USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 576 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 91 THR OG1 : rot 180:sc= -0.153 USER MOD Set 1.2: A 132 GLN : amide:sc= -0.318 X(o=-0.47,f=-0.86!) USER MOD Single : A 88 ASN : amide:sc= -2.04 X(o=-2,f=-2.5!) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= -0.476 K(o=-0.48,f=-3.4!) USER MOD Single : A 102 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 124 LYS NZ :NH3+ 141:sc= -0.694 (180deg=-1.36) USER MOD Single : A 127 SER OG : rot -3:sc= 0.615 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 TYR OH : rot 175:sc= 1.04 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -0.174 X(o=-0.17,f=-0.14) USER MOD Single : A 143 CYS SG : rot -165:sc= 0.506 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -116:sc= -1.2 (180deg=-3.45!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -8.751 13.512 -4.751 1.00 0.00 N ATOM 175 CA ASN A 88 -8.048 13.344 -6.017 1.00 0.00 C ATOM 176 C ASN A 88 -6.764 12.543 -5.824 1.00 0.00 C ATOM 177 O ASN A 88 -6.066 12.675 -4.819 1.00 0.00 O ATOM 178 CB ASN A 88 -7.725 14.709 -6.630 1.00 0.00 C ATOM 179 CG ASN A 88 -6.462 14.681 -7.469 1.00 0.00 C ATOM 180 OD1 ASN A 88 -6.506 14.404 -8.668 1.00 0.00 O ATOM 181 ND2 ASN A 88 -5.328 14.968 -6.841 1.00 0.00 N ATOM 0 HA ASN A 88 -8.699 12.794 -6.696 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.562 15.034 -7.248 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -7.613 15.445 -5.834 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.446 14.965 -7.354 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.339 15.192 -5.846 1.00 0.00 H new ATOM 188 N PRO A 89 -6.443 11.693 -6.811 1.00 0.00 N ATOM 189 CA PRO A 89 -5.241 10.855 -6.774 1.00 0.00 C ATOM 190 C PRO A 89 -3.961 11.670 -6.927 1.00 0.00 C ATOM 191 O PRO A 89 -3.965 12.745 -7.528 1.00 0.00 O ATOM 192 CB PRO A 89 -5.425 9.918 -7.970 1.00 0.00 C ATOM 193 CG PRO A 89 -6.312 10.666 -8.905 1.00 0.00 C ATOM 194 CD PRO A 89 -7.229 11.485 -8.039 1.00 0.00 C ATOM 0 HA PRO A 89 -5.135 10.336 -5.821 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.469 9.680 -8.437 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -5.876 8.973 -7.667 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.729 11.304 -9.569 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -6.879 9.982 -9.536 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.491 12.431 -8.513 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.163 10.961 -7.835 1.00 0.00 H new ATOM 202 N THR A 90 -2.866 11.152 -6.380 1.00 0.00 N ATOM 203 CA THR A 90 -1.579 11.831 -6.456 1.00 0.00 C ATOM 204 C THR A 90 -0.426 10.842 -6.329 1.00 0.00 C ATOM 205 O THR A 90 -0.570 9.779 -5.724 1.00 0.00 O ATOM 206 CB THR A 90 -1.444 12.903 -5.357 1.00 0.00 C ATOM 207 OG1 THR A 90 -0.281 13.703 -5.594 1.00 0.00 O ATOM 208 CG2 THR A 90 -1.352 12.259 -3.982 1.00 0.00 C ATOM 0 H THR A 90 -2.845 10.264 -5.879 1.00 0.00 H new ATOM 0 HA THR A 90 -1.534 12.313 -7.432 1.00 0.00 H new ATOM 0 HB THR A 90 -2.331 13.536 -5.386 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.203 14.383 -4.892 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.257 13.035 -3.222 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.252 11.674 -3.793 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.480 11.606 -3.944 1.00 0.00 H new ATOM 216 N THR A 91 0.719 11.198 -6.902 1.00 0.00 N ATOM 217 CA THR A 91 1.897 10.341 -6.853 1.00 0.00 C ATOM 218 C THR A 91 2.196 9.898 -5.426 1.00 0.00 C ATOM 219 O THR A 91 2.735 8.814 -5.202 1.00 0.00 O ATOM 220 CB THR A 91 3.136 11.055 -7.427 1.00 0.00 C ATOM 221 OG1 THR A 91 3.194 12.401 -6.942 1.00 0.00 O ATOM 222 CG2 THR A 91 3.101 11.060 -8.948 1.00 0.00 C ATOM 0 H THR A 91 0.856 12.074 -7.406 1.00 0.00 H new ATOM 0 HA THR A 91 1.676 9.465 -7.463 1.00 0.00 H new ATOM 0 HB THR A 91 4.024 10.513 -7.101 1.00 0.00 H new ATOM 0 HG1 THR A 91 3.985 12.847 -7.310 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.985 11.569 -9.331 1.00 0.00 H new ATOM 0 HG22 THR A 91 3.086 10.034 -9.315 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.206 11.581 -9.290 1.00 0.00 H new ATOM 230 N ARG A 92 1.842 10.743 -4.463 1.00 0.00 N ATOM 231 CA ARG A 92 2.073 10.438 -3.056 1.00 0.00 C ATOM 232 C ARG A 92 0.944 9.581 -2.493 1.00 0.00 C ATOM 233 O ARG A 92 -0.210 10.010 -2.442 1.00 0.00 O ATOM 234 CB ARG A 92 2.201 11.729 -2.246 1.00 0.00 C ATOM 235 CG ARG A 92 3.029 11.576 -0.981 1.00 0.00 C ATOM 236 CD ARG A 92 3.139 12.891 -0.225 1.00 0.00 C ATOM 237 NE ARG A 92 3.746 12.715 1.092 1.00 0.00 N ATOM 238 CZ ARG A 92 3.964 13.714 1.940 1.00 0.00 C ATOM 239 NH1 ARG A 92 3.626 14.953 1.610 1.00 0.00 N ATOM 240 NH2 ARG A 92 4.521 13.475 3.120 1.00 0.00 N ATOM 0 H ARG A 92 1.394 11.644 -4.631 1.00 0.00 H new ATOM 0 HA ARG A 92 3.004 9.877 -2.980 1.00 0.00 H new ATOM 0 HB2 ARG A 92 2.651 12.498 -2.874 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.204 12.079 -1.977 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.576 10.822 -0.337 1.00 0.00 H new ATOM 0 HG3 ARG A 92 4.026 11.218 -1.238 1.00 0.00 H new ATOM 0 HD2 ARG A 92 3.733 13.595 -0.807 1.00 0.00 H new ATOM 0 HD3 ARG A 92 2.147 13.328 -0.112 1.00 0.00 H new ATOM 0 HE ARG A 92 4.017 11.774 1.376 1.00 0.00 H new ATOM 0 HH11 ARG A 92 3.198 15.141 0.703 1.00 0.00 H new ATOM 0 HH12 ARG A 92 3.794 15.719 2.263 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.782 12.523 3.377 1.00 0.00 H new ATOM 0 HH22 ARG A 92 4.688 14.243 3.770 1.00 0.00 H new ATOM 254 N LEU A 93 1.282 8.367 -2.071 1.00 0.00 N ATOM 255 CA LEU A 93 0.297 7.449 -1.511 1.00 0.00 C ATOM 256 C LEU A 93 0.493 7.289 -0.007 1.00 0.00 C ATOM 257 O LEU A 93 1.622 7.280 0.483 1.00 0.00 O ATOM 258 CB LEU A 93 0.394 6.085 -2.198 1.00 0.00 C ATOM 259 CG LEU A 93 0.447 6.105 -3.726 1.00 0.00 C ATOM 260 CD1 LEU A 93 0.741 4.715 -4.268 1.00 0.00 C ATOM 261 CD2 LEU A 93 -0.859 6.638 -4.298 1.00 0.00 C ATOM 0 H LEU A 93 2.231 7.996 -2.106 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.694 7.868 -1.686 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.286 5.578 -1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -0.463 5.485 -1.892 1.00 0.00 H new ATOM 0 HG LEU A 93 1.253 6.770 -4.034 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.775 4.749 -5.357 1.00 0.00 H new ATOM 0 HD12 LEU A 93 1.702 4.371 -3.886 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -0.043 4.027 -3.951 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.803 6.645 -5.387 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -1.683 5.999 -3.981 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.027 7.652 -3.937 1.00 0.00 H new ATOM 273 N TRP A 94 -0.612 7.162 0.718 1.00 0.00 N ATOM 274 CA TRP A 94 -0.560 7.000 2.167 1.00 0.00 C ATOM 275 C TRP A 94 -0.873 5.561 2.565 1.00 0.00 C ATOM 276 O TRP A 94 -1.862 4.983 2.115 1.00 0.00 O ATOM 277 CB TRP A 94 -1.545 7.955 2.843 1.00 0.00 C ATOM 278 CG TRP A 94 -1.806 7.620 4.280 1.00 0.00 C ATOM 279 CD1 TRP A 94 -1.209 8.179 5.373 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.731 6.647 4.779 1.00 0.00 C ATOM 281 NE1 TRP A 94 -1.707 7.612 6.522 1.00 0.00 N ATOM 282 CE2 TRP A 94 -2.642 6.671 6.185 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.627 5.760 4.176 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -3.415 5.841 6.993 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.392 4.937 4.979 1.00 0.00 C ATOM 286 CH2 TRP A 94 -4.283 4.982 6.376 1.00 0.00 C ATOM 0 H TRP A 94 -1.554 7.168 0.327 1.00 0.00 H new ATOM 0 HA TRP A 94 0.451 7.237 2.499 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.156 8.971 2.779 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.488 7.939 2.297 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -0.456 8.953 5.340 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -1.425 7.854 7.472 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.720 5.719 3.101 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -3.332 5.874 8.069 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -5.086 4.247 4.523 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.896 4.326 6.977 1.00 0.00 H new ATOM 297 N VAL A 95 -0.023 4.989 3.412 1.00 0.00 N ATOM 298 CA VAL A 95 -0.210 3.618 3.872 1.00 0.00 C ATOM 299 C VAL A 95 -0.254 3.550 5.395 1.00 0.00 C ATOM 300 O VAL A 95 0.581 4.142 6.077 1.00 0.00 O ATOM 301 CB VAL A 95 0.913 2.696 3.360 1.00 0.00 C ATOM 302 CG1 VAL A 95 0.702 1.273 3.854 1.00 0.00 C ATOM 303 CG2 VAL A 95 0.984 2.737 1.842 1.00 0.00 C ATOM 0 H VAL A 95 0.801 5.453 3.793 1.00 0.00 H new ATOM 0 HA VAL A 95 -1.163 3.276 3.468 1.00 0.00 H new ATOM 0 HB VAL A 95 1.863 3.055 3.755 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.505 0.636 3.482 1.00 0.00 H new ATOM 0 HG12 VAL A 95 0.705 1.262 