393 1.232 1.00 0.00 H new ATOM 0 HE2 PHE A 126 4.473 3.441 2.967 1.00 0.00 H new ATOM 0 HZ PHE A 126 5.675 1.292 2.951 1.00 0.00 H new ATOM 2109 N TYR A 127 -0.261 3.007 1.058 1.00 0.00 N ATOM 2110 CA TYR A 127 -0.770 3.406 2.385 1.00 0.00 C ATOM 2111 C TYR A 127 -2.001 2.577 2.757 1.00 0.00 C ATOM 2112 O TYR A 127 -2.057 2.015 3.835 1.00 0.00 O ATOM 2113 CB TYR A 127 -1.131 4.923 2.431 1.00 0.00 C ATOM 2114 CG TYR A 127 0.057 5.882 2.287 1.00 0.00 C ATOM 2115 CD1 TYR A 127 1.270 5.624 2.928 1.00 0.00 C ATOM 2116 CD2 TYR A 127 -0.045 7.064 1.544 1.00 0.00 C ATOM 2117 CE1 TYR A 127 2.334 6.493 2.822 1.00 0.00 C ATOM 2118 CE2 TYR A 127 1.025 7.932 1.431 1.00 0.00 C ATOM 2119 CZ TYR A 127 2.205 7.647 2.081 1.00 0.00 C ATOM 2120 OH TYR A 127 3.266 8.517 1.978 1.00 0.00 O ATOM 0 H TYR A 127 -0.189 3.787 0.405 1.00 0.00 H new ATOM 0 HA TYR A 127 0.026 3.221 3.106 1.00 0.00 H new ATOM 0 HB2 TYR A 127 -1.846 5.134 1.636 1.00 0.00 H new ATOM 0 HB3 TYR A 127 -1.634 5.132 3.375 1.00 0.00 H new ATOM 0 HD1 TYR A 127 1.376 4.726 3.518 1.00 0.00 H new ATOM 0 HD2 TYR A 127 -0.976 7.302 1.051 1.00 0.00 H new ATOM 0 HE1 TYR A 127 3.267 6.270 3.319 1.00 0.00 H new ATOM 0 HE2 TYR A 127 0.936 8.829 0.836 1.00 0.00 H new ATOM 0 HH TYR A 127 4.086 8.070 2.275 1.00 0.00 H new ATOM 2130 N ALA A 128 -2.945 2.467 1.817 1.00 0.00 N ATOM 2131 CA ALA A 128 -4.216 1.742 2.011 1.00 0.00 C ATOM 2132 C ALA A 128 -3.986 0.311 2.569 1.00 0.00 C ATOM 2133 O ALA A 128 -4.393 -0.010 3.710 1.00 0.00 O ATOM 2134 CB ALA A 128 -4.971 1.710 0.674 1.00 0.00 C ATOM 0 H ALA A 128 -2.853 2.881 0.889 1.00 0.00 H new ATOM 0 HA ALA A 128 -4.816 2.265 2.756 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -5.913 1.177 0.801 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.172 2.730 0.345 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.364 1.201 -0.074 1.00 0.00 H new ATOM 2140 N PHE A 129 -3.258 -0.510 1.788 1.00 0.00 N ATOM 2141 CA PHE A 129 -2.924 -1.894 2.169 1.00 0.00 C ATOM 2142 C PHE A 129 -1.964 -1.935 3.379 1.00 0.00 C ATOM 2143 O PHE A 129 -2.090 -2.811 4.218 1.00 0.00 O ATOM 2144 CB PHE A 129 -2.299 -2.679 0.978 1.00 0.00 C ATOM 2145 CG PHE A 129 -3.277 -3.017 -0.145 1.00 0.00 C ATOM 2146 CD1 PHE A 129 -4.240 -4.010 0.035 1.00 0.00 C ATOM 2147 CD2 PHE A 129 -3.224 -2.366 -1.378 1.00 0.00 C ATOM 2148 CE1 PHE A 129 -5.128 -4.326 -0.977 1.00 0.00 C ATOM 2149 CE2 PHE A 