USER MOD reduce.3.24.130724 H: found=0, std=0, add=419, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 421 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 134 SER OG : rot 147:sc= 0.13 USER MOD Set 1.2: B 137 THR OG1 : rot -170:sc= -2.12! USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 103 TYR OH : rot -165:sc= 0.366 USER MOD Single : B 107 THR OG1 : rot 180:sc= -0.0132 USER MOD Single : B 112 SER OG : rot 180:sc= 0 USER MOD Single : B 114 HIS : no HD1:sc= -0.954 K(o=-0.95,f=-3.3) USER MOD Single : B 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 124 SER OG : rot 180:sc= 0 USER MOD Single : B 136 THR OG1 : rot 180:sc= 0 USER MOD Single : B 140 THR OG1 : rot 180:sc= -1.54! USER MOD Single : B 142 TYR OH : rot 180:sc= 0 USER MOD Single : B 145 SER OG : rot -115:sc= 0.104 USER MOD Single : B 146 ASN : amide:sc= -2.11 K(o=-2.1,f=-10!) USER MOD Single : B 147 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 69 N LEU A 95 -11.640 -2.107 -21.986 1.00 0.00 N ATOM 70 CA LEU A 95 -10.948 -2.232 -20.668 1.00 0.00 C ATOM 71 C LEU A 95 -9.442 -2.410 -20.889 1.00 0.00 C ATOM 72 O LEU A 95 -9.021 -2.863 -21.937 1.00 0.00 O ATOM 73 CB LEU A 95 -11.505 -3.437 -19.899 1.00 0.00 C ATOM 74 CG LEU A 95 -11.911 -4.546 -20.875 1.00 0.00 C ATOM 75 CD1 LEU A 95 -10.735 -4.881 -21.792 1.00 0.00 C ATOM 76 CD2 LEU A 95 -12.310 -5.795 -20.085 1.00 0.00 C ATOM 0 HA LEU A 95 -11.121 -1.326 -20.087 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -10.755 -3.812 -19.203 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -12.367 -3.132 -19.305 1.00 0.00 H new ATOM 0 HG LEU A 95 -12.754 -4.207 -21.477 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -11.027 -5.670 -22.485 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -10.447 -3.993 -22.354 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -9.891 -5.220 -21.192 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -12.599 -6.586 -20.777 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -11.465 -6.130 -19.483 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -13.150 -5.559 -19.431 1.00 0.00 H new ATOM 88 N PRO A 96 -8.673 -2.037 -19.896 1.00 0.00 N ATOM 89 CA PRO A 96 -7.204 -2.132 -19.960 1.00 0.00 C ATOM 90 C PRO A 96 -6.764 -3.583 -20.182 1.00 0.00 C ATOM 91 O PRO A 96 -7.577 -4.475 -20.316 1.00 0.00 O ATOM 92 CB PRO A 96 -6.717 -1.616 -18.599 1.00 0.00 C ATOM 93 CG PRO A 96 -7.968 -1.221 -17.771 1.00 0.00 C ATOM 94 CD PRO A 96 -9.207 -1.495 -18.635 1.00 0.00 C ATOM 0 HA PRO A 96 -6.790 -1.556 -20.788 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -6.143 -2.384 -18.082 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -6.057 -0.758 -18.729 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -8.012 -1.797 -16.847 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -7.923 -0.169 -17.489 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.877 -2.205 -18.151 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -9.779 -0.583 -18.807 1.00 0.00 H new ATOM 238 N LEU B 86 -19.100 -8.370 -3.229 1.00 0.00 N ATOM 239 CA LEU B 86 -17.922 -7.545 -2.838 1.00 0.00 C ATOM 240 C LEU B 86 -16.718 -7.925 -3.704 1.00 0.00 C ATOM 241 O LEU B 86 -16.292 -9.062 -3.728 1.00 0.00 O ATOM 242 CB LEU B 86 -17.589 -7.799 -1.366 1.00 0.00 C ATOM 243 CG LEU B 86 -17.631 -6.475 -0.600 1.00 0.00 C ATOM 244 CD1 LEU B 86 -16.471 -5.587 -1.049 1.00 0.00 C ATOM 245 CD2 LEU B 86 -18.958 -5.766 -0.886 1.00 0.00 C ATOM 0 HA LEU B 86 -18.155 -6.490 -2.984 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -18.302 -8.503 -0.937 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -16.601 -8.252 -1.278 1.00 0.00 H new ATOM 0 HG LEU B 86 -17.544 -6.670 0.469 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -16.502 -4.644 -0.503 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -15.527 -6.092 -0.847 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -16.556 -5.390 -2.118 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -18.991 -4.822 -0.342 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -19.044 -5.571 -1.955 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -19.785 -6.399 -0.565 1.00 0.00 H new ATOM 257 N PHE B 87 -16.167 -6.978 -4.415 1.00 0.00 N ATOM 258 CA PHE B 87 -14.990 -7.281 -5.277 1.00 0.00 C ATOM 259 C PHE B 87 -13.788 -6.458 -4.805 1.00 0.00 C ATOM 260 O PHE B 87 -13.870 -5.718 -3.845 1.00 0.00 O ATOM 261 CB PHE B 87 -15.316 -6.920 -6.729 1.00 0.00 C ATOM 262 CG PHE B 87 -16.429 -7.807 -7.234 1.00 0.00 C ATOM 263 CD1 PHE B 87 -17.726 -7.662 -6.724 1.00 0.00 C ATOM 264 CD2 PHE B 87 -16.167 -8.773 -8.212 1.00 0.00 C ATOM 265 CE1 PHE B 87 -18.759 -8.482 -7.194 1.00 0.00 C ATOM 266 CE2 PHE B 87 -17.200 -9.593 -8.681 1.00 0.00 C ATOM 267 CZ PHE B 87 -18.496 -9.447 -8.172 1.00 0.00 C ATOM 0 H PHE B 87 -16.482 -6.008 -4.436 1.00 0.00 H new ATOM 0 HA PHE B 87 -14.753 -8.343 -5.210 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -15.613 -5.873 -6.796 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -14.430 -7.041 -7.352 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -17.929 -6.918 -5.968 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.167 -8.886 -8.605 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -19.759 -8.369 -6.801 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -16.997 -10.338 -9.436 1.00 0.00 H new ATOM 0 HZ PHE B 87 -19.293 -10.079 -8.534 1.00 0.00 H new ATOM 277 N VAL B 88 -12.673 -6.579 -5.474 1.00 0.00 N ATOM 278 CA VAL B 88 -11.468 -5.800 -5.063 1.00 0.00 C ATOM 279 C VAL B 88 -10.671 -5.417 -6.310 1.00 0.00 C ATOM 280 O VAL B 88 -10.571 -6.180 -7.251 1.00 0.00 O ATOM 281 CB VAL B 88 -10.576 -6.643 -4.140 1.00 0.00 C ATOM 282 CG1 VAL B 88 -10.066 -5.773 -2.990 1.00 0.00 C ATOM 283 CG2 VAL B 88 -11.371 -7.822 -3.566 1.00 0.00 C ATOM 0 H VAL B 88 -12.544 -7.182 -6.286 1.00 0.00 H new ATOM 0 HA VAL B 88 -11.789 -4.906 -4.529 1.00 0.00 H new ATOM 0 HB VAL B 88 -9.734 -7.026 -4.717 1.00 0.00 H new ATOM 0 HG11 VAL B 88 -9.433 -6.371 -2.335 1.00 0.00 H new ATOM 0 HG12 VAL B 88 -9.488 -4.941 -3.392 1.00 0.00 H new ATOM 0 HG13 VAL B 88 -10.913 -5.387 -2.423 1.00 0.00 H new ATOM 0 HG21 VAL B 88 -10.727 -8.412 -2.913 1.00 0.00 H new ATOM 0 HG22 VAL B 88 -12.219 -7.445 -2.995 1.00 0.00 H new ATOM 0 HG23 VAL B 88 -11.732 -8.448 -4.381 1.00 0.00 H new ATOM 293 N ALA B 89 -10.098 -4.245 -6.327 1.00 0.00 N ATOM 294 CA ALA B 89 -9.306 -3.826 -7.517 1.00 0.00 C ATOM 295 