4.944 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.255 0.900 3.490 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.783 2.080 1.497 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.034 2.404 1.424 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.186 3.757 1.515 1.00 0.00 H new ATOM 313 N GLY A 96 -1.235 2.823 5.921 1.00 0.00 N ATOM 314 CA GLY A 96 -1.369 2.690 7.360 1.00 0.00 C ATOM 315 C GLY A 96 -1.607 1.256 7.791 1.00 0.00 C ATOM 316 O GLY A 96 -1.964 0.407 6.975 1.00 0.00 O ATOM 0 H GLY A 96 -1.939 2.324 5.377 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.466 3.066 7.842 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.196 3.311 7.704 1.00 0.00 H new ATOM 320 N GLY A 97 -1.408 0.985 9.077 1.00 0.00 N ATOM 321 CA GLY A 97 -1.606 -0.357 9.592 1.00 0.00 C ATOM 322 C GLY A 97 -0.344 -1.195 9.527 1.00 0.00 C ATOM 323 O GLY A 97 -0.397 -2.387 9.222 1.00 0.00 O ATOM 0 H GLY A 97 -1.113 1.671 9.772 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.947 -0.300 10.626 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.395 -0.849 9.023 1.00 0.00 H new ATOM 327 N LEU A 98 0.793 -0.571 9.812 1.00 0.00 N ATOM 328 CA LEU A 98 2.075 -1.267 9.783 1.00 0.00 C ATOM 329 C LEU A 98 2.674 -1.363 11.183 1.00 0.00 C ATOM 330 O LEU A 98 2.151 -0.786 12.134 1.00 0.00 O ATOM 331 CB LEU A 98 3.048 -0.546 8.848 1.00 0.00 C ATOM 332 CG LEU A 98 2.538 -0.270 7.433 1.00 0.00 C ATOM 333 CD1 LEU A 98 3.527 0.598 6.670 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.288 -1.575 6.692 1.00 0.00 C ATOM 0 H LEU A 98 0.854 0.415 10.066 1.00 0.00 H new ATOM 0 HA LEU A 98 1.904 -2.277 9.411 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.323 0.404 9.305 1.00 0.00 H new ATOM 0 HB3 LEU A 98 3.959 -1.141 8.775 1.00 0.00 H new ATOM 0 HG LEU A 98 1.593 0.269 7.506 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.148 0.784 5.665 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.656 1.547 7.191 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.487 0.086 6.606 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.926 -1.359 5.687 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.217 -2.141 6.629 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.542 -2.161 7.229 1.00 0.00 H new ATOM 346 N GLY A 99 3.778 -2.096 11.300 1.00 0.00 N ATOM 347 CA GLY A 99 4.432 -2.253 12.586 1.00 0.00 C ATOM 348 C GLY A 99 5.884 -2.664 12.452 1.00 0.00 C ATOM 349 O GLY A 99 6.457 -2.653 11.362 1.00 0.00 O ATOM 0 H GLY A 99 4.231 -2.584 10.527 1.00 0.00 H new ATOM 0 HA2 GLY A 99 4.373 -1.314 13.137 1.00 0.00 H new ATOM 0 HA3 GLY A 99 3.899 -3.001 13.172 1.00 0.00 H new ATOM 353 N PRO A 100 6.504 -3.037 13.581 1.00 0.00 N ATOM 354 CA PRO A 100 7.908 -3.460 13.611 1.00 0.00 C ATOM 355 C PRO A 100 8.121 -4.809 12.933 1.00 0.00 C ATOM 356 O PRO A 100 9.222 -5.119 12.481 1.00 0.00 O ATOM 357 CB PRO A 100 8.216 -3.558 15.107 1.00 0.00 C ATOM 358 CG PRO A 100 6.896 -3.807 15.751 1.00 0.00 C ATOM 359 CD PRO A 100 5.883 -3.074 14.916 1.00 0.00 C ATOM 0 HA PRO A 100 8.555 -2.767 13.073 1.00 0.00 H new ATOM 0 HB2 PRO A 100 8.916 -4.367 15.315 1.00 0.00 H new ATOM 0 HB3 PRO A 100 8.671 -2.640 15.478 1.00 0.00 H new ATOM 0 HG2 PRO A 100 6.674 -4.874 15.786 1.00 0.00 H new ATOM 0 HG3 PRO A 100 6.889 -3.446 16.779 1.00 0.00 H new ATOM 0 HD2 PRO A 100 4.925 -3.593 14.899 1.00 0.00 H new ATOM 0 HD3 PRO A 100 5.696 -2.071 15.300 1.00 0.00 H new ATOM 367 N ASN A 101 7.060 -5.607 12.867 1.00 0.00 N ATOM 368 CA ASN A 101 7.132 -6.923 12.244 1.00 0.00 C ATOM 369 C ASN A 101 7.288 -6.802 10.731 1.00 0.00 C ATOM 370 O ASN A 101 8.181 -7.406 10.136 1.00 0.00 O ATOM 371 CB ASN A 101 5.879 -7.736 12.575 1.00 0.00 C ATOM 372 CG ASN A 101 5.559 -7.728 14.057 1.00 0.00 C ATOM 373 OD1 ASN A 101 6.312 -7.181 14.863 1.00 0.00 O ATOM 374 ND2 ASN A 101 4.437 -8.338 14.424 1.00 0.00 N ATOM 0 H ASN A 101 6.141 -5.365 13.237 1.00 0.00 H new ATOM 0 HA ASN A 101 8.007 -7.438 12.641 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.031 -7.333 12.021 1.00 0.00 H new ATOM 0 HB3 ASN A 101 6.018 -8.764 12.242 1.00 0.00 H new ATOM 0 HD21 ASN A 101 4.170 -8.366 15.408 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.843 -8.778 13.722 1.00 0.00 H new ATOM 381 N THR A 102 6.413 -6.015 10.113 1.00 0.00 N ATOM 382 CA THR A 102 6.452 -5.813 8.670 1.00 0.00 C ATOM 383 C THR A 102 7.834 -5.356 8.216 1.00 0.00 C ATOM 384 O THR A 102 8.501 -4.586 8.906 1.00 0.00 O ATOM 385 CB THR A 102 5.407 -4.776 8.218 1.00 0.00 C ATOM 386 OG1 THR A 102 4.101 -5.177 8.649 1.00 0.00 O ATOM 387 CG2 THR A 102 5.421 -4.616 6.706 1.00 0.00 C ATOM 0 H THR A 102 5.668 -5.507 10.590 1.00 0.00 H new ATOM 0 HA THR A 102 6.220 -6.774 8.211 1.00 0.00 H new ATOM 0 HB THR A 102 5.660 -3.817 8.670 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.442 -4.512 8.359 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.674 -3.878 6.411 1.00 0.00 H new ATOM 0 HG22 THR A 102 6.408 -4.282 6.385 1.00 0.00 H new ATOM 0 HG23 THR A 102 5.191 -5.573 6.237 1.00 0.00 H new ATOM 395 N SER A 103 8.257 -5.835 7.051 1.00 0.00 N ATOM 396 CA SER A 103 9.562 -5.477 6.506 1.00 0.00 C ATOM 397 C SER A 103 9.422 -4.435 5.401 1.00 0.00 C ATOM 398 O SER A 103 8.707 -4.645 4.420 1.00 0.00 O ATOM 399 CB SER A 103 10.270 -6.720 5.964 1.00 0.00 C ATOM 400 OG SER A 103 10.640 -7.595 7.015 1.00 0.00 O ATOM 0 H SER A 103 7.716 -6.472 6.466 1.00 0.00 H new ATOM 0 HA SER A 103 10.160 -5.049 7.311 1.00 0.00 H new ATOM 0 HB2 SER A 103 9.614 -7.241 5.267 1.00 0.00 H new ATOM 0 HB3 SER A 103 11.157 -6.422 5.405 1.00 0.00 H new ATOM 0 HG SER A 103 11.089 -8.382 6.642 1.00 0.00 H new ATOM 406 N LEU A 104 10.109 -3.310 5.566 1.00 0.00 N ATOM 407 CA LEU A 104 10.062 -2.233 4.583 1.00 0.00 C ATOM 408 C LEU A 104 10.237 -2.778 3.170 1.00 0.00 C ATOM 409 O LEU A 104 9.407 -2.537 2.294 1.00 0.00 O ATOM 410 CB LEU A 104 11.148 -1.197 4.881 1.00 0.00 C ATOM 411 CG LEU A 104 10.996 0.154 4.182 1.00 0.00 C ATOM 412 CD1 LEU A 104 11.357 0.039 2.710 1.00 0.00 C ATOM 413 CD2 LEU A 104 9.577 0.681 4.345 1.00 0.00 C ATOM 0 H LEU A 104 10.705 -3.120 6.371 1.00 0.00 H new ATOM 0 HA LEU A 104 9.085 -1.755 4.650 1.00 0.00 H new ATOM 0 HB2 LEU A 104 11.173 -1.026 5.957 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.113 -1.621 4.603 1.00 0.00 H new ATOM 0 HG LEU A 104 11.682 0.861 4.648 1.00 0.00 H new ATOM 0 HD11 LEU A 104 11.242 1.011 2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 104 12.391 -0.294 2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.697 -0.683 2.229 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.486 1.643 3.841 1.00 0.00 H new ATOM 0 HD22 LEU A 104 8.874 -0.026 3.906 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.354 0.804 5.405 1.00 0.00 H new ATOM 425 N ALA A 105 11.322 -3.516 2.955 1.00 0.00 N ATOM 426 CA ALA A 105 11.603 -4.100 1.649 1.00 0.00 C ATOM 427 C ALA A 105 10.381 -4.826 1.098 1.00 0.00 C ATOM 428 O ALA A 105 9.895 -4.507 0.013 1.00 0.00 O ATOM 429 CB ALA A 105 12.788 -5.050 1.740 1.00 0.00 C ATOM 0 H ALA A 105 12.021 -3.723 3.669 1.00 0.00 H new ATOM 0 HA ALA A 105 11.852 -3.291 0.962 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.987 -5.479 0.758 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.667 -4.504 2.082 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.560 -5.849 2.446 1.00 0.00 H new ATOM 435 N ALA A 106 9.888 -5.803 1.852 1.00 0.00 N ATOM 436 CA ALA A 106 8.722 -6.573 1.438 1.00 0.00 C ATOM 437 C ALA A 106 7.692 -5.683 0.751 1.00 0.00 C ATOM 438 O ALA A 106 7.216 -5.996 -0.341 1.00 0.00 O ATOM 439 CB ALA A 106 8.101 -7.274 2.637 1.00 0.00 C ATOM 0 H ALA A 106 10.278 -6.080 2.753 1.00 0.00 H new ATOM 0 HA ALA A 106 9.049 -7.325 0.720 1.00 0.00 H new ATOM 0 HB1 ALA A 106 7.231 -7.846 2.314 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.832 -7.948 3.084 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.794 -6.532 3.374 1.00 0.00 H new ATOM 445 N LEU A 107 7.352 -4.573 1.396 1.00 0.00 N ATOM 446 CA LEU A 107 6.377 -3.637 0.847 1.00 0.00 C ATOM 447 C LEU A 107 6.930 -2.938 -0.390 1.00 0.00 C ATOM 448 O LEU A 107 6.362 -3.038 -1.478 1.00 0.00 O ATOM 449 CB LEU A 107 5.986 -2.600 1.901 1.00 0.00 C ATOM 450 CG LEU A 107 5.300 -3.142 3.155 1.00 0.00 C ATOM 451 CD1 LEU A 107 5.217 -2.066 4.227 1.00 0.00 C ATOM 452 CD2 LEU A 107 3.913 -3.670 2.818 1.00 0.00 C ATOM 0 H LEU A 107 7.737 -4.299 2.300 1.00 0.00 H new ATOM 0 HA LEU A 107 5.491 -4.202 0.557 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.885 -2.065 2.206 1.00 0.00 H new ATOM 0 HB3 LEU A 107 5.323 -1.871 1.435 1.00 0.00 H new ATOM 0 HG LEU A 107 5.897 -3.967 3.544 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.726 -2.471 5.112 1.00 0.00 H new ATOM 0 HD12 LEU A 107 6.222 -1.736 4.489 