129 -4.110 -2.684 -2.388 1.00 0.00 C ATOM 2150 CZ PHE A 129 -5.059 -3.669 -2.190 1.00 0.00 C ATOM 0 H PHE A 129 -2.887 -0.233 0.879 1.00 0.00 H new ATOM 0 HA PHE A 129 -3.861 -2.375 2.452 1.00 0.00 H new ATOM 0 HB2 PHE A 129 -1.479 -2.092 0.564 1.00 0.00 H new ATOM 0 HB3 PHE A 129 -1.868 -3.605 1.357 1.00 0.00 H new ATOM 0 HD1 PHE A 129 -4.293 -4.538 0.976 1.00 0.00 H new ATOM 0 HD2 PHE A 129 -2.479 -1.602 -1.545 1.00 0.00 H new ATOM 0 HE1 PHE A 129 -5.877 -5.088 -0.819 1.00 0.00 H new ATOM 0 HE2 PHE A 129 -4.061 -2.163 -3.333 1.00 0.00 H new ATOM 0 HZ PHE A 129 -5.746 -3.925 -2.983 1.00 0.00 H new ATOM 2160 N GLU A 130 -1.036 -0.964 3.473 1.00 0.00 N ATOM 2161 CA GLU A 130 0.078 -1.014 4.446 1.00 0.00 C ATOM 2162 C GLU A 130 -0.411 -0.745 5.882 1.00 0.00 C ATOM 2163 O GLU A 130 -0.068 -1.480 6.808 1.00 0.00 O ATOM 2164 CB GLU A 130 1.205 -0.010 4.077 1.00 0.00 C ATOM 2165 CG GLU A 130 2.537 -0.287 4.789 1.00 0.00 C ATOM 2166 CD GLU A 130 3.148 -1.649 4.392 1.00 0.00 C ATOM 2167 OE1 GLU A 130 2.786 -2.695 4.994 1.00 0.00 O ATOM 2168 OE2 GLU A 130 3.990 -1.694 3.470 1.00 0.00 O ATOM 0 H GLU A 130 -1.034 -0.131 2.885 1.00 0.00 H new ATOM 0 HA GLU A 130 0.486 -2.024 4.402 1.00 0.00 H new ATOM 0 HB2 GLU A 130 1.366 -0.039 2.999 1.00 0.00 H new ATOM 0 HB3 GLU A 130 0.875 0.999 4.323 1.00 0.00 H new ATOM 0 HG2 GLU A 130 3.244 0.508 4.552 1.00 0.00 H new ATOM 0 HG3 GLU A 130 2.381 -0.263 5.867 1.00 0.00 H new ATOM 2175 N ILE A 131 -1.204 0.331 6.040 1.00 0.00 N ATOM 2176 CA ILE A 131 -1.855 0.700 7.317 1.00 0.00 C ATOM 2177 C ILE A 131 -2.754 -0.460 7.788 1.00 0.00 C ATOM 2178 O ILE A 131 -2.783 -0.802 8.973 1.00 0.00 O ATOM 2179 CB ILE A 131 -2.728 2.010 7.167 1.00 0.00 C ATOM 2180 CG1 ILE A 131 -1.876 3.196 6.612 1.00 0.00 C ATOM 2181 CG2 ILE A 131 -3.398 2.405 8.509 1.00 0.00 C ATOM 2182 CD1 ILE A 131 -2.686 4.351 6.037 1.00 0.00 C ATOM 0 H ILE A 131 -1.415 0.977 5.279 1.00 0.00 H new ATOM 0 HA ILE A 131 -1.073 0.895 8.050 1.00 0.00 H new ATOM 0 HB ILE A 131 -3.518 1.790 6.449 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -1.244 3.578 7.414 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -1.211 2.816 5.837 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -3.990 3.309 8.368 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -4.047 1.596 8.844 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -2.629 2.588 9.260 