C ALA B 89 -8.011 -4.640 -7.566 1.00 0.00 C ATOM 296 O ALA B 89 -7.143 -4.497 -6.728 1.00 0.00 O ATOM 297 CB ALA B 89 -8.975 -2.337 -7.416 1.00 0.00 C ATOM 0 H ALA B 89 -10.144 -3.562 -5.571 1.00 0.00 H new ATOM 0 HA ALA B 89 -9.884 -4.001 -8.424 1.00 0.00 H new ATOM 0 HB1 ALA B 89 -8.396 -2.033 -8.288 1.00 0.00 H new ATOM 0 HB2 ALA B 89 -9.899 -1.761 -7.376 1.00 0.00 H new ATOM 0 HB3 ALA B 89 -8.394 -2.154 -6.512 1.00 0.00 H new ATOM 303 N LEU B 100 -7.881 -5.504 -8.536 1.00 0.00 N ATOM 304 CA LEU B 100 -6.649 -6.341 -8.634 1.00 0.00 C ATOM 305 C LEU B 100 -5.449 -5.471 -9.021 1.00 0.00 C ATOM 306 O LEU B 100 -4.322 -5.923 -9.014 1.00 0.00 O ATOM 307 CB LEU B 100 -6.854 -7.422 -9.696 1.00 0.00 C ATOM 308 CG LEU B 100 -8.093 -8.249 -9.351 1.00 0.00 C ATOM 309 CD1 LEU B 100 -8.818 -8.643 -10.639 1.00 0.00 C ATOM 310 CD2 LEU B 100 -7.666 -9.513 -8.602 1.00 0.00 C ATOM 0 H LEU B 100 -8.575 -5.667 -9.266 1.00 0.00 H new ATOM 0 HA LEU B 100 -6.456 -6.804 -7.666 1.00 0.00 H new ATOM 0 HB2 LEU B 100 -6.972 -6.964 -10.678 1.00 0.00 H new ATOM 0 HB3 LEU B 100 -5.977 -8.067 -9.748 1.00 0.00 H new ATOM 0 HG LEU B 100 -8.761 -7.660 -8.723 1.00 0.00 H new ATOM 0 HD11 LEU B 100 -9.701 -9.233 -10.394 1.00 0.00 H new ATOM 0 HD12 LEU B 100 -9.120 -7.744 -11.176 1.00 0.00 H new ATOM 0 HD13 LEU B 100 -8.150 -9.234 -11.266 1.00 0.00 H new ATOM 0 HD21 LEU B 100 -8.547 -10.105 -8.355 1.00 0.00 H new ATOM 0 HD22 LEU B 100 -6.999 -10.101 -9.232 1.00 0.00 H new ATOM 0 HD23 LEU B 100 -7.147 -9.235 -7.685 1.00 0.00 H new ATOM 322 N TYR B 101 -5.675 -4.233 -9.367 1.00 0.00 N ATOM 323 CA TYR B 101 -4.531 -3.359 -9.756 1.00 0.00 C ATOM 324 C TYR B 101 -4.867 -1.897 -9.457 1.00 0.00 C ATOM 325 O TYR B 101 -5.966 -1.568 -9.059 1.00 0.00 O ATOM 326 CB TYR B 101 -4.257 -3.518 -11.252 1.00 0.00 C ATOM 327 CG TYR B 101 -4.097 -4.982 -11.584 1.00 0.00 C ATOM 328 CD1 TYR B 101 -5.226 -5.768 -11.841 1.00 0.00 C ATOM 329 CD2 TYR B 101 -2.820 -5.554 -11.634 1.00 0.00 C ATOM 330 CE1 TYR B 101 -5.078 -7.126 -12.149 1.00 0.00 C ATOM 331 CE2 TYR B 101 -2.671 -6.911 -11.942 1.00 0.00 C ATOM 332 CZ TYR B 101 -3.801 -7.697 -12.199 1.00 0.00 C ATOM 333 OH TYR B 101 -3.654 -9.035 -12.503 1.00 0.00 O ATOM 0 H TYR B 101 -6.594 -3.791 -9.397 1.00 0.00 H new ATOM 0 HA TYR B 101 -3.649 -3.649 -9.186 1.00 0.00 H new ATOM 0 HB2 TYR B 101 -5.077 -3.091 -11.830 1.00 0.00 H new ATOM 0 HB3 TYR B 101 -3.355 -2.972 -11.527 1.00 0.00 H new ATOM 0 HD1 TYR B 101 -6.211 -5.327 -11.802 1.00 0.00 H new ATOM 0 HD2 TYR B 101 -1.949 -4.947 -11.435 1.00 0.00 H new ATOM 0 HE1 TYR B 101 -5.949 -7.733 -12.348 1.00 0.00 H new ATOM 0 HE2 TYR B 101 -1.686 -7.351 -11.981 1.00 0.00 H new ATOM 0 HH TYR B 101 -2.702 -9.269 -12.497 1.00 0.00 H new ATOM 343 N ASP B 102 -3.923 -1.015 -9.653 1.00 0.00 N ATOM 344 CA ASP B 102 -4.180 0.428 -9.389 1.00 0.00 C ATOM 345 C ASP B 102 -4.741 1.075 -10.655 1.00 0.00 C ATOM 346 O ASP B 102 -4.554 0.583 -11.750 1.00 0.00 O ATOM 347 CB ASP B 102 -2.870 1.117 -8.999 1.00 0.00 C ATOM 348 CG ASP B 102 -1.943 1.180 -10.216 1.00 0.00 C ATOM 349 OD1 ASP B 102 -1.884 0.201 -10.941 1.00 0.00 O ATOM 350 OD2 ASP B 102 -1.309 2.205 -10.401 1.00 0.00 O ATOM 0 H ASP B 102 -2.984 -1.234 -9.985 1.00 0.00 H new ATOM 0 HA ASP B 102 -4.897 0.532 -8.575 1.00 0.00 H new ATOM 0 HB2 ASP B 102 -3.072 2.123 -8.630 1.00 0.00 H new ATOM 0 HB3 ASP B 102 -2.387 0.571 -8.189 1.00 0.00 H new ATOM 355 N TYR B 103 -5.430 2.175 -10.519 1.00 0.00 N ATOM 356 CA TYR B 103 -6.001 2.845 -11.721 1.00 0.00 C ATOM 357 C TYR B 103 -6.209 4.332 -11.428 1.00 0.00 C ATOM 358 O TYR B 103 -6.517 4.718 -10.319 1.00 0.00 O ATOM 359 CB TYR B 103 -7.343 2.200 -12.073 1.00 0.00 C ATOM 360 CG TYR B 103 -7.996 2.972 -13.194 1.00 0.00 C ATOM 361 CD1 TYR B 103 -7.470 2.903 -14.490 1.00 0.00 C ATOM 362 CD2 TYR B 103 -9.127 3.756 -12.939 1.00 0.00 C ATOM 363 CE1 TYR B 103 -8.075 3.619 -15.531 1.00 0.00 C ATOM 364 CE2 TYR B 103 -9.731 4.471 -13.979 1.00 0.00 C ATOM 365 CZ TYR B 103 -9.206 4.403 -15.274 1.00 0.00 C ATOM 366 OH TYR B 103 -9.803 5.109 -16.298 1.00 0.00 O ATOM 0 H TYR B 103 -5.622 2.637 -9.630 1.00 0.00 H new ATOM 0 HA TYR B 103 -5.313 2.735 -12.560 1.00 0.00 H new ATOM 0 HB2 TYR B 103 -7.192 1.163 -12.372 1.00 0.00 H new ATOM 0 HB3 TYR B 103 -7.993 2.189 -11.198 1.00 0.00 H new ATOM 0 HD1 TYR B 103 -6.598 2.298 -14.687 1.00 0.00 H new ATOM 0 HD2 TYR B 103 -9.533 3.809 -11.940 1.00 0.00 H new ATOM 0 HE1 TYR B 103 -7.669 3.566 -16.531 1.00 0.00 H new ATOM 0 HE2 TYR B 103 -10.604 5.076 -13.782 1.00 0.00 H new ATOM 0 HH TYR B 103 -10.411 5.779 -15.922 1.00 0.00 H new ATOM 376 N GLU B 104 -6.042 5.169 -12.415 1.00 0.00 N ATOM 377 CA GLU B 104 -6.230 6.630 -12.192 1.00 0.00 C ATOM 378 C GLU B 104 -7.389 7.135 -13.055 1.00 0.00 C ATOM 379 O GLU B 104 -7.285 7.222 -14.262 1.00 0.00 O ATOM 380 CB GLU B 104 -4.949 7.373 -12.578 1.00 0.00 C ATOM 381 CG GLU B 104 -3.764 6.780 -11.815 1.00 0.00 C ATOM 382 CD GLU B 104 -2.517 7.634 -12.062 1.00 0.00 C ATOM 383 OE1 GLU B 104 -2.379 8.649 -11.402 1.00 0.00 O ATOM 384 OE2 GLU B 104 -1.724 7.255 -12.909 1.00 0.00 O ATOM 0 H GLU B 104 -5.784 4.904 -13.366 1.00 0.00 H new ATOM 0 HA GLU B 104 -6.454 6.810 -11.141 1.00 0.00 H new ATOM 0 HB2 GLU B 104 -4.780 7.294 -13.652 1.00 0.00 H new ATOM 0 HB3 GLU B 104 -5.048 8.434 -12.349 1.00 0.00 H new ATOM 0 HG2 GLU B 104 -3.987 6.743 -10.749 1.00 0.00 H new ATOM 0 HG3 GLU B 104 -3.586 5.755 -12.139 1.00 0.00 H new ATOM 391 N ALA B 105 -8.493 7.471 -12.444 1.00 0.00 N ATOM 392 CA ALA B 105 -9.655 7.971 -13.230 1.00 0.00 C ATOM 393 C ALA B 105 -9.210 9.152 -14.096 1.00 0.00 C ATOM 394 O ALA B 105 -8.981 10.240 -13.606 1.00 0.00 O ATOM 395 CB ALA B 105 -10.758 8.428 -12.272 1.00 0.00 C ATOM 0 H ALA B 105 -8.639 7.421 -11.436 1.00 0.00 H new ATOM 0 HA ALA B 105 -10.035 7.174 -13.868 1.00 0.00 H new ATOM 0 HB1 ALA B 105 -11.609 8.794 -12.846 1.00 0.00 H new ATOM 0 HB2 ALA B 105 -11.072 7.588 -11.652 1.00 0.00 H new ATOM 0 HB3 ALA B 105 -10.379 9.227 -11.635 1.00 0.00 H new ATOM 401 N ARG B 106 -9.085 8.948 -15.379 1.00 0.00 N ATOM 402 CA ARG B 106 -8.653 10.062 -16.269 1.00 0.00 C ATOM 403 C ARG B 106 -9.839 10.991 -16.537 1.00 0.00 C ATOM 404 O ARG B 106 -9.689 12.056 -17.103 1.00 0.00 O ATOM 405 CB ARG B 106 -8.141 9.491 -17.592 1.00 0.00 C ATOM 406 CG ARG B 106 -9.315 8.924 -18.393 1.00 0.00 C ATOM 407 CD ARG B 106 -8.906 7.591 -19.020 1.00 0.00 C ATOM 408 NE ARG B 106 -10.123 