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.644 -1.219 3.849 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.439 -4.052 3.722 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.307 -2.864 2.404 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.997 -4.473 2.086 1.00 0.00 H new ATOM 464 N ALA A 108 8.043 -2.232 -0.217 1.00 0.00 N ATOM 465 CA ALA A 108 8.675 -1.521 -1.321 1.00 0.00 C ATOM 466 C ALA A 108 8.575 -2.317 -2.617 1.00 0.00 C ATOM 467 O ALA A 108 8.241 -1.771 -3.668 1.00 0.00 O ATOM 468 CB ALA A 108 10.131 -1.224 -0.992 1.00 0.00 C ATOM 0 H ALA A 108 8.525 -2.137 0.677 1.00 0.00 H new ATOM 0 HA ALA A 108 8.146 -0.579 -1.464 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.591 -0.693 -1.825 1.00 0.00 H new ATOM 0 HB2 ALA A 108 10.183 -0.607 -0.095 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.663 -2.160 -0.820 1.00 0.00 H new ATOM 474 N ARG A 109 8.868 -3.611 -2.535 1.00 0.00 N ATOM 475 CA ARG A 109 8.813 -4.482 -3.703 1.00 0.00 C ATOM 476 C ARG A 109 7.382 -4.613 -4.216 1.00 0.00 C ATOM 477 O ARG A 109 7.101 -4.324 -5.379 1.00 0.00 O ATOM 478 CB ARG A 109 9.372 -5.865 -3.361 1.00 0.00 C ATOM 479 CG ARG A 109 10.009 -6.574 -4.545 1.00 0.00 C ATOM 480 CD ARG A 109 8.963 -7.239 -5.425 1.00 0.00 C ATOM 481 NE ARG A 109 9.544 -7.789 -6.647 1.00 0.00 N ATOM 482 CZ ARG A 109 10.021 -7.040 -7.635 1.00 0.00 C ATOM 483 NH1 ARG A 109 9.985 -5.718 -7.546 1.00 0.00 N ATOM 484 NH2 ARG A 109 10.534 -7.614 -8.715 1.00 0.00 N ATOM 0 H ARG A 109 9.146 -4.079 -1.672 1.00 0.00 H new ATOM 0 HA ARG A 109 9.423 -4.035 -4.488 1.00 0.00 H new ATOM 0 HB2 ARG A 109 10.113 -5.762 -2.568 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.567 -6.486 -2.967 1.00 0.00 H new ATOM 0 HG2 ARG A 109 10.580 -5.857 -5.135 1.00 0.00 H new ATOM 0 HG3 ARG A 109 10.713 -7.324 -4.185 1.00 0.00 H new ATOM 0 HD2 ARG A 109 8.473 -8.036 -4.866 1.00 0.00 H new ATOM 0 HD3 ARG A 109 8.193 -6.512 -5.685 1.00 0.00 H new ATOM 0 HE ARG A 109 9.586 -8.803 -6.747 1.00 0.00 H new ATOM 0 HH11 ARG A 109 9.590 -5.273 -6.717 1.00 0.00 H new ATOM 0 HH12 ARG A 109 10.352 -5.145 -8.306 1.00 0.00 H new ATOM 0 HH21 ARG A 109 10.562 -8.631 -8.787 1.00 0.00 H new ATOM 0 HH22 ARG A 109 10.900 -7.038 -9.473 1.00 0.00 H new ATOM 498 N GLU A 110 6.483 -5.052 -3.341 1.00 0.00 N ATOM 499 CA GLU A 110 5.081 -5.222 -3.707 1.00 0.00 C ATOM 500 C GLU A 110 4.521 -3.944 -4.324 1.00 0.00 C ATOM 501 O GLU A 110 3.579 -3.984 -5.116 1.00 0.00 O ATOM 502 CB GLU A 110 4.255 -5.615 -2.481 1.00 0.00 C ATOM 503 CG GLU A 110 4.477 -7.050 -2.032 1.00 0.00 C ATOM 504 CD GLU A 110 3.658 -8.045 -2.831 1.00 0.00 C ATOM 505 OE1 GLU A 110 3.411 -7.786 -4.027 1.00 0.00 O ATOM 506 OE2 GLU A 110 3.263 -9.083 -2.258 1.00 0.00 O ATOM 0 H GLU A 110 6.700 -5.296 -2.375 1.00 0.00 H new ATOM 0 HA GLU A 110 5.019 -6.019 -4.448 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.500 -4.944 -1.658 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.198 -5.473 -2.705 1.00 0.00 H new ATOM 0 HG2 GLU A 110 5.534 -7.297 -2.126 1.00 0.00 H new ATOM 0 HG3 GLU A 110 4.222 -7.140 -0.976 1.00 0.00 H new ATOM 513 N PHE A 111 5.106 -2.810 -3.954 1.00 0.00 N ATOM 514 CA PHE A 111 4.665 -1.518 -4.468 1.00 0.00 C ATOM 515 C PHE A 111 5.417 -1.156 -5.746 1.00 0.00 C ATOM 516 O PHE A 111 4.903 -0.429 -6.596 1.00 0.00 O ATOM 517 CB PHE A 111 4.872 -0.428 -3.415 1.00 0.00 C ATOM 518 CG PHE A 111 3.714 -0.281 -2.469 1.00 0.00 C ATOM 519 CD1 PHE A 111 3.663 -1.018 -1.296 1.00 0.00 C ATOM 520 CD2 PHE A 111 2.678 0.594 -2.752 1.00 0.00 C ATOM 521 CE1 PHE A 111 2.599 -0.885 -0.425 1.00 0.00 C ATOM 522 CE2 PHE A 111 1.611 0.731 -1.884 1.00 0.00 C ATOM 523 CZ PHE A 111 1.572 -0.009 -0.718 1.00 0.00 C ATOM 0 H PHE A 111 5.887 -2.759 -3.300 1.00 0.00 H new ATOM 0 HA PHE A 111 3.603 -1.591 -4.700 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.772 -0.653 -2.843 1.00 0.00 H new ATOM 0 HB3 PHE A 111 5.043 0.524 -3.918 1.00 0.00 H new ATOM 0 HD1 PHE A 111 4.464 -1.703 -1.061 1.00 0.00 H new ATOM 0 HD2 PHE A 111 2.704 1.176 -3.661 1.00 0.00 H new ATOM 0 HE1 PHE A 111 2.570 -1.466 0.485 1.00 0.00 H new ATOM 0 HE2 PHE A 111 0.809 1.416 -2.117 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.740 0.097 -0.037 1.00 0.00 H new ATOM 533 N ASP A 112 6.636 -1.669 -5.873 1.00 0.00 N ATOM 534 CA ASP A 112 7.460 -1.400 -7.046 1.00 0.00 C ATOM 535 C ASP A 112 6.903 -2.112 -8.275 1.00 0.00 C ATOM 536 O ASP A 112 6.926 -1.571 -9.381 1.00 0.00 O ATOM 537 CB ASP A 112 8.902 -1.843 -6.795 1.00 0.00 C ATOM 538 CG ASP A 112 9.855 -1.342 -7.862 1.00 0.00 C ATOM 539 OD1 ASP A 112 9.729 -0.167 -8.267 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.729 -2.124 -8.291 1.00 0.00 O ATOM 0 H ASP A 112 7.075 -2.273 -5.178 1.00 0.00 H new ATOM 0 HA ASP A 112 7.445 -0.326 -7.232 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.227 -1.477 -5.821 1.00 0.00 H new ATOM 0 HB3 ASP A 112 8.943 -2.932 -6.757 1.00 0.00 H new ATOM 545 N ARG A 113 6.403 -3.327 -8.073 1.00 0.00 N ATOM 546 CA ARG A 113 5.843 -4.113 -9.166 1.00 0.00 C ATOM 547 C ARG A 113 5.002 -3.238 -10.090 1.00 0.00 C ATOM 548 O ARG A 113 4.954 -3.461 -11.300 1.00 0.00 O ATOM 549 CB ARG A 113 4.990 -5.257 -8.614 1.00 0.00 C ATOM 550 CG ARG A 113 3.630 -4.810 -8.102 1.00 0.00 C ATOM 551 CD ARG A 113 2.588 -4.819 -9.210 1.00 0.00 C ATOM 552 NE ARG A 113 1.923 -6.115 -9.326 1.00 0.00 N ATOM 553 CZ ARG A 113 1.038 -6.404 -10.273 1.00 0.00 C ATOM 554 NH1 ARG A 113 0.713 -5.495 -11.181 1.00 0.00 N ATOM 555 NH2 ARG A 113 0.476 -7.606 -10.312 1.00 0.00 N ATOM 0 H ARG A 113 6.374 -3.788 -7.164 1.00 0.00 H new ATOM 0 HA ARG A 113 6.670 -4.529 -9.742 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.847 -6.003 -9.396 1.00 0.00 H new ATOM 0 HB3 ARG A 113 5.532 -5.745 -7.804 1.00 0.00 H new ATOM 0 HG2 ARG A 113 3.310 -5.468 -7.294 1.00 0.00 H new ATOM 0 HG3 ARG A 113 3.709 -3.807 -7.683 1.00 0.00 H new ATOM 0 HD2 ARG A 113 1.844 -4.046 -9.015 1.00 0.00 H new ATOM 0 HD3 ARG A 113 3.065 -4.570 -10.158 1.00 0.00 H new ATOM 0 HE ARG A 113 2.151 -6.837 -8.642 1.00 0.00 H new ATOM 0 HH11 ARG A 113 1.143 -4.570 -11.154 1.00 0.00 H new ATOM 0 HH12 ARG A 113 0.033 -5.720 -11.907 1.00 0.00 H new ATOM 0 HH21 ARG A 113 0.724 -8.308 -9.615 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -0.204 -7.828 -11.039 1.00 0.00 H new ATOM 569 N PHE A 114 4.340 -2.241 -9.512 1.00 0.00 N ATOM 570 CA PHE A 114 3.500 -1.332 -10.284 1.00 0.00 C ATOM 571 C PHE A 114 4.351 -0.329 -11.057 1.00 0.00 C ATOM 572 O PHE A 114 4.217 -0.191 -12.272 1.00 0.00 O ATOM 573 CB PHE A 114 2.531 -0.592 -9.360 1.00 0.00 C ATOM 574 CG PHE A 114 1.605 -1.504 -8.607 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.395 -1.893 -9.159 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.944 -1.972 -7.349 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.459 -2.731 -8.468 1.00 0.00 C ATOM 578 CE2 PHE A 114 1.094 -2.812 -6.653 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.109 -3.192 -7.215 1.00 0.00 C ATOM 0 H PHE A 114 4.369 -2.042 -8.512 1.00 0.00 H new ATOM 0 HA PHE A 114 2.929 -1.923 -11.000 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.103 0.001 -8.647 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.939 0.106 -9.952 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.116 -1.537 -10.140 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.884 -1.678 -6.906 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.400 -3.025 -8.908 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.370 -3.170 -5.672 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.775 -3.849 -6.675 1.00 0.00 H new ATOM 589 N GLY A 115 5.227 0.371 -10.341 1.00 0.00 N ATOM 590 CA GLY A 115 6.086 1.353 -10.975 1.00 0.00 C ATOM 591 C GLY A 115 7.239 1.775 -10.087 1.00 0.00 C ATOM 592 O GLY A 115 7.134 1.734 -8.861 1.00 0.00 O ATOM 0 H GLY A 115 5.356 0.275 -9.334 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.479 0.941 -11.904 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.496 2.230 -11.240 1.00 0.00 H new ATOM 596 N SER A 116 8.344 2.178 -10.705 1.00 0.00 N ATOM 597 CA SER A 116 9.525 2.603 -9.962 1.00 0.00 C ATOM 598 C SER A 116 9.143 3.564 -8.840 1.00 0.00 C ATOM 599 O SER A 116 8.427 4.541 -9.061 1.00 0.00 O ATOM 600 CB SER A 116 10.531 3.272 -10.901 1.00 0.00 C ATOM 601 OG SER A 116 11.758 3.524 -10.237 1.00 0.00 O ATOM 0 H SER A 116 8.447 2.219 -11.719 1.00 0.00 H new ATOM 0 HA SER A 116 9.984 1.719 -9.520 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.707 2.633 -11.766 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.117 4.208 -11.275 1.00 0.00 H new ATOM 0 HG SER A 116 12.385 3.950 -10.858 1.00 0.00 H new ATOM 607 N ILE A 117 9.627 3.278 -7.635 1.00 0.00 N ATOM 608 CA ILE A 117 9.338 4.116 -6.478 1.00 0.00 C ATOM 609 C ILE A 117 