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -2.009 5.126 5.677 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -3.298 3.990 5.210 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -3.331 4.764 6.812 1.00 0.00 H new ATOM 2194 N ALA A 132 -3.471 -1.064 6.816 1.00 0.00 N ATOM 2195 CA ALA A 132 -4.332 -2.234 7.050 1.00 0.00 C ATOM 2196 C ALA A 132 -3.542 -3.417 7.650 1.00 0.00 C ATOM 2197 O ALA A 132 -3.875 -3.922 8.721 1.00 0.00 O ATOM 2198 CB ALA A 132 -5.009 -2.630 5.736 1.00 0.00 C ATOM 0 H ALA A 132 -3.466 -0.750 5.846 1.00 0.00 H new ATOM 0 HA ALA A 132 -5.094 -1.966 7.782 1.00 0.00 H new ATOM 0 HB1 ALA A 132 -5.649 -3.497 5.903 1.00 0.00 H new ATOM 0 HB2 ALA A 132 -5.613 -1.798 5.373 1.00 0.00 H new ATOM 0 HB3 ALA A 132 -4.249 -2.877 4.995 1.00 0.00 H new ATOM 2204 N ARG A 133 -2.480 -3.809 6.941 1.00 0.00 N ATOM 2205 CA ARG A 133 -1.574 -4.919 7.315 1.00 0.00 C ATOM 2206 C ARG A 133 -0.868 -4.660 8.650 1.00 0.00 C ATOM 2207 O ARG A 133 -0.580 -5.594 9.393 1.00 0.00 O ATOM 2208 CB ARG A 133 -0.522 -5.113 6.197 1.00 0.00 C ATOM 2209 CG ARG A 133 -1.099 -5.644 4.873 1.00 0.00 C ATOM 2210 CD ARG A 133 -0.116 -5.517 3.694 1.00 0.00 C ATOM 2211 NE ARG A 133 -0.614 -6.199 2.489 1.00 0.00 N ATOM 2212 CZ ARG A 133 -0.026 -6.173 1.283 1.00 0.00 C ATOM 2213 NH1 ARG A 133 1.032 -5.406 1.055 1.00 0.00 N ATOM 2214 NH2 ARG A 133 -0.517 -6.912 0.309 1.00 0.00 N ATOM 0 H ARG A 133 -2.212 -3.357 6.067 1.00 0.00 H new ATOM 0 HA ARG A 133 -2.175 -5.821 7.433 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -0.028 -4.160 6.009 1.00 0.00 H new ATOM 0 HB3 ARG A 133 0.243 -5.804 6.550 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -1.375 -6.691 4.997 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -2.013 -5.099 4.637 1.00 0.00 H new ATOM 0 HD2 ARG A 133 0.050 -4.463 3.472 1.00 0.00 H new ATOM 0 HD3 ARG A 133 0.848 -5.939 3.978 1.00 0.00 H new ATOM 0 HE ARG A 133 -1.477 -6.736 2.578 1.00 0.00 H new ATOM 0 HH11 ARG A 133 1.411 -4.824 1.802 1.00 0.00 H new ATOM 0 HH12 ARG A 133 1.467 -5.398 0.132 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -1.336 -7.496 0.475 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -0.078 -6.900 -0.612 1.00 0.00 H new ATOM 2228 N ASN A 134 -0.589 -3.384 8.924 1.00 0.00 N ATOM 2229 CA ASN A 134 0.087 -2.944 10.161 1.00 0.00 C ATOM 2230 C ASN A 134 -0.823 -3.173 11.390 1.00 0.00 C ATOM 2231 O ASN A 134 -0.390 -3.748 12.398 1.00 0.00 O ATOM 2232 CB ASN A 134 0.498 -1.446 10.046 1.00 0.00 C ATOM 2233 CG ASN A 134 1.296 -0.919 11.245 1.00 0.00 C ATOM 2234 OD1 ASN A 134 2.002 -1.670 11.918 1.00 0.00 O ATOM 2235 ND2 ASN A 134 1.209 0.385 11.506 1.00 0.00 N ATOM 0 H ASN A 134 -0.824 -2.617 8.294 1.00 0.00 H new ATOM 0 HA ASN A 134 0.990 -3.539 10.296 1.00 0.00 H new ATOM 0 HB2 ASN A 134 1.092 -1.312 9.142 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -0.402 -0.842 9.929 1.00 0.00 H new ATOM 0 HD21 ASN A 134 1.736 0.786 12.282 1.00 0.00 H new ATOM 0 HD22 ASN A 134 0.615 0.982 10.930 1.00 0.00 H new ATOM 2242 N LYS A 135 -2.100 -2.739 11.275 1.00 0.00 N ATOM 2243 CA LYS A 135 -3.116 -2.903 12.346 1.00 0.00 C ATOM 2244 C LYS A 135 -3.477 -4.385 12.540 1.00 0.00 C ATOM 2245 O LYS A 135 -3.701 -4.846 13.662 1.00 0.00 O ATOM 2246 CB LYS A 135 -4.400 -2.092 12.024 1.00 0.00 C ATOM 2247 CG LYS A 135 -4.173 -0.574 11.887 1.00 0.00 C ATOM 2248 CD LYS A 135 -5.496 0.217 11.827 1.00 0.00 C ATOM 2249 CE LYS A 135 -5.271 1.722 11.644 1.00 0.00 C ATOM 2250 NZ LYS A 135 -6.527 2.494 11.791 1.00 0.00 N ATOM 0 H LYS A 135 -2.455 -2.268 10.443 1.00 0.00 H new ATOM 0 HA LYS A 135 -2.681 -2.522 13.270 1.00 0.00 H new ATOM 0 HB2 LYS A 135 -4.830 -2.468 11.096 1.00 0.00 H new ATOM 0 HB3 LYS A 135 -5.134 -2.268 12.810 1.00 0.00 H new ATOM 0 HG2 LYS A 135 -3.580 -0.221 12.731 1.00 0.00 H new ATOM 0 HG3 LYS A 135 -3.594 -0.376 10.985 1.00 0.00 H new ATOM 0 HD2 LYS A 135 -6.104 -0.159 11.004 1.00 0.00 H new ATOM 0 HD3 LYS A 135 -6.060 0.046 12.744 1.00 0.00 H new ATOM 0 HE2 LYS A 135 -4.543 2.071 12.376 1.00 0.00 H new ATOM 0 HE3 LYS A 135 -4.845 1.907 10.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 -6.794 2.901 10.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 -7.285 1.864 12.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 -6.385 3.259 12.481 1.00 0.00 H new ATOM 2264 N HIS A 136 -3.536 -5.112 11.414 1.00 0.00 N ATOM 2265 CA HIS A 136 -3.830 -6.559 11.388 1.00 0.00 C ATOM 2266 C HIS A 136 -2.594 -7.403 11.799 1.00 0.00 C ATOM 2267 O HIS A 136 -2.725 -8.608 12.041 1.00 0.00 O ATOM 2268 CB HIS A 136 -4.351 -6.976 9.981 1.00 0.00 C ATOM 2269 CG HIS A 136 -5.809 -6.675 9.708 1.00 0.00 C ATOM 2270 ND1 HIS A 136 -6.263 -5.452 9.262 1.00 0.00 N ATOM 2271 CD2 HIS A 136 -6.912 -7.455 9.832 1.00 0.00 C ATOM 2272 CE1 HIS A 136 -7.575 -5.500 9.108 1.00 0.00 C ATOM 