6.862 -19.477 1.00 0.00 N ATOM 409 CZ ARG B 106 -10.272 6.569 -20.739 1.00 0.00 C ATOM 410 NH1 ARG B 106 -9.293 6.015 -21.401 1.00 0.00 N ATOM 411 NH2 ARG B 106 -11.401 6.828 -21.340 1.00 0.00 N ATOM 0 H ARG B 106 -9.263 8.060 -15.848 1.00 0.00 H new ATOM 0 HA ARG B 106 -7.854 10.624 -15.785 1.00 0.00 H new ATOM 0 HB2 ARG B 106 -7.638 10.270 -18.166 1.00 0.00 H new ATOM 0 HB3 ARG B 106 -7.405 8.709 -17.402 1.00 0.00 H new ATOM 0 HG2 ARG B 106 -10.178 8.783 -17.743 1.00 0.00 H new ATOM 0 HG3 ARG B 106 -9.613 9.628 -19.170 1.00 0.00 H new ATOM 0 HD2 ARG B 106 -8.235 7.764 -19.862 1.00 0.00 H new ATOM 0 HD3 ARG B 106 -8.359 6.988 -18.295 1.00 0.00 H new ATOM 0 HE ARG B 106 -10.839 6.592 -18.803 1.00 0.00 H new ATOM 0 HH11 ARG B 106 -8.411 5.811 -20.931 1.00 0.00 H new ATOM 0 HH12 ARG B 106 -9.410 5.786 -22.388 1.00 0.00 H new ATOM 0 HH21 ARG B 106 -12.167 7.260 -20.823 1.00 0.00 H new ATOM 0 HH22 ARG B 106 -11.518 6.599 -22.327 1.00 0.00 H new ATOM 425 N THR B 107 -11.016 10.598 -16.133 1.00 0.00 N ATOM 426 CA THR B 107 -12.208 11.460 -16.363 1.00 0.00 C ATOM 427 C THR B 107 -12.980 11.617 -15.052 1.00 0.00 C ATOM 428 O THR B 107 -12.642 11.024 -14.048 1.00 0.00 O ATOM 429 CB THR B 107 -13.115 10.811 -17.412 1.00 0.00 C ATOM 430 OG1 THR B 107 -13.278 9.433 -17.106 1.00 0.00 O ATOM 431 CG2 THR B 107 -12.485 10.957 -18.797 1.00 0.00 C ATOM 0 H THR B 107 -11.203 9.717 -15.654 1.00 0.00 H new ATOM 0 HA THR B 107 -11.886 12.439 -16.718 1.00 0.00 H new ATOM 0 HB THR B 107 -14.088 11.303 -17.406 1.00 0.00 H new ATOM 0 HG1 THR B 107 -13.860 9.016 -17.775 1.00 0.00 H new ATOM 0 HG21 THR B 107 -13.132 10.494 -19.542 1.00 0.00 H new ATOM 0 HG22 THR B 107 -12.361 12.014 -19.031 1.00 0.00 H new ATOM 0 HG23 THR B 107 -11.512 10.467 -18.807 1.00 0.00 H new ATOM 439 N GLU B 108 -14.016 12.410 -15.055 1.00 0.00 N ATOM 440 CA GLU B 108 -14.808 12.600 -13.808 1.00 0.00 C ATOM 441 C GLU B 108 -15.903 11.532 -13.731 1.00 0.00 C ATOM 442 O GLU B 108 -16.758 11.569 -12.870 1.00 0.00 O ATOM 443 CB GLU B 108 -15.448 13.990 -13.818 1.00 0.00 C ATOM 444 CG GLU B 108 -14.619 14.941 -12.951 1.00 0.00 C ATOM 445 CD GLU B 108 -15.238 15.028 -11.554 1.00 0.00 C ATOM 446 OE1 GLU B 108 -15.196 14.035 -10.846 1.00 0.00 O ATOM 447 OE2 GLU B 108 -15.742 16.087 -11.216 1.00 0.00 O ATOM 0 H GLU B 108 -14.348 12.933 -15.865 1.00 0.00 H new ATOM 0 HA GLU B 108 -14.152 12.509 -12.942 1.00 0.00 H new ATOM 0 HB2 GLU B 108 -15.505 14.368 -14.839 1.00 0.00 H new ATOM 0 HB3 GLU B 108 -16.469 13.934 -13.441 1.00 0.00 H new ATOM 0 HG2 GLU B 108 -13.591 14.586 -12.883 1.00 0.00 H new ATOM 0 HG3 GLU B 108 -14.585 15.930 -13.408 1.00 0.00 H new ATOM 454 N ASP B 109 -15.882 10.579 -14.624 1.00 0.00 N ATOM 455 CA ASP B 109 -16.921 9.512 -14.596 1.00 0.00 C ATOM 456 C ASP B 109 -16.336 8.249 -13.962 1.00 0.00 C ATOM 457 O ASP B 109 -16.958 7.614 -13.134 1.00 0.00 O ATOM 458 CB ASP B 109 -17.379 9.201 -16.023 1.00 0.00 C ATOM 459 CG ASP B 109 -18.510 10.154 -16.415 1.00 0.00 C ATOM 460 OD1 ASP B 109 -18.227 11.320 -16.634 1.00 0.00 O ATOM 461 OD2 ASP B 109 -19.640 9.701 -16.490 1.00 0.00 O ATOM 0 H ASP B 109 -15.191 10.494 -15.370 1.00 0.00 H new ATOM 0 HA ASP B 109 -17.774 9.854 -14.010 1.00 0.00 H new ATOM 0 HB2 ASP B 109 -16.544 9.306 -16.715 1.00 0.00 H new ATOM 0 HB3 ASP B 109 -17.720 8.168 -16.090 1.00 0.00 H new ATOM 466 N ASP B 110 -15.140 7.880 -14.337 1.00 0.00 N ATOM 467 CA ASP B 110 -14.520 6.661 -13.745 1.00 0.00 C ATOM 468 C ASP B 110 -14.013 6.990 -12.340 1.00 0.00 C ATOM 469 O ASP B 110 -14.211 8.079 -11.840 1.00 0.00 O ATOM 470 CB ASP B 110 -13.352 6.198 -14.619 1.00 0.00 C ATOM 471 CG ASP B 110 -12.463 7.393 -14.967 1.00 0.00 C ATOM 472 OD1 ASP B 110 -12.473 8.352 -14.214 1.00 0.00 O ATOM 473 OD2 ASP B 110 -11.786 7.328 -15.980 1.00 0.00 O ATOM 0 H ASP B 110 -14.568 8.369 -15.026 1.00 0.00 H new ATOM 0 HA ASP B 110 -15.261 5.863 -13.691 1.00 0.00 H new ATOM 0 HB2 ASP B 110 -12.770 5.440 -14.094 1.00 0.00 H new ATOM 0 HB3 ASP B 110 -13.729 5.735 -15.531 1.00 0.00 H new ATOM 478 N LEU B 111 -13.364 6.060 -11.695 1.00 0.00 N ATOM 479 CA LEU B 111 -12.855 6.330 -10.321 1.00 0.00 C ATOM 480 C LEU B 111 -11.366 5.990 -10.242 1.00 0.00 C ATOM 481 O LEU B 111 -10.837 5.271 -11.068 1.00 0.00 O ATOM 482 CB LEU B 111 -13.624 5.472 -9.315 1.00 0.00 C ATOM 483 CG LEU B 111 -15.126 5.623 -9.557 1.00 0.00 C ATOM 484 CD1 LEU B 111 -15.773 4.239 -9.622 1.00 0.00 C ATOM 485 CD2 LEU B 111 -15.752 6.423 -8.413 1.00 0.00 C ATOM 0 H LEU B 111 -13.165 5.128 -12.058 1.00 0.00 H new ATOM 0 HA LEU B 111 -12.996 7.385 -10.088 1.00 0.00 H new ATOM 0 HB2 LEU B 111 -13.332 4.427 -9.415 1.00 0.00 H new ATOM 0 HB3 LEU B 111 -13.377 5.776 -8.298 1.00 0.00 H new ATOM 0 HG LEU B 111 -15.290 6.147 -10.498 1.00 0.00 H new ATOM 0 HD11 LEU B 111 -16.844 4.346 -9.794 1.00 0.00 H new ATOM 0 HD12 LEU B 111 -15.329 3.668 -10.437 1.00 0.00 H new ATOM 0 HD13 LEU B 111 -15.608 3.715 -8.680 1.00 0.00 H new ATOM 0 HD21 LEU B 111 -16.823 6.530 -8.587 1.00 0.00 H new ATOM 0 HD22 LEU B 111 -15.588 5.900 -7.471 1.00 0.00 H new ATOM 0 HD23 LEU B 111 -15.292 7.410 -8.365 1.00 0.00 H new ATOM 497 N SER B 112 -10.690 6.494 -9.249 1.00 0.00 N ATOM 498 CA SER B 112 -9.237 6.199 -9.101 1.00 0.00 C ATOM 499 C SER B 112 -9.011 5.470 -7.777 1.00 0.00 C ATOM 500 O SER B 112 -9.631 5.776 -6.779 1.00 0.00 O ATOM 501 CB SER B 112 -8.445 7.508 -9.111 1.00 0.00 C ATOM 502 OG SER B 112 -8.097 7.861 -7.779 1.00 0.00 O ATOM 0 H SER B 112 -11.083 7.101 -8.529 1.00 0.00 H new ATOM 0 HA SER B 112 -8.901 5.573 -9.927 1.00 0.00 H new ATOM 0 HB2 SER B 112 -7.545 7.397 -9.716 1.00 0.00 H new ATOM 0 HB3 SER B 112 -9.039 8.301 -9.566 1.00 0.00 H new ATOM 0 HG SER B 112 -7.588 8.699 -7.785 1.00 0.00 H new ATOM 508 N PHE B 113 -8.140 4.500 -7.757 1.00 0.00 N ATOM 509 CA PHE B 113 -7.898 3.754 -6.492 1.00 0.00 C ATOM 510 C PHE B 113 -6.602 2.951 -6.602 1.00 0.00 C ATOM 511 O PHE B 113 -5.867 3.063 -7.562 1.00 0.00 O ATOM 512 CB PHE B 113 -9.063 2.794 -6.253 1.00 0.00 C ATOM 513 CG PHE B 113 -9.380 2.081 -7.544 1.00 0.00 C ATOM 514 CD1 PHE B 113 -10.194 2.696 -8.504 1.00 0.00 C ATOM 515 CD2 PHE B 113 -8.852 0.808 -7.787 1.00 0.00 C ATOM 516 CE1 PHE B 113 -10.480 2.037 -9.705 1.00 0.00 C ATOM 517 CE2 PHE B 113 -9.138 0.150 -8.989 1.00 0.00 C ATOM 518 CZ PHE B 113 -9.951 0.764 -9.947 1.00 0.00 C ATOM 0 H PHE B 113 -7.588 4.193 -8.558 1.00 0.00 H new ATOM 0 HA PHE B 113 -7.815 4.459 -5.665 