10.475 5.097 -6.213 1.00 0.00 C ATOM 610 O ILE A 117 11.640 4.707 -6.137 1.00 0.00 O ATOM 611 CB ILE A 117 9.101 3.268 -5.214 1.00 0.00 C ATOM 612 CG1 ILE A 117 7.773 2.515 -5.321 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.118 4.150 -3.975 1.00 0.00 C ATOM 614 CD1 ILE A 117 7.632 1.395 -4.314 1.00 0.00 C ATOM 0 H ILE A 117 10.221 2.473 -7.435 1.00 0.00 H new ATOM 0 HA ILE A 117 8.429 4.671 -6.709 1.00 0.00 H new ATOM 0 HB ILE A 117 9.905 2.537 -5.127 1.00 0.00 H new ATOM 0 HG12 ILE A 117 6.953 3.220 -5.186 1.00 0.00 H new ATOM 0 HG13 ILE A 117 7.677 2.104 -6.326 1.00 0.00 H new ATOM 0 HG21 ILE A 117 8.949 3.537 -3.090 1.00 0.00 H new ATOM 0 HG22 ILE A 117 10.086 4.645 -3.894 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.331 4.901 -4.052 1.00 0.00 H new ATOM 0 HD11 ILE A 117 6.668 0.905 -4.447 1.00 0.00 H new ATOM 0 HD12 ILE A 117 8.431 0.669 -4.463 1.00 0.00 H new ATOM 0 HD13 ILE A 117 7.695 1.803 -3.305 1.00 0.00 H new ATOM 626 N ARG A 118 10.127 6.372 -6.070 1.00 0.00 N ATOM 627 CA ARG A 118 11.118 7.410 -5.812 1.00 0.00 C ATOM 628 C ARG A 118 11.773 7.209 -4.449 1.00 0.00 C ATOM 629 O ARG A 118 12.995 7.089 -4.346 1.00 0.00 O ATOM 630 CB ARG A 118 10.469 8.793 -5.879 1.00 0.00 C ATOM 631 CG ARG A 118 11.464 9.924 -6.080 1.00 0.00 C ATOM 632 CD ARG A 118 10.759 11.250 -6.322 1.00 0.00 C ATOM 633 NE ARG A 118 11.673 12.383 -6.214 1.00 0.00 N ATOM 634 CZ ARG A 118 11.273 13.650 -6.182 1.00 0.00 C ATOM 635 NH1 ARG A 118 9.982 13.942 -6.250 1.00 0.00 N ATOM 636 NH2 ARG A 118 12.166 14.626 -6.083 1.00 0.00 N ATOM 0 H ARG A 118 9.167 6.711 -6.128 1.00 0.00 H new ATOM 0 HA ARG A 118 11.888 7.341 -6.580 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.747 8.807 -6.695 1.00 0.00 H new ATOM 0 HB3 ARG A 118 9.913 8.969 -4.958 1.00 0.00 H new ATOM 0 HG2 ARG A 118 12.105 10.006 -5.202 1.00 0.00 H new ATOM 0 HG3 ARG A 118 12.111 9.695 -6.927 1.00 0.00 H new ATOM 0 HD2 ARG A 118 10.305 11.244 -7.313 1.00 0.00 H new ATOM 0 HD3 ARG A 118 9.950 11.367 -5.601 1.00 0.00 H new ATOM 0 HE ARG A 118 12.673 12.192 -6.160 1.00 0.00 H new ATOM 0 HH11 ARG A 118 9.293 13.194 -6.327 1.00 0.00 H new ATOM 0 HH12 ARG A 118 9.677 14.915 -6.225 1.00 0.00 H new ATOM 0 HH21 ARG A 118 13.160 14.404 -6.031 1.00 0.00 H new ATOM 0 HH22 ARG A 118 11.858 15.598 -6.059 1.00 0.00 H new ATOM 650 N THR A 119 10.953 7.173 -3.403 1.00 0.00 N ATOM 651 CA THR A 119 11.452 6.989 -2.046 1.00 0.00 C ATOM 652 C THR A 119 10.342 6.521 -1.111 1.00 0.00 C ATOM 653 O THR A 119 9.158 6.681 -1.410 1.00 0.00 O ATOM 654 CB THR A 119 12.062 8.289 -1.491 1.00 0.00 C ATOM 655 OG1 THR A 119 12.810 8.011 -0.302 1.00 0.00 O ATOM 656 CG2 THR A 119 10.976 9.309 -1.184 1.00 0.00 C ATOM 0 H THR A 119 9.940 7.269 -3.470 1.00 0.00 H new ATOM 0 HA THR A 119 12.228 6.225 -2.095 1.00 0.00 H new ATOM 0 HB THR A 119 12.726 8.705 -2.249 1.00 0.00 H new ATOM 0 HG1 THR A 119 13.196 8.843 0.044 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.431 10.219 -0.793 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.427 9.541 -2.096 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.291 8.899 -0.442 1.00 0.00 H new ATOM 664 N ILE A 120 10.732 5.945 0.020 1.00 0.00 N ATOM 665 CA ILE A 120 9.769 5.456 0.999 1.00 0.00 C ATOM 666 C ILE A 120 10.201 5.810 2.419 1.00 0.00 C ATOM 667 O ILE A 120 11.378 5.704 2.765 1.00 0.00 O ATOM 668 CB ILE A 120 9.586 3.930 0.896 1.00 0.00 C ATOM 669 CG1 ILE A 120 8.962 3.560 -0.452 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.725 3.421 2.042 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.002 2.077 -0.749 1.00 0.00 C ATOM 0 H ILE A 120 11.708 5.805 0.282 1.00 0.00 H new ATOM 0 HA ILE A 120 8.819 5.943 0.778 1.00 0.00 H new ATOM 0 HB ILE A 120 10.565 3.456 0.965 1.00 0.00 H new ATOM 0 HG12 ILE A 120 7.926 3.898 -0.469 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.485 4.095 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.605 2.341 1.955 1.00 0.00 H new ATOM 0 HG22 ILE A 120 9.206 3.657 2.991 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.746 3.899 2.002 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.543 1.888 -1.719 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.037 1.737 -0.765 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.454 1.536 0.023 1.00 0.00 H new ATOM 683 N ASP A 121 9.241 6.228 3.236 1.00 0.00 N ATOM 684 CA ASP A 121 9.521 6.594 4.619 1.00 0.00 C ATOM 685 C ASP A 121 9.562 5.357 5.512 1.00 0.00 C ATOM 686 O ASP A 121 8.688 4.493 5.433 1.00 0.00 O ATOM 687 CB ASP A 121 8.465 7.574 5.133 1.00 0.00 C ATOM 688 CG ASP A 121 9.001 8.486 6.219 1.00 0.00 C ATOM 689 OD1 ASP A 121 10.137 8.981 6.070 1.00 0.00 O ATOM 690 OD2 ASP A 121 8.284 8.704 7.219 1.00 0.00 O ATOM 0 H ASP A 121 8.262 6.322 2.965 1.00 0.00 H new ATOM 0 HA ASP A 121 10.499 7.075 4.651 1.00 0.00 H new ATOM 0 HB2 ASP A 121 8.100 8.178 4.303 1.00 0.00 H new ATOM 0 HB3 ASP A 121 7.613 7.015 5.520 1.00 0.00 H new ATOM 695 N HIS A 122 10.583 5.279 6.359 1.00 0.00 N ATOM 696 CA HIS A 122 10.739 4.147 7.266 1.00 0.00 C ATOM 697 C HIS A 122 10.441 4.559 8.704 1.00 0.00 C ATOM 698 O HIS A 122 11.169 5.355 9.296 1.00 0.00 O ATOM 699 CB HIS A 122 12.156 3.580 7.168 1.00 0.00 C ATOM 700 CG HIS A 122 12.517 2.673 8.305 1.00 0.00 C ATOM 701 ND1 HIS A 122 13.502 2.972 9.222 1.00 0.00 N ATOM 702 CD2 HIS A 122 12.017 1.469 8.670 1.00 0.00 C ATOM 703 CE1 HIS A 122 13.594 1.991 10.102 1.00 0.00 C ATOM 704 NE2 HIS A 122 12.703 1.066 9.789 1.00 0.00 N ATOM 0 H HIS A 122 11.315 5.986 6.437 1.00 0.00 H new ATOM 0 HA HIS A 122 10.026 3.376 6.973 1.00 0.00 H new ATOM 0 HB2 HIS A 122 12.256 3.032 6.231 1.00 0.00 H new ATOM 0 HB3 HIS A 122 12.867 4.405 7.132 1.00 0.00 H new ATOM 0 HD2 HIS A 122 11.226 0.927 8.174 1.00 0.00 H new ATOM 0 HE1 HIS A 122 14.280 1.951 10.935 1.00 0.00 H new ATOM 0 HE2 HIS A 122 12.550 0.194 10.296 1.00 0.00 H new ATOM 713 N VAL A 123 9.365 4.011 9.260 1.00 0.00 N ATOM 714 CA VAL A 123 8.970 4.321 10.629 1.00 0.00 C ATOM 715 C VAL A 123 7.935 3.326 11.142 1.00 0.00 C ATOM 716 O VAL A 123 6.879 3.143 10.535 1.00 0.00 O ATOM 717 CB VAL A 123 8.395 5.745 10.739 1.00 0.00 C ATOM 718 CG1 VAL A 123 7.046 5.832 10.041 1.00 0.00 C ATOM 719 CG2 VAL A 123 8.278 6.161 12.197 1.00 0.00 C ATOM 0 H VAL A 123 8.751 3.350 8.783 1.00 0.00 H new ATOM 0 HA VAL A 123 9.870 4.252 11.240 1.00 0.00 H new ATOM 0 HB VAL A 123 9.079 6.433 10.242 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.655 6.846 10.129 1.00 0.00 H new ATOM 0 HG12 VAL A 123 7.165 5.579 8.987 1.00 0.00 H new ATOM 0 HG13 VAL A 123 6.350 5.133 10.506 1.00 0.00 H new ATOM 0 HG21 VAL A 123 7.870 7.170 12.256 1.00 0.00 H new ATOM 0 HG22 VAL A 123 7.616 5.471 12.720 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.264 6.141 12.661 1.00 0.00 H new ATOM 729 N LYS A 124 8.244 2.683 12.263 1.00 0.00 N ATOM 730 CA LYS A 124 7.341 1.707 12.860 1.00 0.00 C ATOM 731 C LYS A 124 6.395 2.376 13.852 1.00 0.00 C ATOM 732 O LYS A 124 5.241 1.974 13.992 1.00 0.00 O ATOM 733 CB LYS A 124 8.139 0.607 13.563 1.00 0.00 C ATOM 734 CG LYS A 124 9.296 1.131 14.396 1.00 0.00 C ATOM 735 CD LYS A 124 10.573 1.225 13.579 1.00 0.00 C ATOM 736 CE LYS A 124 11.376 -0.065 13.650 1.00 0.00 C ATOM 737 NZ LYS A 124 10.852 -1.097 12.713 1.00 0.00 N ATOM 0 H LYS A 124 9.114 2.821 12.777 1.00 0.00 H new ATOM 0 HA LYS A 124 6.747 1.263 12.061 1.00 0.00 H new ATOM 0 HB2 LYS A 124 7.468 0.038 14.206 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.525 -0.085 12.814 1.00 0.00 H new ATOM 0 HG2 LYS A 124 9.044 2.114 14.793 1.00 0.00 H new ATOM 0 HG3 LYS A 124 9.457 0.474 15.251 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.326 1.445 12.540 1.00 0.00 H new ATOM 0 HD3 LYS A 124 11.180 2.053 13.944 1.00 0.00 H new ATOM 0 HE2 LYS A 124 12.420 0.143 13.414 1.00 0.00 H new ATOM 0 HE3 LYS A 124 11.351 -0.453 14.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 11.647 -1.612 12.