2273 NE2 HIS A 136 -7.992 -6.701 9.448 1.00 0.00 N ATOM 0 H HIS A 136 -3.381 -4.713 10.488 1.00 0.00 H new ATOM 0 HA HIS A 136 -4.611 -6.758 12.122 1.00 0.00 H new ATOM 0 HB2 HIS A 136 -3.747 -6.473 9.226 1.00 0.00 H new ATOM 0 HB3 HIS A 136 -4.190 -8.047 9.856 1.00 0.00 H new ATOM 0 HD1 HIS A 136 -5.678 -4.637 9.079 1.00 0.00 H new ATOM 0 HD2 HIS A 136 -6.936 -8.480 10.171 1.00 0.00 H new ATOM 0 HE1 HIS A 136 -8.200 -4.690 8.761 1.00 0.00 H new ATOM 2282 N GLY A 137 -1.402 -6.763 11.858 1.00 0.00 N ATOM 2283 CA GLY A 137 -0.153 -7.430 12.286 1.00 0.00 C ATOM 2284 C GLY A 137 0.334 -8.498 11.303 1.00 0.00 C ATOM 2285 O GLY A 137 1.024 -9.446 11.684 1.00 0.00 O ATOM 0 H GLY A 137 -1.281 -5.780 11.613 1.00 0.00 H new ATOM 0 HA2 GLY A 137 0.627 -6.679 12.411 1.00 0.00 H new ATOM 0 HA3 GLY A 137 -0.311 -7.890 13.261 1.00 0.00 H new ATOM 2289 N LEU A 138 -0.030 -8.334 10.023 1.00 0.00 N ATOM 2290 CA LEU A 138 0.322 -9.282 8.943 1.00 0.00 C ATOM 2291 C LEU A 138 1.752 -9.026 8.422 1.00 0.00 C ATOM 2292 O LEU A 138 2.326 -9.855 7.711 1.00 0.00 O ATOM 2293 CB LEU A 138 -0.732 -9.169 7.813 1.00 0.00 C ATOM 2294 CG LEU A 138 -2.211 -9.329 8.282 1.00 0.00 C ATOM 2295 CD1 LEU A 138 -3.201 -9.137 7.129 1.00 0.00 C ATOM 2296 CD2 LEU A 138 -2.445 -10.677 9.007 1.00 0.00 C ATOM 0 H LEU A 138 -0.580 -7.538 9.701 1.00 0.00 H new ATOM 0 HA LEU A 138 0.312 -10.300 9.333 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -0.622 -8.199 7.328 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -0.520 -9.928 7.060 1.00 0.00 H new ATOM 0 HG LEU A 138 -2.397 -8.535 9.005 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -4.219 -9.257 7.500 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -3.083 -8.138 6.710 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -3.007 -9.880 6.355 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -3.488 -10.747 9.317 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -2.211 -11.499 8.331 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -1.801 -10.735 9.885 1.00 0.00 H new ATOM 2308 N ASN A 139 2.305 -7.854 8.788 1.00 0.00 N ATOM 2309 CA ASN A 139 3.717 -7.483 8.550 1.00 0.00 C ATOM 2310 C ASN A 139 4.493 -7.416 9.883 1.00 0.00 C ATOM 2311 O ASN A 139 5.491 -6.701 10.003 1.00 0.00 O ATOM 2312 CB ASN A 139 3.803 -6.137 7.768 1.00 0.00 C ATOM 2313 CG ASN A 139 3.558 -6.310 6.268 1.00 0.00 C ATOM 2314 OD1 ASN A 139 2.437 -6.221 5.785 1.00 0.00 O ATOM 2315 ND2 ASN A 139 4.616 -6.586 5.522 1.00 0.00 N ATOM 0 H ASN A 139 1.776 -7.125 9.266 1.00 0.00 H new ATOM 0 HA ASN A 139 4.183 -8.254 7.936 1.00 0.00 H new ATOM 0 HB2 ASN A 139 3.071 -5.438 8.173 1.00 0.00 H new ATOM 0 HB3 ASN A 139 4.787 -5.694 7.923 1.00 0.00 H new ATOM 0 HD21 ASN A 139 4.508 -6.730 4.518 1.00 0.00 H new ATOM 0 HD22 ASN A 139 5.539 -6.654 5.951 1.00 0.00 H new ATOM 2322 N ASP A 140 4.055 -8.220 10.865 1.00 0.00 N ATOM 2323 CA ASP A 140 4.719 -8.320 12.182 1.00 0.00 C ATOM 2324 C ASP A 140 6.074 -9.052 12.063 1.00 0.00 C ATOM 2325 O ASP A 140 7.051 -8.681 12.712 1.00 0.00 O ATOM 2326 CB ASP A 140 3.782 -9.050 13.178 1.00 0.00 C ATOM 2327 CG ASP A 140 4.350 -9.144 14.605 1.00 0.00 C ATOM 2328 OD1 ASP A 140 4.354 -8.118 15.317 1.00 0.00 O ATOM 2329 OD2 ASP A 140 4.809 -10.235 15.012 1.00 0.00 O ATOM 0 H ASP A 140 3.234 -8.818 10.773 1.00 0.00 H new ATOM 0 HA ASP A 140 4.921 -7.316 12.555 1.00 0.00 H new ATOM 0 HB2 ASP A 140 2.825 -8.530 13.211 1.00 0.00 H new ATOM 0 HB3 ASP A 140 3.585 -10.056 12.808 1.00 0.00 H new ATOM 2334 N TRP A 141 6.115 -10.063 11.180 1.00 0.00 N ATOM 2335 CA TRP A 141 7.279 -10.970 11.001 1.00 0.00 C ATOM 2336 C TRP A 141 8.585 -10.246 10.590 1.00 0.00 C ATOM 2337 O TRP A 141 9.669 -10.810 10.783 1.00 0.00 O ATOM 2338 CB TRP A 141 6.935 -12.077 9.971 1.00 0.00 C ATOM 2339 CG TRP A 141 6.588 -11.549 8.597 1.00 0.00 C ATOM 2340 CD1 TRP A 141 5.408 -10.978 8.223 1.00 0.00 C ATOM 2341 CD2 TRP A 141 7.427 -11.539 7.434 1.00 0.00 C ATOM 2342 NE1 TRP A 141 5.474 -10.591 6.916 1.00 0.00 N ATOM 2343 CE2 TRP A 141 6.693 -10.944 6.405 1.00 0.00 C ATOM 2344 CE3 TRP A 141 8.728 -11.983 7.167 1.00 0.00 C ATOM 2345 CZ2 TRP A 141 7.210 -10.757 5.133 1.00 0.00 C ATOM 2346 CZ3 TRP A 141 9.239 -11.810 5.898 1.00 0.00 C ATOM 2347 CH2 TRP A 141 8.478 -11.206 4.892 1.00 0.00 C ATOM 0 H TRP A 141 5.336 -10.283 10.559 1.00 0.00 H new ATOM 0 HA TRP A 141 7.474 -11.410 11.979 1.00 0.00 H new ATOM 0 HB2 TRP A 141 7.783 -12.756 9.885 1.00 0.00 H new ATOM 0 HB3 TRP A 141 6.096 -12.662 10.347 1.00 0.00 H new ATOM 0 HD1 TRP A 141 4.549 -10.851 8.865 1.00 0.00 H new ATOM 0 HE1 TRP A 141 4.733 -10.115 6.402 1.00 0.00 H new ATOM 0 HE3 TRP A 141 9.319 -12.452 7.940 1.00 0.00 H new ATOM 0 HZ2 TRP A 141 6.631 -10.274 4.