1.00 0.00 H new ATOM 0 HB2 PHE B 113 -8.804 2.073 -5.478 1.00 0.00 H new ATOM 0 HB3 PHE B 113 -9.937 3.342 -5.900 1.00 0.00 H new ATOM 0 HD1 PHE B 113 -10.601 3.679 -8.317 1.00 0.00 H new ATOM 0 HD2 PHE B 113 -8.224 0.333 -7.047 1.00 0.00 H new ATOM 0 HE1 PHE B 113 -11.109 2.510 -10.445 1.00 0.00 H new ATOM 0 HE2 PHE B 113 -8.731 -0.832 -9.177 1.00 0.00 H new ATOM 0 HZ PHE B 113 -10.171 0.256 -10.874 1.00 0.00 H new ATOM 528 N HIS B 114 -6.325 2.135 -5.623 1.00 0.00 N ATOM 529 CA HIS B 114 -5.084 1.313 -5.659 1.00 0.00 C ATOM 530 C HIS B 114 -5.443 -0.148 -5.374 1.00 0.00 C ATOM 531 O HIS B 114 -6.404 -0.439 -4.690 1.00 0.00 O ATOM 532 CB HIS B 114 -4.105 1.815 -4.596 1.00 0.00 C ATOM 533 CG HIS B 114 -3.643 3.202 -4.952 1.00 0.00 C ATOM 534 ND1 HIS B 114 -3.589 3.651 -6.262 1.00 0.00 N ATOM 535 CD2 HIS B 114 -3.211 4.251 -4.179 1.00 0.00 C ATOM 536 CE1 HIS B 114 -3.139 4.918 -6.239 1.00 0.00 C ATOM 537 NE2 HIS B 114 -2.894 5.334 -4.994 1.00 0.00 N ATOM 0 H HIS B 114 -6.908 2.002 -4.796 1.00 0.00 H new ATOM 0 HA HIS B 114 -4.619 1.393 -6.642 1.00 0.00 H new ATOM 0 HB2 HIS B 114 -4.586 1.821 -3.618 1.00 0.00 H new ATOM 0 HB3 HIS B 114 -3.250 1.142 -4.527 1.00 0.00 H new ATOM 0 HD2 HIS B 114 -3.129 4.238 -3.102 1.00 0.00 H new ATOM 0 HE1 HIS B 114 -2.993 5.525 -7.120 1.00 0.00 H new ATOM 0 HE2 HIS B 114 -2.549 6.249 -4.703 1.00 0.00 H new ATOM 545 N LYS B 115 -4.681 -1.070 -5.895 1.00 0.00 N ATOM 546 CA LYS B 115 -4.983 -2.511 -5.656 1.00 0.00 C ATOM 547 C LYS B 115 -5.205 -2.750 -4.160 1.00 0.00 C ATOM 548 O LYS B 115 -4.421 -2.334 -3.332 1.00 0.00 O ATOM 549 CB LYS B 115 -3.804 -3.360 -6.141 1.00 0.00 C ATOM 550 CG LYS B 115 -3.992 -4.810 -5.688 1.00 0.00 C ATOM 551 CD LYS B 115 -2.689 -5.584 -5.900 1.00 0.00 C ATOM 552 CE LYS B 115 -2.639 -6.779 -4.946 1.00 0.00 C ATOM 553 NZ LYS B 115 -3.051 -8.013 -5.673 1.00 0.00 N ATOM 0 H LYS B 115 -3.862 -0.889 -6.476 1.00 0.00 H new ATOM 0 HA LYS B 115 -5.885 -2.790 -6.201 1.00 0.00 H new ATOM 0 HB2 LYS B 115 -3.733 -3.315 -7.228 1.00 0.00 H new ATOM 0 HB3 LYS B 115 -2.870 -2.963 -5.744 1.00 0.00 H new ATOM 0 HG2 LYS B 115 -4.278 -4.840 -4.637 1.00 0.00 H new ATOM 0 HG3 LYS B 115 -4.800 -5.276 -6.251 1.00 0.00 H new ATOM 0 HD2 LYS B 115 -2.622 -5.927 -6.932 1.00 0.00 H new ATOM 0 HD3 LYS B 115 -1.834 -4.931 -5.725 1.00 0.00 H new ATOM 0 HE2 LYS B 115 -1.631 -6.898 -4.548 1.00 0.00 H new ATOM 0 HE3 LYS B 115 -3.299 -6.607 -4.096 1.00 0.00 H new ATOM 0 HZ1 LYS B 115 -3.017 -8.826 -5.025 1.00 0.00 H new ATOM 0 HZ2 LYS B 115 -4.020 -7.897 -6.032 1.00 0.00 H new ATOM 0 HZ3 LYS B 115 -2.404 -8.179 -6.470 1.00 0.00 H new ATOM 567 N GLY B 116 -6.267 -3.426 -3.810 1.00 0.00 N ATOM 568 CA GLY B 116 -6.536 -3.697 -2.368 1.00 0.00 C ATOM 569 C GLY B 116 -7.787 -2.939 -1.920 1.00 0.00 C ATOM 570 O GLY B 116 -8.375 -3.241 -0.901 1.00 0.00 O ATOM 0 H GLY B 116 -6.958 -3.801 -4.459 1.00 0.00 H new ATOM 0 HA2 GLY B 116 -6.672 -4.767 -2.209 1.00 0.00 H new ATOM 0 HA3 GLY B 116 -5.680 -3.392 -1.766 1.00 0.00 H new ATOM 574 N GLU B 117 -8.201 -1.956 -2.671 1.00 0.00 N ATOM 575 CA GLU B 117 -9.414 -1.181 -2.281 1.00 0.00 C ATOM 576 C GLU B 117 -10.670 -1.986 -2.619 1.00 0.00 C ATOM 577 O GLU B 117 -10.879 -2.384 -3.747 1.00 0.00 O ATOM 578 CB GLU B 117 -9.438 0.145 -3.044 1.00 0.00 C ATOM 579 CG GLU B 117 -9.538 1.304 -2.049 1.00 0.00 C ATOM 580 CD GLU B 117 -8.156 1.591 -1.460 1.00 0.00 C ATOM 581 OE1 GLU B 117 -7.206 1.639 -2.225 1.00 0.00 O ATOM 582 OE2 GLU B 117 -8.071 1.757 -0.255 1.00 0.00 O ATOM 0 H GLU B 117 -7.753 -1.656 -3.537 1.00 0.00 H new ATOM 0 HA GLU B 117 -9.388 -0.985 -1.209 1.00 0.00 H new ATOM 0 HB2 GLU B 117 -8.536 0.246 -3.647 1.00 0.00 H new ATOM 0 HB3 GLU B 117 -10.284 0.167 -3.730 1.00 0.00 H new ATOM 0 HG2 GLU B 117 -9.924 2.193 -2.548 1.00 0.00 H new ATOM 0 HG3 GLU B 117 -10.240 1.055 -1.253 1.00 0.00 H new ATOM 589 N LYS B 118 -11.513 -2.222 -1.650 1.00 0.00 N ATOM 590 CA LYS B 118 -12.760 -2.993 -1.918 1.00 0.00 C ATOM 591 C LYS B 118 -13.709 -2.134 -2.757 1.00 0.00 C ATOM 592 O LYS B 118 -13.637 -0.922 -2.742 1.00 0.00 O ATOM 593 CB LYS B 118 -13.432 -3.354 -0.592 1.00 0.00 C ATOM 594 CG LYS B 118 -12.558 -4.352 0.171 1.00 0.00 C ATOM 595 CD LYS B 118 -11.409 -3.607 0.854 1.00 0.00 C ATOM 596 CE LYS B 118 -11.104 -4.263 2.203 1.00 0.00 C ATOM 597 NZ LYS B 118 -9.973 -3.549 2.858 1.00 0.00 N ATOM 0 H LYS B 118 -11.392 -1.914 -0.685 1.00 0.00 H new ATOM 0 HA LYS B 118 -12.518 -3.908 -2.459 1.00 0.00 H new ATOM 0 HB2 LYS B 118 -13.584 -2.456 0.007 1.00 0.00 H new ATOM 0 HB3 LYS B 118 -14.416 -3.784 -0.777 1.00 0.00 H new ATOM 0 HG2 LYS B 118 -13.155 -4.881 0.914 1.00 0.00 H new ATOM 0 HG3 LYS B 118 -12.163 -5.103 -0.513 1.00 0.00 H new ATOM 0 HD2 LYS B 118 -10.522 -3.625 0.220 1.00 0.00 H new ATOM 0 HD3 LYS B 118 -11.676 -2.560 0.999 1.00 0.00 H new ATOM 0 HE2 LYS B 118 -11.986 -4.232 2.842 1.00 0.00 H new ATOM 0 HE3 LYS B 118 -10.851 -5.313 2.060 1.00 0.00 H new ATOM 0 HZ1 LYS B 118 -9.765 -3.994 3.775 1.00 0.00 H new ATOM 0 HZ2 LYS B 118 -9.131 -3.600 2.250 1.00 0.00 H new ATOM 0 HZ3 LYS B 118 -10.232 -2.553 3.008 1.00 0.00 H new ATOM 611 N PHE B 119 -14.596 -2.748 -3.491 1.00 0.00 N ATOM 612 CA PHE B 119 -15.540 -1.955 -4.329 1.00 0.00 C ATOM 613 C PHE B 119 -16.924 -2.603 -4.308 1.00 0.00 C ATOM 614 O PHE B 119 -17.055 -3.812 -4.321 1.00 0.00 O ATOM 615 CB PHE B 119 -15.028 -1.910 -5.769 1.00 0.00 C ATOM 616 CG PHE B 119 -14.045 -0.775 -5.925 1.00 0.00 C ATOM 617 CD1 PHE B 119 -12.696 -0.969 -5.610 1.00 0.00 C ATOM 618 CD2 PHE B 119 -14.484 0.472 -6.387 1.00 0.00 C ATOM 619 CE1 PHE B 119 -11.783 0.084 -5.757 1.00 0.00 C ATOM 620 CE2 PHE B 119 -13.572 1.525 -6.534 1.00 0.00 C ATOM 621 CZ PHE B 119 -12.222 1.330 -6.219 1.00 0.00 C ATOM 0 H PHE B 119 -14.708 -3.760 -3.547 1.00 0.00 H new ATOM 0 HA PHE B 119 -15.608 -0.943 -3.929 1.00 0.00 H new ATOM 0 HB2 PHE B 119 -14.550 -2.856 -6.025 1.00 0.00 H new ATOM 0 HB3 PHE B 119 -15.862 -1.778 -6.458 1.00 0.00 H new ATOM 0 HD1 PHE B 119 -12.358 -1.931 -5.253 1.00 0.00 H new ATOM 0 HD2 PHE B 119 -15.526 0.622 -6.630 1.00 0.00 H new ATOM 0 HE1 PHE B 119 -10.741 -0.066 -5.514 1.00 0.00 H new ATOM 0 HE2 PHE B 119 -13.910 2.487 -6.890 1.00 0.00 H new ATOM 0 HZ PHE B 119 -11.519 2.142 -6.333 1.00 0.00 H new ATOM 631 N GLN B 120 -17.960 -1.809 -4.289 1.00 0.00 N ATOM 632 CA GLN B 120 -19.337 -2.381 -4.282 1.00 0.00 C ATOM 633 C GLN B 120 -19.912 -2.310 -5.697 1.00 0.00 C