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 10.248 -1.764 13.234 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 10.294 -0.636 11.966 1.00 0.00 H new ATOM 751 N GLY A 125 6.892 3.401 14.537 1.00 0.00 N ATOM 752 CA GLY A 125 6.076 4.111 15.506 1.00 0.00 C ATOM 753 C GLY A 125 4.854 4.750 14.878 1.00 0.00 C ATOM 754 O GLY A 125 3.723 4.361 15.169 1.00 0.00 O ATOM 0 H GLY A 125 7.844 3.753 14.439 1.00 0.00 H new ATOM 0 HA2 GLY A 125 5.760 3.419 16.286 1.00 0.00 H new ATOM 0 HA3 GLY A 125 6.678 4.881 15.988 1.00 0.00 H new ATOM 758 N ASP A 126 5.080 5.734 14.015 1.00 0.00 N ATOM 759 CA ASP A 126 3.988 6.429 13.344 1.00 0.00 C ATOM 760 C ASP A 126 2.927 5.442 12.866 1.00 0.00 C ATOM 761 O ASP A 126 1.736 5.753 12.855 1.00 0.00 O ATOM 762 CB ASP A 126 4.520 7.238 12.160 1.00 0.00 C ATOM 763 CG ASP A 126 5.560 8.259 12.577 1.00 0.00 C ATOM 764 OD1 ASP A 126 6.121 8.118 13.684 1.00 0.00 O ATOM 765 OD2 ASP A 126 5.814 9.200 11.796 1.00 0.00 O ATOM 0 H ASP A 126 6.010 6.069 13.763 1.00 0.00 H new ATOM 0 HA ASP A 126 3.529 7.109 14.061 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.955 6.559 11.426 1.00 0.00 H new ATOM 0 HB3 ASP A 126 3.690 7.748 11.670 1.00 0.00 H new ATOM 770 N SER A 127 3.369 4.252 12.472 1.00 0.00 N ATOM 771 CA SER A 127 2.459 3.221 11.988 1.00 0.00 C ATOM 772 C SER A 127 1.918 3.578 10.607 1.00 0.00 C ATOM 773 O SER A 127 0.839 3.132 10.216 1.00 0.00 O ATOM 774 CB SER A 127 1.300 3.033 12.969 1.00 0.00 C ATOM 775 OG SER A 127 1.750 3.106 14.311 1.00 0.00 O ATOM 0 H SER A 127 4.352 3.978 12.479 1.00 0.00 H new ATOM 0 HA SER A 127 3.016 2.287 11.911 1.00 0.00 H new ATOM 0 HB2 SER A 127 0.544 3.798 12.794 1.00 0.00 H new ATOM 0 HB3 SER A 127 0.824 2.068 12.794 1.00 0.00 H new ATOM 0 HG SER A 127 2.725 3.209 14.324 1.00 0.00 H new ATOM 781 N PHE A 128 2.676 4.385 9.872 1.00 0.00 N ATOM 782 CA PHE A 128 2.274 4.804 8.535 1.00 0.00 C ATOM 783 C PHE A 128 3.463 5.364 7.760 1.00 0.00 C ATOM 784 O PHE A 128 4.421 5.864 8.348 1.00 0.00 O ATOM 785 CB PHE A 128 1.164 5.855 8.618 1.00 0.00 C ATOM 786 CG PHE A 128 1.574 7.103 9.346 1.00 0.00 C ATOM 787 CD1 PHE A 128 2.534 7.949 8.812 1.00 0.00 C ATOM 788 CD2 PHE A 128 1.001 7.431 10.564 1.00 0.00 C ATOM 789 CE1 PHE A 128 2.913 9.098 9.479 1.00 0.00 C ATOM 790 CE2 PHE A 128 1.376 8.579 11.235 1.00 0.00 C ATOM 791 CZ PHE A 128 2.334 9.413 10.693 1.00 0.00 C ATOM 0 H PHE A 128 3.572 4.762 10.180 1.00 0.00 H new ATOM 0 HA PHE A 128 1.897 3.929 8.006 1.00 0.00 H new ATOM 0 HB2 PHE A 128 0.849 6.120 7.609 1.00 0.00 H new ATOM 0 HB3 PHE A 128 0.299 5.420 9.118 1.00 0.00 H new ATOM 0 HD1 PHE A 128 2.991 7.707 7.864 1.00 0.00 H new ATOM 0 HD2 PHE A 128 0.253 6.782 10.994 1.00 0.00 H new ATOM 0 HE1 PHE A 128 3.661 9.749 9.052 1.00 0.00 H new ATOM 0 HE2 PHE A 128 0.920 8.824 12.183 1.00 0.00 H new ATOM 0 HZ PHE A 128 2.630 10.310 11.217 1.00 0.00 H new ATOM 801 N ALA A 129 3.393 5.276 6.435 1.00 0.00 N ATOM 802 CA ALA A 129 4.462 5.775 5.579 1.00 0.00 C ATOM 803 C ALA A 129 3.902 6.367 4.290 1.00 0.00 C ATOM 804 O ALA A 129 2.735 6.160 3.956 1.00 0.00 O ATOM 805 CB ALA A 129 5.450 4.661 5.265 1.00 0.00 C ATOM 0 H ALA A 129 2.607 4.864 5.932 1.00 0.00 H new ATOM 0 HA ALA A 129 4.983 6.568 6.115 1.00 0.00 H new ATOM 0 HB1 ALA A 129 6.243 5.048 4.625 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.883 4.286 6.193 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.933 3.850 4.752 1.00 0.00 H new ATOM 811 N TYR A 130 4.740 7.104 3.570 1.00 0.00 N ATOM 812 CA TYR A 130 4.327 7.728 2.318 1.00 0.00 C ATOM 813 C TYR A 130 5.178 7.229 1.154 1.00 0.00 C ATOM 814 O TYR A 130 6.398 7.395 1.147 1.00 0.00 O ATOM 815 CB TYR A 130 4.431 9.250 2.425 1.00 0.00 C ATOM 816 CG TYR A 130 3.396 9.865 3.340 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.111 10.135 2.886 1.00 0.00 C ATOM 818 CD2 TYR A 130 3.703 10.176 4.659 1.00 0.00 C ATOM 819 CE1 TYR A 130 1.162 10.697 3.718 1.00 0.00 C ATOM 820 CE2 TYR A 130 2.760 10.737 5.499 1.00 0.00 C ATOM 821 CZ TYR A 130 1.491 10.996 5.023 1.00 0.00 C ATOM 822 OH TYR A 130 0.549 11.555 5.856 1.00 0.00 O ATOM 0 H TYR A 130 5.709 7.284 3.831 1.00 0.00 H new ATOM 0 HA TYR A 130 3.289 7.454 2.129 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.425 9.513 2.786 1.00 0.00 H new ATOM 0 HB3 TYR A 130 4.328 9.684 1.430 1.00 0.00 H new ATOM 0 HD1 TYR A 130 1.849 9.901 1.865 1.00 0.00 H new ATOM 0 HD2 TYR A 130 4.696 9.976 5.034 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.168 10.901 3.348 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.015 10.971 6.522 1.00 0.00 H new ATOM 0 HH TYR A 130 0.942 11.702 6.742 1.00 0.00 H new ATOM 832 N ILE A 131 4.524 6.619 0.171 1.00 0.00 N ATOM 833 CA ILE A 131 5.219 6.098 -0.999 1.00 0.00 C ATOM 834 C ILE A 131 5.006 6.999 -2.211 1.00 0.00 C ATOM 835 O ILE A 131 3.872 7.310 -2.574 1.00 0.00 O ATOM 836 CB ILE A 131 4.749 4.673 -1.344 1.00 0.00 C ATOM 837 CG1 ILE A 131 4.929 3.747 -0.139 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.514 4.139 -2.547 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.469 2.328 -0.393 1.00 0.00 C ATOM 0 H ILE A 131 3.514 6.474 0.162 1.00 0.00 H new ATOM 0 HA ILE A 131 6.280 6.072 -0.751 1.00 0.00 H new ATOM 0 HB ILE A 131 3.689 4.708 -1.597 1.00 0.00 H new ATOM 0 HG12 ILE A 131 5.981 3.734 0.145 1.00 0.00 H new ATOM 0 HG13 ILE A 131 4.376 4.154 0.707 1.00 0.00 H new ATOM 0 HG21 ILE A 131 5.170 3.131 -2.778 1.00 0.00 H new ATOM 0 HG22 ILE A 131 5.340 4.788 -3.406 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.580 4.116 -2.319 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.626 1.729 0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.409 2.329 -0.647 1.00 0.00 H new ATOM 0 HD13 ILE A 131 5.040 1.903 -1.219 1.00 0.00 H new ATOM 851 N GLN A 132 6.105 7.413 -2.834 1.00 0.00 N ATOM 852 CA GLN A 132 6.038 8.277 -4.006 1.00 0.00 C ATOM 853 C GLN A 132 6.296 7.483 -5.283 1.00 0.00 C ATOM 854 O GLN A 132 7.025 6.492 -5.273 1.00 0.00 O ATOM 855 CB GLN A 132 7.053 9.415 -3.886 1.00 0.00 C ATOM 856 CG GLN A 132 6.834 10.535 -4.890 1.00 0.00 C ATOM 857 CD GLN A 132 5.892 11.605 -4.375 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.546 11.627 -3.193 1.00 0.00 O ATOM 859 NE2 GLN A 132 5.470 12.499 -5.261 1.00 0.00 N ATOM 0 H GLN A 132 7.051 7.164 -2.547 1.00 0.00 H new ATOM 0 HA GLN A 132 5.034 8.699 -4.058 1.00 0.00 H new ATOM 0 HB2 GLN A 132 7.006 9.828 -2.878 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.057 9.011 -4.018 1.00 0.00 H new ATOM 0 HG2 GLN A 132 7.794 10.989 -5.137 1.00 0.00 H new ATOM 0 HG3 GLN A 132 6.433 10.117 -5.813 1.00 0.00 H new ATOM 0 HE21 GLN A 132 5.782 12.443 -6.230 1.00 0.00 H new ATOM 0 HE22 GLN A 132 4.834 13.242 -4.972 1.00 0.00 H new ATOM 868 N TYR A 133 5.692 7.926 -6.380 1.00 0.00 N ATOM 869 CA TYR A 133 5.854 7.255 -7.665 1.00 0.00 C ATOM 870 C TYR A 133 6.310 8.238 -8.739 1.00 0.00 C ATOM 871 O TYR A 133 6.011 9.430 -8.672 1.00 0.00 O ATOM 872 CB TYR A 133 4.541 6.594 -8.087 1.00 0.00 C ATOM 873 CG TYR A 133 4.308 5.246 -7.444 1.00 0.00 C ATOM 874 CD1 TYR A 133 3.761 5.147 -6.170 1.00 0.00 C ATOM 875 CD2 TYR A 133 4.633 4.071 -8.110 1.00 0.00 C ATOM 876 CE1 TYR A 133 3.547 3.917 -5.579 1.00 0.00 C ATOM 877 CE2 TYR A 133 4.421 2.836 -7.527 1.00 0.00 C ATOM 878 CZ TYR A 133 3.878 2.765 -6.261 1.00 0.00 C ATOM 879 OH TYR A 133 3.665 1.538 -5.675 1.00 0.00 O ATOM 0 H TYR A 133 5.086 8.746 -6.406 1.00 0.00 H new ATOM 0 HA TYR A 133 6.620 6.488 -7.552 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.713 7.256 -7.834 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.535 6.476 -9.171 1.00 0.00 H new ATOM 0 HD1 TYR A 133 3.499 6.047 -5.633 1.00 0.00 H new ATOM 0 HD2 TYR A 133 5.059 4.124 -9.101 1.00 0.00 H new ATOM 0 HE1 TYR A 133 3.123 3.858 -4.588 1.00 0.00 H new ATOM 0 HE2 TYR A 133 4.679 1.932 -8.059 1.00 0.00 H new ATOM 0 HH TYR A 133 3.876 0.828 -6.317 1.00 0.00 H new ATOM 889 N GLU A 134 7.036 7.728 -9.729 1.00 0.00 N ATOM 890 CA GLU A 134 7.534 8.560 -10.818 1.00 0.00 C ATOM 891 C GLU A 134 6.380 9.183 -11.598 1.00 0.00 C ATOM 892 O GLU A 134 6.513 10.268 -12.164 1.00 0.00 O ATOM 893 CB GLU A 134 8.414 7.735 -11.759 1.00 0.00 C ATOM 894 CG GLU A 134 9.797 7.445 -11.201 1.00 0.00 C ATOM 895 CD GLU A 134 10.798 8.537 -11.525 1.00 0.00 C ATOM 896 OE1 GLU A 134 10.789 9.027 -12.674 1.00 0.00 O ATOM 897 OE2 GLU A 134 11.590 8.901 -10.631 1.00 0.00 O ATOM 0 H GLU A 134 7.292 6.743 -9.799 1.00 0.00 H new ATOM 0 HA GLU A 134 8.131 9.362 -10.384 1.00 0.00 H new ATOM 0 HB2 GLU A 134 7.914 6.791 -11.976 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.517 8.266 -12.705 1.00 0.00 H new ATOM 0 HG2 GLU A 134 9.731 7.327 -10.119 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.156 6.498 -11.603 1.00 0.00 H new ATOM 904 N SER A 135 5.248 8.487 -11.625 1.00 0.00 N ATOM 905 CA SER A 135 4.071 8.968 -12.339 1.00 0.00 C ATOM 906 C SER A 135 2.812 8.786 -11.497 1.00 0.00 C ATOM 907 O SER A 135 2.737 7.889 -10.656 1.00 0.00 O ATOM 908 CB SER A 135 3.919 8.229 -13.670 1.00 0.00 C ATOM 909 OG SER A 135 3.278 9.045 -14.636 1.00 0.00 O ATOM 0 H SER A 135 5.121 7.588 -11.161 1.00 0.00 H new ATOM 0 HA SER A 135 4.205 10.032 -12.535 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.900 7.928 -14.037 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.342 7.317 -13.519 1.00 0.00 H new ATOM 0 HG SER A 135 3.194 8.551 -15.478 1.00 0.00 H new ATOM 915 N LEU A 136 1.825 9.644 -11.729 1.00 0.00 N ATOM 916 CA LEU A 136 0.567 9.580 -10.992 1.00 0.00 C ATOM 917 C LEU A 136 -0.203 8.310 -11.339 1.00 0.00 C ATOM 918 O LEU A 136 -0.812 7.685 -10.471 1.00 0.00 O ATOM 919 CB LEU