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 141 10.242 -12.146 5.678 1.00 0.00 H new ATOM 0 HH2 TRP A 141 8.901 -11.092 3.905 1.00 0.00 H new ATOM 2358 N ILE A 142 8.495 -9.011 10.028 1.00 0.00 N ATOM 2359 CA ILE A 142 9.704 -8.242 9.631 1.00 0.00 C ATOM 2360 C ILE A 142 10.501 -7.834 10.893 1.00 0.00 C ATOM 2361 O ILE A 142 11.733 -7.859 10.887 1.00 0.00 O ATOM 2362 CB ILE A 142 9.417 -6.970 8.719 1.00 0.00 C ATOM 2363 CG1 ILE A 142 8.709 -7.338 7.367 1.00 0.00 C ATOM 2364 CG2 ILE A 142 10.723 -6.193 8.408 1.00 0.00 C ATOM 2365 CD1 ILE A 142 7.247 -7.665 7.474 1.00 0.00 C ATOM 0 H ILE A 142 7.613 -8.534 9.842 1.00 0.00 H new ATOM 0 HA ILE A 142 10.292 -8.913 9.005 1.00 0.00 H new ATOM 0 HB ILE A 142 8.741 -6.340 9.297 1.00 0.00 H new ATOM 0 HG12 ILE A 142 8.828 -6.504 6.675 1.00 0.00 H new ATOM 0 HG13 ILE A 142 9.224 -8.192 6.928 1.00 0.00 H new ATOM 0 HG21 ILE A 142 10.493 -5.330 7.783 1.00 0.00 H new ATOM 0 HG22 ILE A 142 11.176 -5.856 9.340 1.00 0.00 H new ATOM 0 HG23 ILE A 142 11.419 -6.847 7.882 1.00 0.00 H new ATOM 0 HD11 ILE A 142 6.854 -7.905 6.486 1.00 0.00 H new ATOM 0 HD12 ILE A 142 7.113 -8.521 8.135 1.00 0.00 H new ATOM 0 HD13 ILE A 142 6.711 -6.807 7.879 1.00 0.00 H new ATOM 2377 N VAL A 143 9.792 -7.523 11.997 1.00 0.00 N ATOM 2378 CA VAL A 143 10.436 -7.188 13.290 1.00 0.00 C ATOM 2379 C VAL A 143 11.070 -8.454 13.926 1.00 0.00 C ATOM 2380 O VAL A 143 11.898 -8.359 14.843 1.00 0.00 O ATOM 2381 CB VAL A 143 9.437 -6.477 14.299 1.00 0.00 C ATOM 2382 CG1 VAL A 143 8.496 -5.498 13.551 1.00 0.00 C ATOM 2383 CG2 VAL A 143 8.627 -7.477 15.165 1.00 0.00 C ATOM 0 H VAL A 143 8.773 -7.496 12.022 1.00 0.00 H new ATOM 0 HA VAL A 143 11.228 -6.470 13.080 1.00 0.00 H new ATOM 0 HB VAL A 143 10.056 -5.907 14.992 1.00 0.00 H new ATOM 0 HG11 VAL A 143 7.822 -5.024 14.265 1.00 0.00 H new ATOM 0 HG12 VAL A 143 9.090 -4.733 13.050 1.00 0.00 H new ATOM 0 HG13 VAL A 143 7.913 -6.047 12.811 1.00 0.00 H new ATOM 0 HG21 VAL A 143 7.964 -6.926 15.832 1.00 0.00 H new ATOM 0 HG22 VAL A 143 8.035 -8.123 14.517 1.00 0.00 H new ATOM 0 HG23 VAL A 143 9.312 -8.085 15.755 1.00 0.00 H new ATOM 2393 N GLY A 144 10.657 -9.639 13.417 1.00 0.00 N ATOM 2394 CA GLY A 144 11.192 -10.932 13.850 1.00 0.00 C ATOM 2395 C GLY A 144 12.234 -11.506 12.894 1.00 0.00 C ATOM 2396 O GLY A 144 12.658 -12.653 13.065 1.00 0.00 O ATOM 0 H GLY A 144 9.942 -9.715 12.694 1.00 0.00 H new ATOM 0 HA2 GLY A 144 11.638 -10.820 14.838 1.00 0.00 H new ATOM 0 HA3 