ATOM 634 O GLN B 120 -20.356 -1.271 -6.146 1.00 0.00 O ATOM 635 CB GLN B 120 -20.225 -1.582 -3.327 1.00 0.00 C ATOM 636 CG GLN B 120 -20.161 -2.204 -1.931 1.00 0.00 C ATOM 637 CD GLN B 120 -21.513 -2.834 -1.590 1.00 0.00 C ATOM 638 OE1 GLN B 120 -21.764 -3.977 -1.917 1.00 0.00 O ATOM 639 NE2 GLN B 120 -22.402 -2.130 -0.942 1.00 0.00 N ATOM 0 H GLN B 120 -17.913 -0.790 -4.278 1.00 0.00 H new ATOM 0 HA GLN B 120 -19.301 -3.418 -3.949 1.00 0.00 H new ATOM 0 HB2 GLN B 120 -19.895 -0.544 -3.290 1.00 0.00 H new ATOM 0 HB3 GLN B 120 -21.254 -1.577 -3.688 1.00 0.00 H new ATOM 0 HG2 GLN B 120 -19.376 -2.959 -1.894 1.00 0.00 H new ATOM 0 HG3 GLN B 120 -19.906 -1.443 -1.194 1.00 0.00 H new ATOM 0 HE21 GLN B 120 -22.191 -1.170 -0.667 1.00 0.00 H new ATOM 0 HE22 GLN B 120 -23.307 -2.540 -0.710 1.00 0.00 H new ATOM 648 N ILE B 121 -19.902 -3.403 -6.408 1.00 0.00 N ATOM 649 CA ILE B 121 -20.440 -3.392 -7.797 1.00 0.00 C ATOM 650 C ILE B 121 -21.965 -3.287 -7.766 1.00 0.00 C ATOM 651 O ILE B 121 -22.652 -4.189 -7.330 1.00 0.00 O ATOM 652 CB ILE B 121 -20.039 -4.683 -8.511 1.00 0.00 C ATOM 653 CG1 ILE B 121 -18.523 -4.702 -8.731 1.00 0.00 C ATOM 654 CG2 ILE B 121 -20.750 -4.759 -9.861 1.00 0.00 C ATOM 655 CD1 ILE B 121 -18.067 -3.354 -9.296 1.00 0.00 C ATOM 0 H ILE B 121 -19.545 -4.303 -6.088 1.00 0.00 H new ATOM 0 HA ILE B 121 -20.030 -2.534 -8.329 1.00 0.00 H new ATOM 0 HB ILE B 121 -20.325 -5.538 -7.899 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -18.012 -4.905 -7.790 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -18.256 -5.505 -9.418 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -20.465 -5.679 -10.371 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -21.829 -4.750 -9.705 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -20.464 -3.902 -10.471 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -16.988 -3.371 -9.451 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -18.568 -3.170 -10.247 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -18.320 -2.560 -8.593 1.00 0.00 H new ATOM 667 N LEU B 122 -22.500 -2.195 -8.241 1.00 0.00 N ATOM 668 CA LEU B 122 -23.981 -2.034 -8.255 1.00 0.00 C ATOM 669 C LEU B 122 -24.517 -2.539 -9.594 1.00 0.00 C ATOM 670 O LEU B 122 -25.597 -3.089 -9.678 1.00 0.00 O ATOM 671 CB LEU B 122 -24.344 -0.556 -8.086 1.00 0.00 C ATOM 672 CG LEU B 122 -23.288 0.138 -7.227 1.00 0.00 C ATOM 673 CD1 LEU B 122 -23.726 1.575 -6.937 1.00 0.00 C ATOM 674 CD2 LEU B 122 -23.129 -0.621 -5.908 1.00 0.00 C ATOM 0 H LEU B 122 -21.975 -1.407 -8.620 1.00 0.00 H new ATOM 0 HA LEU B 122 -24.421 -2.604 -7.436 1.00 0.00 H new ATOM 0 HB2 LEU B 122 -24.408 -0.073 -9.061 1.00 0.00 H new ATOM 0 HB3 LEU B 122 -25.325 -0.463 -7.619 1.00 0.00 H new ATOM 0 HG LEU B 122 -22.337 0.150 -7.760 1.00 0.00 H new ATOM 0 HD11 LEU B 122 -22.972 2.069 -6.324 1.00 0.00 H new ATOM 0 HD12 LEU B 122 -23.842 2.116 -7.876 1.00 0.00 H new ATOM 0 HD13 LEU B 122 -24.677 1.565 -6.404 1.00 0.00 H new ATOM 0 HD21 LEU B 122 -22.376 -0.128 -5.293 1.00 0.00 H new ATOM 0 HD22 LEU B 122 -24.081 -0.632 -5.377 1.00 0.00 H new ATOM 0 HD23 LEU B 122 -22.817 -1.645 -6.113 1.00 0.00 H new ATOM 686 N ASN B 123 -23.761 -2.359 -10.641 1.00 0.00 N ATOM 687 CA ASN B 123 -24.211 -2.826 -11.982 1.00 0.00 C ATOM 688 C ASN B 123 -23.029 -3.468 -12.713 1.00 0.00 C ATOM 689 O ASN B 123 -21.918 -2.980 -12.664 1.00 0.00 O ATOM 690 CB ASN B 123 -24.726 -1.636 -12.792 1.00 0.00 C ATOM 691 CG ASN B 123 -25.824 -2.104 -13.748 1.00 0.00 C ATOM 692 OD1 ASN B 123 -25.611 -2.187 -14.941 1.00 0.00 O ATOM 693 ND2 ASN B 123 -26.997 -2.419 -13.271 1.00 0.00 N ATOM 0 H ASN B 123 -22.847 -1.907 -10.625 1.00 0.00 H new ATOM 0 HA ASN B 123 -25.012 -3.556 -11.866 1.00 0.00 H new ATOM 0 HB2 ASN B 123 -25.115 -0.869 -12.123 1.00 0.00 H new ATOM 0 HB3 ASN B 123 -23.908 -1.184 -13.354 1.00 0.00 H new ATOM 0 HD21 ASN B 123 -27.735 -2.735 -13.900 1.00 0.00 H new ATOM 0 HD22 ASN B 123 -27.176 -2.349 -12.269 1.00 0.00 H new ATOM 700 N SER B 124 -23.258 -4.561 -13.389 1.00 0.00 N ATOM 701 CA SER B 124 -22.143 -5.230 -14.117 1.00 0.00 C ATOM 702 C SER B 124 -22.703 -5.992 -15.318 1.00 0.00 C ATOM 703 O SER B 124 -22.171 -7.008 -15.721 1.00 0.00 O ATOM 704 CB SER B 124 -21.438 -6.207 -13.176 1.00 0.00 C ATOM 705 OG SER B 124 -22.382 -7.151 -12.686 1.00 0.00 O ATOM 0 H SER B 124 -24.166 -5.018 -13.468 1.00 0.00 H new ATOM 0 HA SER B 124 -21.432 -4.480 -14.464 1.00 0.00 H new ATOM 0 HB2 SER B 124 -20.633 -6.720 -13.702 1.00 0.00 H new ATOM 0 HB3 SER B 124 -20.983 -5.666 -12.346 1.00 0.00 H new ATOM 0 HG SER B 124 -21.933 -7.780 -12.084 1.00 0.00 H new ATOM 744 N ASP B 128 -18.741 -3.528 -20.933 1.00 0.00 N ATOM 745 CA ASP B 128 -17.529 -4.226 -20.420 1.00 0.00 C ATOM 746 C ASP B 128 -17.097 -3.586 -19.099 1.00 0.00 C ATOM 747 O ASP B 128 -16.429 -4.198 -18.290 1.00 0.00 O ATOM 748 CB ASP B 128 -16.397 -4.102 -21.442 1.00 0.00 C ATOM 749 CG ASP B 128 -16.743 -4.919 -22.689 1.00 0.00 C ATOM 750 OD1 ASP B 128 -17.754 -5.601 -22.665 1.00 0.00 O ATOM 751 OD2 ASP B 128 -15.990 -4.849 -23.646 1.00 0.00 O ATOM 0 HA ASP B 128 -17.756 -5.280 -20.258 1.00 0.00 H new ATOM 0 HB2 ASP B 128 -16.247 -3.056 -21.710 1.00 0.00 H new ATOM 0 HB3 ASP B 128 -15.462 -4.457 -21.009 1.00 0.00 H new ATOM 756 N TRP B 129 -17.476 -2.358 -18.870 1.00 0.00 N ATOM 757 CA TRP B 129 -17.089 -1.681 -17.599 1.00 0.00 C ATOM 758 C TRP B 129 -18.269 -1.724 -16.626 1.00 0.00 C ATOM 759 O TRP B 129 -19.413 -1.632 -17.021 1.00 0.00 O ATOM 760 CB TRP B 129 -16.713 -0.226 -17.887 1.00 0.00 C ATOM 761 CG TRP B 129 -15.345 -0.175 -18.489 1.00 0.00 C ATOM 762 CD1 TRP B 129 -14.923 -0.938 -19.523 1.00 0.00 C ATOM 763 CD2 TRP B 129 -14.215 0.667 -18.114 1.00 0.00 C ATOM 764 NE1 TRP B 129 -13.607 -0.620 -19.807 1.00 0.00 N ATOM 765 CE2 TRP B 129 -13.126 0.364 -18.966 1.00 0.00 C ATOM 766 CE3 TRP B 129 -14.030 1.654 -17.129 1.00 0.00 C ATOM 767 CZ2 TRP B 129 -11.898 1.015 -18.844 1.00 0.00 C ATOM 768 CZ3 TRP B 129 -12.796 2.313 -17.003 1.00 0.00 C ATOM 769 CH2 TRP B 129 -11.731 1.993 -17.860 1.00 0.00 C ATOM 0 H TRP B 129 -18.037 -1.794 -19.508 1.00 0.00 H new ATOM 0 HA TRP B 129 -16.233 -2.192 -17.158 1.00 0.00 H new ATOM 0 HB2 TRP B 129 -17.438 0.221 -18.567 1.00 0.00 H new ATOM 0 HB3 TRP B 129 -16.739 0.357 -16.966 1.00 0.00 H new ATOM 0 HD1 TRP B 129 -15.517 -1.676 -20.042 1.00 0.00 H new ATOM 0 HE1 TRP B 129 -13.059 -1.059 -20.547 1.00 0.00 H new ATOM 0 HE3 TRP B 129 -14.843 1.907 -16.465 1.00 0.00 H new ATOM 0 HZ2 TRP B 129 -11.082 0.765 -19.506 1.00 0.00 H new ATOM 0 HZ3 TRP B 129 -12.666 3.069 -16.243 1.00 0.00 H new ATOM 0 HH2 TRP B 129 -10.784 2.502 -17.759 1.00 0.00 H new ATOM 780 N TRP B 130 -18.001 -1.870 -15.356 1.00 0.00 N ATOM 781 CA TRP B 130 -19.112 -1.925 -14.365 1.00 0.00 C ATOM 782 C TRP B 130 -19.091 -0.671 -13.489 1.00 0.00 C ATOM 783 O TRP B 130 -18.098 0.022 -13.401 1.00 0.00 O ATOM 784 CB TRP B 130 -18.940 -3.152 -13.469 1.00 0.00 C ATOM 785 CG TRP B 130 -18.843 -4.388 -14.304 1.00 0.00 C ATOM 786 CD1 TRP B 130 -19.155 -4.472 -15.618 1.00 0.00 C ATOM 787 CD2 TRP B 130 -18.410 -5.717 -13.899 1.00 0.00 C ATOM 788 NE1 TRP B 130 -18.938 -5.771 -16.045 1.00 0.00 N ATOM 789 CE2 TRP B 130 -18.478 -6.576 -15.020 1.00 0.00 C ATOM 790 CE3 TRP B 130 -17.968 -6.254 -12.677 1.00 0.00 C ATOM 791 CZ2 TRP B 130 -18.121 -7.922 -14.932 1.00 0.00 C ATOM 792 CZ3 TRP B 130 -17.608 -7.608 -12.583 1.00 0.00 C ATOM 793 CH2 TRP B 130 -17.684 -8.441 -13.709 1.00 0.00 C ATOM 0 H TRP B 130 -17.063 -1.953 -14.964 1.00 0.00 H new ATOM 0 HA TRP B 130 -20.059 -1.984 -14.901 1.00 0.00 H new ATOM 0 HB2 TRP B 130 -18.043 -3.044 -12.860 1.00 0.00 H new ATOM 0 HB3 TRP B 130 -19.783 -3.232 -12.783 1.00 0.00 H new ATOM 0 HD1 TRP B 130 -19.514 -3.660 -16.232 1.00 0.00 H new ATOM 0 HE1 TRP B 130 -19.098 -6.094 -16.999 1.00 0.00 H new ATOM 0 HE3 TRP B 130 -17.905 -5.621 -11.805 1.00 0.00 H new ATOM 0 HZ2 TRP B 130 -18.182 -8.559 -15.802 1.00 0.00 H new ATOM 0 HZ3 TRP B 130 -17.271 -8.010 -11.639 1.00 0.00 H new ATOM 0 HH2 TRP B 130 -17.405 -9.482 -13.632 1.00 0.00 H new ATOM 804 N GLU B 131 -20.179 -0.389 -12.826 1.00 0.00 N ATOM 805 CA GLU B 131 -20.224 0.805 -11.938 1.00 0.00 C ATOM 806 C GLU B 131 -19.999 0.350 -10.496 1.00 0.00 C ATOM 807 O GLU B 131 -20.689 -0.516 -9.995 1.00 0.00 O ATOM 808 CB GLU B 131 -21.591 1.485 -12.055 1.00 0.00 C ATOM 809 CG GLU B 131 -22.653 0.630 -11.362 1.00 0.00 C ATOM 810 CD GLU B 131 -24.033 1.247 -11.590 1.00 0.00 C ATOM 811 OE1 GLU B 131 -24.532 1.138 -12.698 1.00 0.00 O ATOM 812 OE2 GLU B 131 -24.567 1.819 -10.654 1.00 0.00 O ATOM 0 H GLU B 131 -21.040 -0.935 -12.862 1.00 0.00 H new ATOM 0 HA GLU B 131 -19.450 1.514 -12.231 1.00 0.00 H new ATOM 0 HB2 GLU B 131 -21.555 2.476 -11.602 1.00 0.00 H new ATOM 0 HB3 GLU B 131 -21.850 1.624 -13.105 1.00 0.00 H new ATOM 0 HG2 GLU B 131 -22.629 -0.387 -11.753 1.00 0.00 H new ATOM 0 HG3 GLU B 131 -22.444 0.566 -10.294 1.00 0.00 H new ATOM 819 N ALA B 132 -19.034 0.913 -9.824 1.00 0.00 N ATOM 820 CA ALA B 132 -18.770 0.492 -8.421 1.00 0.00 C ATOM 821 C ALA B 132 -18.669 1.721 -7.517 1.00 0.00 C ATOM 822 O ALA B 132 -18.220 2.773 -7.926 1.00 0.00 O ATOM 823 CB ALA B 132 -17.456 -0.289 -8.364 1.00 0.00 C ATOM 0 H ALA B 132 -18.419 1.643 -10.184 1.00 0.00 H new ATOM 0 HA ALA B 132 -19.589 -0.139 -8.077 1.00 0.00 H new ATOM 0 HB1 ALA B 132 -17.261 -0.598 -7.337 1.00 0.00 H new ATOM 0 HB2 ALA B 132 -17.529 -1.171 -9.001 1.00 0.00 H new ATOM 0 HB3 ALA B 132 -16.641 0.345 -8.713 1.00 0.00 H new ATOM 829 N ARG B 133 -19.079 1.588 -6.286 1.00 0.00 N ATOM 830 CA ARG B 133 -19.003 2.736 -5.344 1.00 0.00 C ATOM 831 C ARG B 133 -17.809 2.537 -4.411 1.00 0.00 C ATOM 832 O ARG B 133 -17.587 1.458 -3.895 1.00 0.00 O ATOM 833 CB ARG B 133 -20.291 2.808 -4.520 1.00 0.00 C ATOM 834 CG ARG B 133 -20.119 3.824 -3.390 1.00 0.00 C ATOM 835 CD ARG B 133 -21.295 4.801 -3.400 1.00 0.00 C ATOM 836 NE ARG B 133 -21.531 5.310 -2.019 1.00 0.00 N ATOM 837 CZ ARG B 133 -22.723 5.240 -1.493 1.00 0.00 C ATOM 838 NH1 ARG B 133 -23.492 4.217 -1.752 1.00 0.00 N ATOM 839 NH2 ARG B 133 -23.146 6.192 -0.706 1.00 0.00 N ATOM 0 H ARG B 133 -19.465 0.730 -5.892 1.00 0.00 H new ATOM 0 HA ARG B 133 -18.882 3.664 -5.903 1.00 0.00 H new ATOM 0 HB2 ARG B 133 -21.127 3.095 -5.157 1.00 0.00 H new ATOM 0 HB3 ARG B 133 -20.527 1.827 -4.108 1.00 0.00 H new ATOM 0 HG2 ARG B 133 -20.067 3.311 -2.430 1.00 0.00 H new ATOM 0 HG3 ARG B 133 -19.181 4.366 -3.513 1.00 0.00 H new ATOM 0 HD2 ARG B 133 -21.086 5.632 -4.074 1.00 0.00 H new ATOM 0 HD3 ARG B 133 -22.191 4.305 -3.774 1.00 0.00 H new ATOM 0 HE ARG B 133 -20.761 5.713 -1.485 1.00 0.00 H new ATOM 0 HH11 ARG B 133 -23.161 3.472 -2.366 1.00 0.00 H new ATOM 0 HH12 ARG B 133 -24.424 4.162 -1.341 1.00 0.00 H new ATOM 0 HH21 ARG B 133 -22.545 6.990 -0.502 1.00 0.00 H new ATOM 0 HH22 ARG B 133 -24.078 6.137 -0.295 1.00 0.00 H new ATOM 853 N SER B 134 -17.037 3.566 -4.193 1.00 0.00 N ATOM 854 CA SER B 134 -15.855 3.435 -3.296 1.00 0.00 C ATOM 855 C SER B 134 -16.320 3.433 -1.839 1.00 0.00 C ATOM 856 O SER B 134 -16.883 4.396 -1.355 1.00 0.00 O ATOM 857 CB SER B 134 -14.909 4.613 -3.528 1.00 0.00 C ATOM 858 OG SER B 134 -15.210 5.215 -4.781 1.00 0.00 O ATOM 0 H SER B 134 -17.174 4.492 -4.598 1.00 0.00 H new ATOM 0 HA SER B 134 -15.334 2.502 -3.512 1.00 0.00 H new ATOM 0 HB2 SER B 134 -15.015 5.343 -2.726 1.00 0.00 H new ATOM 0 HB3 SER B 134 -13.874 4.272 -3.514 1.00 0.00 H new ATOM 0 HG SER B 134 -15.039 6.179 -4.730 1.00 0.00 H new ATOM 864 N LEU B 135 -16.089 2.361 -1.133 1.00 0.00 N ATOM 865 CA LEU B 135 -16.517 2.301 0.292 1.00 0.00 C ATOM 866 C LEU B 135 -15.678 3.279 1.117 1.00 0.00 C ATOM 867 O LEU B 135 -15.938 3.507 2.282 1.00 0.00 O ATOM 868 CB LEU B 135 -16.320 0.880 0.826 1.00 0.00 C ATOM 869 CG LEU B 135 -17.480 -0.004 0.361 1.00 0.00 C ATOM 870 CD1 LEU B 135 -16.975 -1.430 0.130 1.00 0.00 C ATOM 871 CD2 LEU B 135 -18.570 -0.019 1.434 1.00 0.00 C ATOM 0 H LEU B 135 -15.622 1.524 -1.482 1.00 0.00 H new ATOM 0 HA LEU B 135 -17.570 2.573 0.367 1.00 0.00 H new ATOM 0 HB2 LEU B 135 -15.373 0.474 0.470 1.00 0.00 H new ATOM 0 HB3 LEU B 135 -16.272 0.892 1.915 1.00 0.00 H new ATOM 0 HG LEU B 135 -17.888 0.392 -0.569 1.00 0.00 H new ATOM 0 HD11 LEU B 135 -17.801 -2.059 -0.201 1.00 0.00 H new ATOM 0 HD12 LEU B 135 -16.197 -1.421 -0.633 1.00 0.00 H new ATOM 0 HD13 LEU B 135 -16.567 -1.826 1.060 1.00 0.00 H new ATOM 0 HD21 LEU B 135 -19.397 -0.648 1.104 1.00 0.00 H new ATOM 0 HD22 LEU B 135 -18.161 -0.416 2.363 1.00 0.00 H new ATOM 0 HD23 LEU B 135 -18.931 0.996 1.601 1.00 0.00 H new ATOM 883 N THR B 136 -14.670 3.860 0.523 1.00 0.00 N ATOM 884 CA THR B 136 -13.816 4.821 1.273 1.00 0.00 C ATOM 885 C THR B 136 -14.230 6.254 0.926 1.00 0.00 C ATOM 886 O THR B 136 -14.767 6.971 1.748 1.00 0.00 O ATOM 887 CB THR B 136 -12.351 4.610 0.886 1.00 0.00 C ATOM 888 OG1 THR B 136 -11.892 3.381 