A 136 -0.290 10.810 -11.298 1.00 0.00 C ATOM 920 CG LEU A 136 -1.439 11.086 -10.329 1.00 0.00 C ATOM 921 CD1 LEU A 136 -2.057 12.447 -10.606 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.492 9.991 -10.425 1.00 0.00 C ATOM 0 H LEU A 136 1.871 10.392 -12.421 1.00 0.00 H new ATOM 0 HA LEU A 136 0.799 9.563 -9.927 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.360 11.685 -11.318 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.705 10.699 -12.300 1.00 0.00 H new ATOM 0 HG LEU A 136 -1.039 11.091 -9.315 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.873 12.625 -9.906 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -1.300 13.222 -10.485 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -2.442 12.471 -11.626 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.303 10.204 -9.728 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.887 9.954 -11.440 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -2.042 9.030 -10.175 1.00 0.00 H new ATOM 934 N ASP A 137 -0.170 7.934 -12.612 1.00 0.00 N ATOM 935 CA ASP A 137 -0.862 6.736 -13.074 1.00 0.00 C ATOM 936 C ASP A 137 -0.488 5.529 -12.220 1.00 0.00 C ATOM 937 O ASP A 137 -1.327 4.972 -11.514 1.00 0.00 O ATOM 938 CB ASP A 137 -0.528 6.462 -14.541 1.00 0.00 C ATOM 939 CG ASP A 137 -0.425 7.734 -15.359 1.00 0.00 C ATOM 940 OD1 ASP A 137 -1.252 8.645 -15.147 1.00 0.00 O ATOM 941 OD2 ASP A 137 0.484 7.819 -16.212 1.00 0.00 O ATOM 0 H ASP A 137 0.329 8.441 -13.343 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.934 6.907 -12.980 1.00 0.00 H new ATOM 0 HB2 ASP A 137 0.415 5.918 -14.600 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -1.295 5.818 -14.971 1.00 0.00 H new ATOM 946 N ALA A 138 0.778 5.130 -12.291 1.00 0.00 N ATOM 947 CA ALA A 138 1.263 3.989 -11.524 1.00 0.00 C ATOM 948 C ALA A 138 0.782 4.055 -10.078 1.00 0.00 C ATOM 949 O ALA A 138 0.331 3.057 -9.518 1.00 0.00 O ATOM 950 CB ALA A 138 2.783 3.928 -11.574 1.00 0.00 C ATOM 0 H ALA A 138 1.486 5.580 -12.872 1.00 0.00 H new ATOM 0 HA ALA A 138 0.858 3.082 -11.973 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.132 3.071 -10.997 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.109 3.826 -12.609 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.198 4.843 -11.152 1.00 0.00 H new ATOM 956 N ALA A 139 0.882 5.237 -9.480 1.00 0.00 N ATOM 957 CA ALA A 139 0.456 5.433 -8.100 1.00 0.00 C ATOM 958 C ALA A 139 -0.982 4.967 -7.898 1.00 0.00 C ATOM 959 O ALA A 139 -1.293 4.296 -6.914 1.00 0.00 O ATOM 960 CB ALA A 139 0.599 6.896 -7.706 1.00 0.00 C ATOM 0 H ALA A 139 1.254 6.074 -9.929 1.00 0.00 H new ATOM 0 HA ALA A 139 1.099 4.831 -7.458 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.277 7.028 -6.673 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.642 7.199 -7.803 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -0.019 7.511 -8.360 1.00 0.00 H new ATOM 966 N GLN A 140 -1.853 5.327 -8.834 1.00 0.00 N ATOM 967 CA GLN A 140 -3.258 4.946 -8.757 1.00 0.00 C ATOM 968 C GLN A 140 -3.414 3.430 -8.803 1.00 0.00 C ATOM 969 O GLN A 140 -4.035 2.833 -7.924 1.00 0.00 O ATOM 970 CB GLN A 140 -4.046 5.586 -9.902 1.00 0.00 C ATOM 971 CG GLN A 140 -4.441 7.030 -9.635 1.00 0.00 C ATOM 972 CD GLN A 140 -5.668 7.453 -10.418 1.00 0.00 C ATOM 973 OE1 GLN A 140 -5.624 8.407 -11.196 1.00 0.00 O ATOM 974 NE2 GLN A 140 -6.772 6.744 -10.218 1.00 0.00 N ATOM 0 H GLN A 140 -1.611 5.882 -9.655 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.654 5.306 -7.807 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.448 5.544 -10.812 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -4.946 4.999 -10.085 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -4.632 7.160 -8.570 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.608 7.684 -9.891 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.764 5.961 -9.564 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -7.628 6.982 -10.718 1.00 0.00 H new ATOM 983 N ALA A 141 -2.846 2.812 -9.834 1.00 0.00 N ATOM 984 CA ALA A 141 -2.921 1.365 -9.993 1.00 0.00 C ATOM 985 C ALA A 141 -2.587 0.651 -8.687 1.00 0.00 C ATOM 986 O ALA A 141 -3.348 -0.196 -8.221 1.00 0.00 O ATOM 987 CB ALA A 141 -1.985 0.907 -11.101 1.00 0.00 C ATOM 0 H ALA A 141 -2.329 3.291 -10.571 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.944 1.107 -10.266 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -2.051 -0.176 -11.209 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.271 1.383 -12.039 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.961 1.185 -10.850 1.00 0.00 H new ATOM 993 N ALA A 142 -1.446 0.999 -8.103 1.00 0.00 N ATOM 994 CA ALA A 142 -1.012 0.392 -6.851 1.00 0.00 C ATOM 995 C ALA A 142 -1.941 0.778 -5.704 1.00 0.00 C ATOM 996 O ALA A 142 -2.235 -0.038 -4.830 1.00 0.00 O ATOM 997 CB ALA A 142 0.419 0.801 -6.534 1.00 0.00 C ATOM 0 H ALA A 142 -0.805 1.699 -8.477 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.051 -0.691 -6.968 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.730 0.340 -5.596 1.00 0.00 H new ATOM 0 HB2 ALA A 142 1.078 0.470 -7.337 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.475 1.886 -6.442 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.398 2.025 -5.713 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.293 2.519 -4.672 1.00 0.00 C ATOM 1005 C CYS A 143 -4.534 1.639 -4.559 1.00 0.00 C ATOM 1006 O CYS A 143 -4.884 1.179 -3.473 1.00 0.00 O ATOM 1007 CB CYS A 143 -3.701 3.963 -4.964 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.657 4.742 -3.642 1.00 0.00 S ATOM 0 H CYS A 143 -2.164 2.713 -6.429 1.00 0.00 H new ATOM 0 HA CYS A 143 -2.759 2.486 -3.722 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -2.803 4.554 -5.145 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.287 3.985 -5.883 1.00 0.00 H new ATOM 0 HG CYS A 143 -5.227 5.819 -4.095 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.196 1.412 -5.689 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.398 0.588 -5.717 1.00 0.00 C ATOM 1016 C ALA A 144 -6.065 -0.877 -5.457 1.00 0.00 C ATOM 1017 O ALA A 144 -6.574 -1.482 -4.513 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.111 0.741 -7.053 1.00 0.00 C ATOM 0 H ALA A 144 -4.920 1.787 -6.597 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.062 0.929 -4.922 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -8.007 0.120 -7.060 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.391 1.784 -7.199 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.446 0.428 -7.858 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.210 -1.443 -6.301 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.808 -2.838 -6.163 1.00 0.00 C ATOM 1026 C LYS A 145 -4.438 -3.157 -4.718 1.00 0.00 C ATOM 1027 O LYS A 145 -5.052 -4.017 -4.086 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.623 -3.143 -7.083 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.034 -3.618 -8.466 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.404 -2.453 -9.369 1.00 0.00 C ATOM 1031 CE LYS A 145 -5.096 -2.929 -10.637 1.00 0.00 C ATOM 1032 NZ LYS A 145 -5.257 -1.829 -11.627 1.00 0.00 N ATOM 0 H LYS A 145 -4.781 -0.957 -7.089 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.653 -3.463 -6.450 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -3.011 -2.247 -7.183 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -2.998 -3.905 -6.617 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.217 -4.183 -8.915 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -4.882 -4.297 -8.381 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.059 -1.768 -8.831 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.505 -1.895 -9.631 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -4.519 -3.738 -11.084 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -6.075 -3.337 -10.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -5.733 -2.194 -12.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -5.829 -1.067 -11.