GLY A 144 10.371 -11.642 13.950 1.00 0.00 H new ATOM 2400 N GLN A 145 12.636 -10.723 11.867 1.00 0.00 N ATOM 2401 CA GLN A 145 13.695 -11.126 10.903 1.00 0.00 C ATOM 2402 C GLN A 145 15.106 -10.938 11.510 1.00 0.00 C ATOM 2403 O GLN A 145 15.252 -10.589 12.682 1.00 0.00 O ATOM 2404 CB GLN A 145 13.558 -10.322 9.574 1.00 0.00 C ATOM 2405 CG GLN A 145 12.296 -10.636 8.748 1.00 0.00 C ATOM 2406 CD GLN A 145 12.251 -12.062 8.197 1.00 0.00 C ATOM 2407 OE1 GLN A 145 11.721 -12.974 8.830 1.00 0.00 O ATOM 2408 NE2 GLN A 145 12.811 -12.259 7.008 1.00 0.00 N ATOM 0 H GLN A 145 12.242 -9.801 11.681 1.00 0.00 H new ATOM 0 HA GLN A 145 13.564 -12.186 10.684 1.00 0.00 H new ATOM 0 HB2 GLN A 145 13.564 -9.258 9.809 1.00 0.00 H new ATOM 0 HB3 GLN A 145 14.435 -10.517 8.957 1.00 0.00 H new ATOM 0 HG2 GLN A 145 11.417 -10.470 9.370 1.00 0.00 H new ATOM 0 HG3 GLN A 145 12.235 -9.934 7.916 1.00 0.00 H new ATOM 0 HE21 GLN A 145 13.241 -11.479 6.511 1.00 0.00 H new ATOM 0 HE22 GLN A 145 12.810 -13.190 6.592 1.00 0.00 H new ATOM 2417 N LYS A 146 16.135 -11.198 10.686 1.00 0.00 N ATOM 2418 CA LYS A 146 17.550 -11.088 11.083 1.00 0.00 C ATOM 2419 C LYS A 146 18.410 -10.828 9.819 1.00 0.00 C ATOM 2420 O LYS A 146 18.274 -11.581 8.830 1.00 0.00 O ATOM 2421 CB LYS A 146 18.034 -12.355 11.890 1.00 0.00 C ATOM 2422 CG LYS A 146 18.070 -13.705 11.126 1.00 0.00 C ATOM 2423 CD LYS A 146 16.674 -14.248 10.725 1.00 0.00 C ATOM 2424 CE LYS A 146 16.770 -15.365 9.675 1.00 0.00 C ATOM 2425 NZ LYS A 146 17.403 -14.881 8.418 1.00 0.00 N ATOM 2426 OXT LYS A 146 19.208 -9.867 9.807 1.00 0.00 O ATOM 0 H LYS A 146 16.008 -11.493 9.718 1.00 0.00 H new ATOM 0 HA LYS A 146 17.667 -10.245 11.764 1.00 0.00 H new ATOM 0 HB2 LYS A 146 19.036 -12.153 12.269 1.00 0.00 H new ATOM 0 HB3 LYS A 146 17.384 -12.473 12.757 1.00 0.00 H new ATOM 0 HG2 LYS A 146 18.672 -13.584 10.226 1.00 0.00 H new ATOM 0 HG3 LYS A 146 18.571 -14.447 11.747 1.00 0.00 H new ATOM 0 HD2 LYS A 146 16.164 -14.626 11.611 1.00 0.00 H new ATOM 0 HD3 LYS A 146 16.067 -13.432 10.332 1.00 0.00 H new ATOM 0 HE2 LYS A 146 17.349 -16.196 10.078 1.00 0.00 H new ATOM 0 HE3 LYS A 146 15.773 -15.747 9.457 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 17.142 -15.511 7.633 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 17.073 -13.917 8.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 18.437 -14.876 8.529 1.00 0.00 H new