1.431 1.00 0.00 O ATOM 889 CG2 THR B 136 -11.505 5.760 1.433 1.00 0.00 C ATOM 0 H THR B 136 -14.402 3.709 -0.450 1.00 0.00 H new ATOM 0 HA THR B 136 -13.940 4.655 2.343 1.00 0.00 H new ATOM 0 HB THR B 136 -12.262 4.583 -0.200 1.00 0.00 H new ATOM 0 HG1 THR B 136 -10.954 3.243 1.183 1.00 0.00 H new ATOM 0 HG21 THR B 136 -10.462 5.608 1.156 1.00 0.00 H new ATOM 0 HG22 THR B 136 -11.858 6.702 1.014 1.00 0.00 H new ATOM 0 HG23 THR B 136 -11.591 5.791 2.519 1.00 0.00 H new ATOM 897 N THR B 137 -13.984 6.675 -0.283 1.00 0.00 N ATOM 898 CA THR B 137 -14.361 8.060 -0.682 1.00 0.00 C ATOM 899 C THR B 137 -15.885 8.199 -0.664 1.00 0.00 C ATOM 900 O THR B 137 -16.425 9.156 -0.145 1.00 0.00 O ATOM 901 CB THR B 137 -13.840 8.343 -2.092 1.00 0.00 C ATOM 902 OG1 THR B 137 -14.190 7.266 -2.950 1.00 0.00 O ATOM 903 CG2 THR B 137 -12.318 8.494 -2.053 1.00 0.00 C ATOM 0 H THR B 137 -13.538 6.120 -1.013 1.00 0.00 H new ATOM 0 HA THR B 137 -13.923 8.772 0.017 1.00 0.00 H new ATOM 0 HB THR B 137 -14.285 9.265 -2.467 1.00 0.00 H new ATOM 0 HG1 THR B 137 -13.726 7.367 -3.807 1.00 0.00 H new ATOM 0 HG21 THR B 137 -11.947 8.696 -3.058 1.00 0.00 H new ATOM 0 HG22 THR B 137 -12.051 9.321 -1.395 1.00 0.00 H new ATOM 0 HG23 THR B 137 -11.870 7.573 -1.679 1.00 0.00 H new ATOM 911 N GLY B 138 -16.583 7.251 -1.226 1.00 0.00 N ATOM 912 CA GLY B 138 -18.071 7.331 -1.239 1.00 0.00 C ATOM 913 C GLY B 138 -18.555 7.730 -2.635 1.00 0.00 C ATOM 914 O GLY B 138 -19.721 7.612 -2.954 1.00 0.00 O ATOM 0 H GLY B 138 -16.188 6.425 -1.676 1.00 0.00 H new ATOM 0 HA2 GLY B 138 -18.499 6.369 -0.957 1.00 0.00 H new ATOM 0 HA3 GLY B 138 -18.412 8.060 -0.504 1.00 0.00 H new ATOM 918 N GLU B 139 -17.669 8.203 -3.470 1.00 0.00 N ATOM 919 CA GLU B 139 -18.084 8.611 -4.842 1.00 0.00 C ATOM 920 C GLU B 139 -18.356 7.365 -5.688 1.00 0.00 C ATOM 921 O GLU B 139 -17.719 6.342 -5.529 1.00 0.00 O ATOM 922 CB GLU B 139 -16.968 9.434 -5.491 1.00 0.00 C ATOM 923 CG GLU B 139 -16.613 10.615 -4.586 1.00 0.00 C ATOM 924 CD GLU B 139 -15.514 11.452 -5.243 1.00 0.00 C ATOM 925 OE1 GLU B 139 -15.107 11.105 -6.339 1.00 0.00 O ATOM 926 OE2 GLU B 139 -15.098 12.427 -4.638 1.00 0.00 O ATOM 0 H GLU B 139 -16.678 8.324 -3.261 1.00 0.00 H new ATOM 0 HA GLU B 139 -18.991 9.213 -4.781 1.00 0.00 H new ATOM 0 HB2 GLU B 139 -16.089 8.810 -5.654 1.00 0.00 H new ATOM 0 HB3 GLU B 139 -17.289 9.795 -6.468 1.00 0.00 H new ATOM 0 HG2 GLU B 139 -17.496 11.229 -4.410 1.00 0.00 H new ATOM 0 HG3 GLU B 139 -16.277 10.253 -3.614 1.00 0.00 H new ATOM 933 N THR B 140 -19.296 7.443 -6.589 1.00 0.00 N ATOM 934 CA THR B 140 -19.609 6.268 -7.450 1.00 0.00 C ATOM 935 C THR B 140 -19.139 6.549 -8.878 1.00 0.00 C ATOM 936 O THR B 140 -19.166 7.673 -9.337 1.00 0.00 O ATOM 937 CB THR B 140 -21.121 6.024 -7.449 1.00 0.00 C ATOM 938 OG1 THR B 140 -21.604 6.060 -6.114 1.00 0.00 O ATOM 939 CG2 THR B 140 -21.421 4.657 -8.066 1.00 0.00 C ATOM 0 H THR B 140 -19.862 8.272 -6.767 1.00 0.00 H new ATOM 0 HA THR B 140 -19.099 5.385 -7.064 1.00 0.00 H new ATOM 0 HB THR B 140 -21.614 6.799 -8.035 1.00 0.00 H new ATOM 0 HG1 THR B 140 -22.572 5.906 -6.112 1.00 0.00 H new ATOM 0 HG21 THR B 140 -22.497 4.485 -8.064 1.00 0.00 H new ATOM 0 HG22 THR B 140 -21.051 4.631 -9.091 1.00 0.00 H new ATOM 0 HG23 THR B 140 -20.929 3.879 -7.483 1.00 0.00 H new ATOM 947 N GLY B 141 -18.706 5.540 -9.585 1.00 0.00 N ATOM 948 CA GLY B 141 -18.235 5.763 -10.982 1.00 0.00 C ATOM 949 C GLY B 141 -18.249 4.441 -11.751 1.00 0.00 C ATOM 950 O GLY B 141 -18.967 3.521 -11.412 1.00 0.00 O ATOM 0 H GLY B 141 -18.658 4.575 -9.257 1.00 0.00 H new ATOM 0 HA2 GLY B 141 -18.876 6.491 -11.480 1.00 0.00 H new ATOM 0 HA3 GLY B 141 -17.227 6.179 -10.974 1.00 0.00 H new ATOM 954 N TYR B 142 -17.460 4.340 -12.786 1.00 0.00 N ATOM 955 CA TYR B 142 -17.426 3.079 -13.582 1.00 0.00 C ATOM 956 C TYR B 142 -15.977 2.615 -13.744 1.00 0.00 C ATOM 957 O TYR B 142 -15.175 3.271 -14.377 1.00 0.00 O ATOM 958 CB TYR B 142 -18.027 3.332 -14.965 1.00 0.00 C ATOM 959 CG TYR B 142 -19.444 3.829 -14.821 1.00 0.00 C ATOM 960 CD1 TYR B 142 -20.502 2.916 -14.762 1.00 0.00 C ATOM 961 CD2 TYR B 142 -19.699 5.203 -14.750 1.00 0.00 C ATOM 962 CE1 TYR B 142 -21.818 3.377 -14.630 1.00 0.00 C ATOM 963 CE2 TYR B 142 -21.013 5.666 -14.619 1.00 0.00 C ATOM 964 CZ TYR B 142 -22.074 4.752 -14.560 1.00 0.00 C ATOM 965 OH TYR B 142 -23.369 5.209 -14.432 1.00 0.00 O ATOM 0 H TYR B 142 -16.837 5.077 -13.115 1.00 0.00 H new ATOM 0 HA TYR B 142 -18.002 2.312 -13.065 1.00 0.00 H new ATOM 0 HB2 TYR B 142 -17.427 4.065 -15.504 1.00 0.00 H new ATOM 0 HB3 TYR B 142 -18.011 2.414 -15.552 1.00 0.00 H new ATOM 0 HD1 TYR B 142 -20.304 1.856 -14.818 1.00 0.00 H new ATOM 0 HD2 TYR B 142 -18.881 5.907 -14.796 1.00 0.00 H new ATOM 0 HE1 TYR B 142 -22.635 2.672 -14.582 1.00 0.00 H new ATOM 0 HE2 TYR B 142 -21.209 6.727 -14.563 1.00 0.00 H new ATOM 0 HH TYR B 142 -23.368 6.188 -14.397 1.00 0.00 H new ATOM 975 N ILE B 143 -15.635 1.486 -13.185 1.00 0.00 N ATOM 976 CA ILE B 143 -14.236 0.989 -13.321 1.00 0.00 C ATOM 977 C ILE B 143 -14.209 -0.226 -14.251 1.00 0.00 C ATOM 978 O ILE B 143 -15.216 -0.874 -14.457 1.00 0.00 O ATOM 979 CB ILE B 143 -13.688 0.578 -11.954 1.00 0.00 C ATOM 980 CG1 ILE B 143 -14.633 -0.441 -11.313 1.00 0.00 C ATOM 981 CG2 ILE B 143 -13.581 1.810 -11.054 1.00 0.00 C ATOM 982 CD1 ILE B 143 -13.866 -1.728 -11.006 1.00 0.00 C ATOM 0 H ILE B 143 -16.260 0.889 -12.643 1.00 0.00 H new ATOM 0 HA ILE B 143 -13.620 1.788 -13.734 1.00 0.00 H new ATOM 0 HB ILE B 143 -12.701 0.133 -12.077 1.00 0.00 H new ATOM 0 HG12 ILE B 143 -15.058 -0.032 -10.397 1.00 0.00 H new ATOM 0 HG13 ILE B 143 -15.465 -0.653 -11.984 1.00 0.00 H new ATOM 0 HG21 ILE B 143 -13.190 1.516 -10.080 1.00 0.00 H new ATOM 0 HG22 ILE B 143 -12.909 2.537 -11.510 1.00 0.00 H new ATOM 0 HG23 ILE B 143 -14.568 2.256 -10.930 1.00 0.00 H new ATOM 0 HD11 ILE B 143 -14.540 -2.453 -10.550 1.00 0.00 H new ATOM 0 HD12 ILE B 143 -13.462 -2.140 -11.931 1.00 0.00 H new ATOM 0 HD13 ILE B 143 -13.049 -1.509 -10.319 1.00 0.00 H new ATOM 994 N PRO B 144 -13.043 -0.501 -14.775 1.00 0.00 N ATOM 995 CA PRO B 144 -12.834 -1.643 -15.682 1.00 0.00 C ATOM 996 C PRO B 144 -13.251 -2.943 -14.991 1.00 0.00 C ATOM 997 O PRO B 144 -12.828 -3.232 -13.889 1.00 0.00 O ATOM 998 CB PRO B 144 -11.323 -1.645 -15.958 1.00 0.00 C ATOM 999 CG PRO B 144 -10.699 -0.472 -15.157 1.00 0.00 C ATOM 1000 CD PRO B 144 -11.840 0.307 -14.506 1.00 