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -4.322 -1.456 -11.887 1.00 0.00 H new ATOM 1046 N MET A 146 -3.432 -2.459 -4.201 1.00 0.00 N ATOM 1047 CA MET A 146 -2.983 -2.667 -2.829 1.00 0.00 C ATOM 1048 C MET A 146 -4.147 -2.537 -1.851 1.00 0.00 C ATOM 1049 O MET A 146 -4.270 -3.322 -0.911 1.00 0.00 O ATOM 1050 CB MET A 146 -1.886 -1.663 -2.471 1.00 0.00 C ATOM 1051 CG MET A 146 -0.582 -1.897 -3.216 1.00 0.00 C ATOM 1052 SD MET A 146 0.077 -3.556 -2.958 1.00 0.00 S ATOM 1053 CE MET A 146 0.469 -3.496 -1.211 1.00 0.00 C ATOM 0 H MET A 146 -2.912 -1.745 -4.711 1.00 0.00 H new ATOM 0 HA MET A 146 -2.579 -3.677 -2.754 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.242 -0.656 -2.686 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.696 -1.712 -1.399 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.743 -1.736 -4.282 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.155 -1.163 -2.890 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.545 -3.603 -1.076 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.144 -2.541 -0.798 1.00 0.00 H new ATOM 0 HE3 MET A 146 -0.044 -4.308 -0.695 1.00 0.00 H new ATOM 1063 N ARG A 147 -4.996 -1.540 -2.078 1.00 0.00 N ATOM 1064 CA ARG A 147 -6.148 -1.307 -1.215 1.00 0.00 C ATOM 1065 C ARG A 147 -6.720 -2.626 -0.704 1.00 0.00 C ATOM 1066 O ARG A 147 -7.248 -3.426 -1.475 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.228 -0.528 -1.970 1.00 0.00 C ATOM 1068 CG ARG A 147 -8.252 0.129 -1.060 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.523 0.484 -1.816 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.301 -0.702 -2.165 1.00 0.00 N ATOM 1071 CZ ARG A 147 -11.570 -0.660 -2.555 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -12.201 0.503 -2.645 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -12.210 -1.782 -2.856 1.00 0.00 N ATOM 0 H ARG A 147 -4.908 -0.881 -2.852 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.817 -0.719 -0.359 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.751 0.239 -2.580 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.742 -1.205 -2.653 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -8.493 -0.543 -0.237 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -7.825 1.031 -0.621 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -10.133 1.151 -1.207 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.265 1.028 -2.724 1.00 0.00 H new ATOM 0 HE ARG A 147 -9.845 -1.612 -2.106 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -11.712 1.368 -2.415 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -13.176 0.533 -2.945 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -11.728 -2.678 -2.788 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -13.185 -1.749 -3.155 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.611 -2.846 0.603 1.00 0.00 N ATOM 1088 CA GLY A 148 -7.121 -4.069 1.195 1.00 0.00 C ATOM 1089 C GLY A 148 -6.339 -5.293 0.761 1.00 0.00 C ATOM 1090 O GLY A 148 -6.921 -6.323 0.423 1.00 0.00 O ATOM 0 H GLY A 148 -6.179 -2.199 1.262 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -7.086 -3.985 2.281 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -8.168 -4.194 0.919 1.00 0.00 H new ATOM 1094 N PHE A 149 -5.015 -5.180 0.769 1.00 0.00 N ATOM 1095 CA PHE A 149 -4.151 -6.285 0.371 1.00 0.00 C ATOM 1096 C PHE A 149 -4.292 -7.460 1.335 1.00 0.00 C ATOM 1097 O PHE A 149 -4.410 -7.289 2.549 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.692 -5.827 0.319 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.875 -6.547 -0.715 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -2.187 -6.442 -2.061 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.794 -7.329 -0.342 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -1.437 -7.104 -3.014 1.00 0.00 C ATOM 1103 CE2 PHE A 149 -0.040 -7.994 -1.290 1.00 0.00 C ATOM 1104 CZ PHE A 149 -0.361 -7.880 -2.629 1.00 0.00 C ATOM 0 H PHE A 149 -4.517 -4.334 1.047 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.457 -6.613 -0.622 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.662 -4.757 0.114 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.237 -5.976 1.298 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -3.026 -5.836 -2.369 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.537 -7.420 0.703 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -1.692 -7.015 -4.060 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.799 -8.602 -0.985 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.228 -8.396 -3.373 1.00 0.00 H new ATOM 1114 N PRO A 150 -4.281 -8.682 0.783 1.00 0.00 N ATOM 1115 CA PRO A 150 -4.407 -9.910 1.575 1.00 0.00 C ATOM 1116 C PRO A 150 -3.173 -10.177 2.430 1.00 0.00 C ATOM 1117 O PRO A 150 -3.066 -11.221 3.075 1.00 0.00 O ATOM 1118 CB PRO A 150 -4.569 -11.001 0.513 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.914 -10.446 -0.704 1.00 0.00 C ATOM 1120 CD PRO A 150 -4.143 -8.960 -0.657 1.00 0.00 C ATOM 0 HA PRO A 150 -5.236 -9.857 2.281 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -4.097 -11.932 0.827 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -5.621 -11.223 0.330 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.849 -10.676 -0.713 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -4.342 -10.878 -1.609 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.309 -8.411 -1.094 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -5.038 -8.674 -1.209 1.00 0.00 H new ATOM 1128 N LEU A 151 -2.243 -9.229 2.431 1.00 0.00 N ATOM 1129 CA LEU A 151 -1.015 -9.362 3.208 1.00 0.00 C ATOM 1130 C LEU A 151 -1.271 -10.125 4.503 1.00 0.00 C ATOM 1131 O LEU A 151 -2.363 -10.064 5.066 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.435 -7.982 3.521 1.00 0.00 C ATOM 1133 CG LEU A 151 1.076 -7.925 3.748 1.00 0.00 C ATOM 1134 CD1 LEU A 151 1.819 -8.060 2.427 1.00 0.00 C ATOM 1135 CD2 LEU A 151 1.462 -6.630 4.448 1.00 0.00 C ATOM 0 H LEU A 151 -2.315 -8.360 1.903 1.00 0.00 H new ATOM 0 HA LEU A 151 -0.296 -9.925 2.613 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.684 -7.310 2.700 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -0.931 -7.595 4.411 1.00 0.00 H new ATOM 0 HG LEU A 151 1.360 -8.760 4.389 1.00 0.00 H new ATOM 0 HD11 LEU A 151 2.893 -8.017 2.608 1.00 0.00 H new ATOM 0 HD12 LEU A 151 1.567 -9.014 1.963 1.00 0.00 H new ATOM 0 HD13 LEU A 151 1.530 -7.246 1.762 1.00 0.00 H new ATOM 0 HD21 LEU A 151 2.541 -6.607 4.601 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.165 -5.781 3.832 1.00 0.00 H new ATOM 0 HD23 LEU A 151 0.957 -6.573 5.412 1.00 0.00 H new ATOM 1147 N GLY A 152 -0.254 -10.842 4.972 1.00 0.00 N ATOM 1148 CA GLY A 152 -0.388 -11.605 6.199 1.00 0.00 C ATOM 1149 C GLY A 152 -1.569 -12.555 6.166 1.00 0.00 C ATOM 1150 O GLY A 152 -1.541 -13.567 5.467 1.00 0.00 O ATOM 0 H GLY A 152 0.660 -10.908 4.524 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.526 -12.173 6.372 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.501 -10.919 7.039 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.611 -12.228 6.924 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.792 -13.070 6.965 1.00 0.00 C ATOM 1156 C GLY A 153 -4.998 -12.411 6.325 1.00 0.00 C ATOM 1157 O GLY A 153 -4.934 -11.274 5.856 1.00 0.00 O ATOM 0 H GLY A 153 -2.658 -11.395 7.510 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -3.582 -14.010 6.454 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -4.023 -13.315 8.002 1.00 0.00 H new ATOM 1161 N PRO A 154 -6.128 -13.133 6.298 1.00 0.00 N ATOM 1162 CA PRO A 154 -7.374 -12.631 5.712 1.00 0.00 C ATOM 1163 C PRO A 154 -7.994 -11.510 6.540 1.00 0.00 C ATOM 1164 O PRO A 154 -8.937 -10.850 6.102 1.00 0.00 O ATOM 1165 CB PRO A 154 -8.286 -13.860 5.710 1.00 0.00 C ATOM 1166 CG PRO A 154 -7.762 -14.722 6.807 1.00 0.00 C ATOM 1167 CD PRO A 154 -6.276 -14.494 6.839 1.00 0.00 C ATOM 0 HA PRO A 154 -7.214 -12.200 4.724 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -9.325 -13.582 5.887 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -8.253 -14.376 4.751 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -8.218 -14.459 7.762 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -7.992 -15.771 6.622 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -5.880 -14.569 7.852 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -5.744 -15.227 6.233 1.00 0.00 H new ATOM 1175 N ASP A 155 -7.458 -11.299 7.737 1.00 0.00 N ATOM 1176 CA ASP A 155 -7.957 -10.256 8.626 1.00 0.00 C ATOM 1177 C ASP A 155 -7.078 -9.012 8.552 1.00 0.00 C ATOM 1178 O ASP A 155 -7.579 -7.890 8.481 1.00 0.00 O ATOM 1179 CB ASP A 155 -8.017 -10.769 10.066 1.00 0.00 C ATOM 1180 CG ASP A 155 -9.290 -11.540 10.353 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -10.336 -10.896 10.583 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -9.242 -12.788 10.348 1.00 0.00 O ATOM 0 H ASP A 155 -6.678 -11.837 8.114 1.00 0.00 H new ATOM 0 HA ASP A 155 -8.963 -9.988 8.302 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -7.156 -11.410 10.256 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -7.944 -9.926 10.753 1.00 0.00 H new ATOM 1187 N ARG A 156 -5.765 -9.219 8.570 1.00 0.00 N ATOM 1188 CA ARG A 156 -4.816 -8.114 8.507 1.00 0.00 C ATOM 1189 C ARG A 156 -4.671 -7.603 7.077 1.00 0.00 C ATOM 1190 O ARG A 156 -3.765 -8.011 6.350 1.00 0.00 O ATOM 1191 CB ARG A 156 -3.453 -8.554 9.044 1.00 0.00 C ATOM 1192 CG ARG A 156 -3.496 -9.056 10.478 1.00 0.00 C ATOM 1193 CD ARG A 156 -2.134 -9.553 10.935 1.00 0.00 C ATOM 1194 NE ARG A 156 -2.240 -10.491 12.050 1.00 0.00 N ATOM 1195 CZ ARG A 156 -2.534 -10.126 13.292 