0.00 C ATOM 0 HA PRO B 144 -13.421 -1.565 -16.597 1.00 0.00 H new ATOM 0 HB2 PRO B 144 -10.880 -2.594 -15.656 1.00 0.00 H new ATOM 0 HB3 PRO B 144 -11.128 -1.527 -17.024 1.00 0.00 H new ATOM 0 HG2 PRO B 144 -10.013 -0.849 -14.399 1.00 0.00 H new ATOM 0 HG3 PRO B 144 -10.121 0.176 -15.816 1.00 0.00 H new ATOM 0 HD2 PRO B 144 -11.676 0.430 -13.435 1.00 0.00 H new ATOM 0 HD3 PRO B 144 -11.931 1.307 -14.931 1.00 0.00 H new ATOM 1008 N SER B 145 -14.076 -3.730 -15.622 1.00 0.00 N ATOM 1009 CA SER B 145 -14.512 -5.006 -14.995 1.00 0.00 C ATOM 1010 C SER B 145 -13.310 -5.946 -14.865 1.00 0.00 C ATOM 1011 O SER B 145 -13.218 -6.731 -13.941 1.00 0.00 O ATOM 1012 CB SER B 145 -15.579 -5.655 -15.873 1.00 0.00 C ATOM 1013 OG SER B 145 -14.951 -6.356 -16.937 1.00 0.00 O ATOM 0 H SER B 145 -14.467 -3.544 -16.545 1.00 0.00 H new ATOM 0 HA SER B 145 -14.924 -4.810 -14.005 1.00 0.00 H new ATOM 0 HB2 SER B 145 -16.187 -6.339 -15.281 1.00 0.00 H new ATOM 0 HB3 SER B 145 -16.251 -4.894 -16.270 1.00 0.00 H new ATOM 0 HG SER B 145 -15.184 -5.933 -17.790 1.00 0.00 H new ATOM 1019 N ASN B 146 -12.386 -5.872 -15.783 1.00 0.00 N ATOM 1020 CA ASN B 146 -11.190 -6.760 -15.716 1.00 0.00 C ATOM 1021 C ASN B 146 -10.251 -6.288 -14.604 1.00 0.00 C ATOM 1022 O ASN B 146 -9.209 -6.870 -14.370 1.00 0.00 O ATOM 1023 CB ASN B 146 -10.453 -6.717 -17.057 1.00 0.00 C ATOM 1024 CG ASN B 146 -9.809 -5.342 -17.244 1.00 0.00 C ATOM 1025 OD1 ASN B 146 -10.404 -4.332 -16.925 1.00 0.00 O ATOM 1026 ND2 ASN B 146 -8.611 -5.260 -17.753 1.00 0.00 N ATOM 0 H ASN B 146 -12.407 -5.234 -16.578 1.00 0.00 H new ATOM 0 HA ASN B 146 -11.511 -7.780 -15.504 1.00 0.00 H new ATOM 0 HB2 ASN B 146 -9.690 -7.495 -17.089 1.00 0.00 H new ATOM 0 HB3 ASN B 146 -11.148 -6.918 -17.872 1.00 0.00 H new ATOM 0 HD21 ASN B 146 -8.174 -4.348 -17.883 1.00 0.00 H new ATOM 0 HD22 ASN B 146 -8.112 -6.108 -18.021 1.00 0.00 H new ATOM 1033 N TYR B 147 -10.604 -5.237 -13.915 1.00 0.00 N ATOM 1034 CA TYR B 147 -9.723 -4.731 -12.824 1.00 0.00 C ATOM 1035 C TYR B 147 -10.333 -5.066 -11.461 1.00 0.00 C ATOM 1036 O TYR B 147 -9.917 -4.542 -10.446 1.00 0.00 O ATOM 1037 CB TYR B 147 -9.573 -3.213 -12.955 1.00 0.00 C ATOM 1038 CG TYR B 147 -8.174 -2.878 -13.417 1.00 0.00 C ATOM 1039 CD1 TYR B 147 -7.473 -3.775 -14.232 1.00 0.00 C ATOM 1040 CD2 TYR B 147 -7.579 -1.670 -13.033 1.00 0.00 C ATOM 1041 CE1 TYR B 147 -6.177 -3.467 -14.661 1.00 0.00 C ATOM 1042 CE2 TYR B 147 -6.282 -1.361 -13.463 1.00 0.00 C ATOM 1043 CZ TYR B 147 -5.581 -2.260 -14.276 1.00 0.00 C ATOM 1044 OH TYR B 147 -4.304 -1.957 -14.699 1.00 0.00 O ATOM 0 H TYR B 147 -11.464 -4.707 -14.060 1.00 0.00 H new ATOM 0 HA TYR B 147 -8.745 -5.206 -12.904 1.00 0.00 H new ATOM 0 HB2 TYR B 147 -10.304 -2.826 -13.665 1.00 0.00 H new ATOM 0 HB3 TYR B 147 -9.775 -2.734 -11.997 1.00 0.00 H new ATOM 0 HD1 TYR B 147 -7.933 -4.706 -14.530 1.00 0.00 H new ATOM 0 HD2 TYR B 147 -8.120 -0.977 -12.406 1.00 0.00 H new ATOM 0 HE1 TYR B 147 -5.637 -4.160 -15.289 1.00 0.00 H new ATOM 0 HE2 TYR B 147 -5.823 -0.429 -13.167 1.00 0.00 H new ATOM 0 HH TYR B 147 -4.041 -1.082 -14.344 1.00 0.00 H new ATOM 1054 N VAL B 148 -11.310 -5.931 -11.416 1.00 0.00 N ATOM 1055 CA VAL B 148 -11.922 -6.279 -10.101 1.00 0.00 C ATOM 1056 C VAL B 148 -12.161 -7.788 -10.019 1.00 0.00 C ATOM 1057 O VAL B 148 -12.320 -8.459 -11.020 1.00 0.00 O ATOM 1058 CB VAL B 148 -13.257 -5.547 -9.945 1.00 0.00 C ATOM 1059 CG1 VAL B 148 -13.008 -4.139 -9.399 1.00 0.00 C ATOM 1060 CG2 VAL B 148 -13.945 -5.452 -11.307 1.00 0.00 C ATOM 0 H VAL B 148 -11.708 -6.408 -12.225 1.00 0.00 H new ATOM 0 HA VAL B 148 -11.243 -5.977 -9.303 1.00 0.00 H new ATOM 0 HB VAL B 148 -13.894 -6.096 -9.252 1.00 0.00 H new ATOM 0 HG11 VAL B 148 -13.959 -3.618 -9.288 1.00 0.00 H new ATOM 0 HG12 VAL B 148 -12.516 -4.207 -8.429 1.00 0.00 H new ATOM 0 HG13 VAL B 148 -12.371 -3.588 -10.091 1.00 0.00 H new ATOM 0 HG21 VAL B 148 -14.896 -4.931 -11.199 1.00 0.00 H new ATOM 0 HG22 VAL B 148 -13.307 -4.903 -11.999 1.00 0.00 H new ATOM 0 HG23 VAL B 148 -14.123 -6.455 -11.696 1.00 0.00 H new ATOM 1070 N ALA B 149 -12.191 -8.325 -8.829 1.00 0.00 N ATOM 1071 CA ALA B 149 -12.423 -9.789 -8.672 1.00 0.00 C ATOM 1072 C ALA B 149 -13.070 -10.055 -7.309 1.00 0.00 C ATOM 1073 O ALA B 149 -12.974 -9.241 -6.413 1.00 0.00 O ATOM 1074 CB ALA B 149 -11.085 -10.527 -8.755 1.00 0.00 C ATOM 0 H ALA B 149 -12.064 -7.811 -7.957 1.00 0.00 H new ATOM 0 HA ALA B 149 -13.082 -10.143 -9.464 1.00 0.00 H new ATOM 0 HB1 ALA B 149 -11.252 -11.598 -8.640 1.00 0.00 H new ATOM 0 HB2 ALA B 149 -10.622 -10.334 -9.723 1.00 0.00 H new ATOM 0 HB3 ALA B 149 -10.426 -10.176 -7.961 1.00 0.00 H new ATOM 1080 N PRO B 150 -13.711 -11.191 -7.193 1.00 0.00 N ATOM 1081 CA PRO B 150 -14.385 -11.587 -5.942 1.00 0.00 C ATOM 1082 C PRO B 150 -13.368 -11.672 -4.800 1.00 0.00 C ATOM 1083 O PRO B 150 -12.228 -12.044 -4.997 1.00 0.00 O ATOM 1084 CB PRO B 150 -14.987 -12.967 -6.241 1.00 0.00 C ATOM 1085 CG PRO B 150 -14.628 -13.331 -7.705 1.00 0.00 C ATOM 1086 CD PRO B 150 -13.815 -12.166 -8.292 1.00 0.00 C ATOM 0 HA PRO B 150 -15.146 -10.871 -5.632 1.00 0.00 H new ATOM 0 HB2 PRO B 150 -14.591 -13.714 -5.553 1.00 0.00 H new ATOM 0 HB3 PRO B 150 -16.068 -12.950 -6.105 1.00 0.00 H new ATOM 0 HG2 PRO B 150 -14.051 -14.255 -7.738 1.00 0.00 H new ATOM 0 HG3 PRO B 150 -15.532 -13.499 -8.290 1.00 0.00 H new ATOM 0 HD2 PRO B 150 -12.830 -12.497 -8.622 1.00 0.00 H new ATOM 0 HD3 PRO B 150 -14.313 -11.733 -9.160 1.00 0.00 H new ATOM 1094 N VAL B 151 -13.770 -11.328 -3.607 1.00 0.00 N ATOM 1095 CA VAL B 151 -12.826 -11.386 -2.456 1.00 0.00 C ATOM 1096 C VAL B 151 -12.468 -12.843 -2.157 1.00 0.00 C ATOM 1097 O VAL B 151 -11.294 -13.118 -1.970 1.00 0.00 O ATOM 1098 CB VAL B 151 -13.483 -10.757 -1.226 1.00 0.00 C ATOM 1099 CG1 VAL B 151 -14.813 -11.457 -0.939 1.00 0.00 C ATOM 1100 CG2 VAL B 151 -12.555 -10.911 -0.018 1.00 0.00 C ATOM 0 H VAL B 151 -14.712 -11.009 -3.380 1.00 0.00 H new ATOM 0 HA VAL B 151 -11.918 -10.836 -2.704 1.00 0.00 H new ATOM 0 HB VAL B 151 -13.665 -9.699 -1.414 1.00 0.00 H new ATOM 0 HG11 VAL B 151 -15.279 -11.007 -0.062 1.00 0.00 H new ATOM 0 HG12 VAL B 151 -15.475 -11.347 -1.798 1.00 0.00 H new ATOM 0 HG13 VAL B 151 -14.634 -12.516 -0.752 1.00 0.00 H new ATOM 0 HG21 VAL B 151 -13.022 -10.463 0.859 1.00 0.00 H new ATOM 0 HG22 VAL B 151 -12.373 -11.969 0.168 1.00 0.00 H new ATOM 0 HG23 VAL B 151 -11.608 -10.410 -0.220 1.00 0.00 H new