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -2.751 -8.849 13.578 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -2.612 -11.038 14.253 1.00 0.00 N ATOM 0 H ARG A 156 -5.334 -10.142 8.628 1.00 0.00 H new ATOM 0 HA ARG A 156 -5.199 -7.303 9.127 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -3.057 -9.342 8.404 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -2.760 -7.715 8.982 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.831 -8.254 11.136 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -4.225 -9.862 10.561 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -1.626 -10.037 10.101 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.519 -8.704 11.233 1.00 0.00 H new ATOM 0 HE ARG A 156 -2.079 -11.481 11.864 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -2.692 -8.145 12.843 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -2.977 -8.572 14.533 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -2.446 -12.021 14.038 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -2.838 -10.756 15.207 1.00 0.00 H new ATOM 1211 N ARG A 157 -5.570 -6.708 6.679 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.543 -6.143 5.336 1.00 0.00 C ATOM 1213 C ARG A 157 -4.881 -4.768 5.338 1.00 0.00 C ATOM 1214 O ARG A 157 -4.999 -4.012 6.303 1.00 0.00 O ATOM 1215 CB ARG A 157 -6.962 -6.037 4.775 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.463 -7.322 4.137 1.00 0.00 C ATOM 1217 CD ARG A 157 -8.677 -7.071 3.257 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.918 -7.062 4.027 1.00 0.00 N ATOM 1219 CZ ARG A 157 -11.120 -6.909 3.482 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -11.242 -6.754 2.171 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -12.203 -6.912 4.249 1.00 0.00 N ATOM 0 H ARG A 157 -6.326 -6.359 7.268 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.958 -6.808 4.701 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -7.641 -5.752 5.579 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -6.992 -5.238 4.034 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -6.667 -7.768 3.541 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -7.719 -8.040 4.916 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -8.562 -6.116 2.744 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -8.733 -7.841 2.488 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.859 -7.180 5.038 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -10.412 -6.752 1.578 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -12.166 -6.637 1.755 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -12.113 -7.032 5.258 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -13.125 -6.794 3.830 1.00 0.00 H new ATOM 1235 N LEU A 158 -4.185 -4.450 4.252 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.504 -3.166 4.128 1.00 0.00 C ATOM 1237 C LEU A 158 -4.498 -2.049 3.829 1.00 0.00 C ATOM 1238 O LEU A 158 -5.550 -2.284 3.234 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.447 -3.232 3.025 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.292 -4.207 3.259 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.323 -4.179 2.087 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.571 -3.877 4.558 1.00 0.00 C ATOM 0 H LEU A 158 -4.077 -5.064 3.445 1.00 0.00 H new ATOM 0 HA LEU A 158 -3.016 -2.948 5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -2.941 -3.503 2.092 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -2.031 -2.234 2.888 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.702 -5.214 3.340 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.492 -4.879 2.272 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -0.847 -4.465 1.175 1.00 0.00 H new ATOM 0 HD13 LEU A 158 0.081 -3.173 1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.248 -4.581 4.709 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -0.173 -2.863 4.506 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.270 -3.950 5.391 1.00 0.00 H new ATOM 1254 N ARG A 159 -4.157 -0.833 4.243 1.00 0.00 N ATOM 1255 CA ARG A 159 -5.019 0.321 4.019 1.00 0.00 C ATOM 1256 C ARG A 159 -4.295 1.390 3.207 1.00 0.00 C ATOM 1257 O ARG A 159 -3.442 2.109 3.728 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.482 0.905 5.355 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.479 0.026 6.092 1.00 0.00 C ATOM 1260 CD ARG A 159 -7.891 0.217 5.560 1.00 0.00 C ATOM 1261 NE ARG A 159 -8.596 1.291 6.255 1.00 0.00 N ATOM 1262 CZ ARG A 159 -8.926 1.241 7.541 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -8.615 0.177 8.268 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -9.568 2.258 8.102 1.00 0.00 N ATOM 0 H ARG A 159 -3.289 -0.622 4.736 1.00 0.00 H new ATOM 0 HA ARG A 159 -5.890 -0.011 3.454 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -4.612 1.066 5.992 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -5.933 1.881 5.178 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -6.189 -1.020 5.990 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -6.455 0.261 7.156 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -7.850 0.441 4.494 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -8.449 -0.713 5.669 1.00 0.00 H new ATOM 0 HE ARG A 159 -8.849 2.125 5.724 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -8.121 -0.606 7.840 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -8.870 0.142 9.255 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -9.808 3.079 7.546 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -9.821 2.219 9.089 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.642 1.491 1.927 1.00 0.00 N ATOM 1279 CA VAL A 160 -4.026 2.472 1.043 1.00 0.00 C ATOM 1280 C VAL A 160 -5.054 3.478 0.537 1.00 0.00 C ATOM 1281 O VAL A 160 -6.030 3.107 -0.117 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.349 1.795 -0.163 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -2.582 2.817 -0.989 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.430 0.675 0.301 1.00 0.00 C ATOM 0 H VAL A 160 -5.347 0.905 1.480 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.269 2.994 1.628 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.124 1.360 -0.795 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.111 2.320 -1.837 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.269 3.581 -1.353 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -1.816 3.284 -0.370 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -1.960 0.208 -0.564 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.660 1.084 0.955 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.010 -0.070 0.845 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.829 4.751 0.842 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.736 5.811 0.416 1.00 0.00 C ATOM 1296 C ASP A 161 -4.957 7.022 -0.087 1.00 0.00 C ATOM 1297 O ASP A 161 -4.007 7.473 0.553 1.00 0.00 O ATOM 1298 CB ASP A 161 -6.651 6.222 1.571 1.00 0.00 C ATOM 1299 CG ASP A 161 -7.564 7.375 1.203 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -8.521 7.152 0.431 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -7.323 8.500 1.688 1.00 0.00 O ATOM 0 H ASP A 161 -4.027 5.074 1.382 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.346 5.428 -0.402 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -7.255 5.367 1.875 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -6.043 6.504 2.430 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.364 7.543 -1.240 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.704 8.701 -1.831 1.00 0.00 C ATOM 1308 C PHE A 162 -4.433 9.770 -0.777 1.00 0.00 C ATOM 1309 O PHE A 162 -5.282 10.052 0.069 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.560 9.284 -2.957 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.642 8.398 -4.168 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.533 8.200 -4.974 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.829 7.764 -4.499 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.606 7.387 -6.089 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.908 6.949 -5.613 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.794 6.759 -6.408 1.00 0.00 C ATOM 0 H PHE A 162 -6.148 7.181 -1.783 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.750 8.372 -2.243 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.567 9.465 -2.581 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.151 10.250 -3.251 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.601 8.687 -4.728 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.702 7.908 -3.880 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.735 7.243 -6.711 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.839 6.462 -5.861 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.852 6.121 -7.277 1.00 0.00 H new ATOM 1326 N ALA A 163 -3.245 10.363 -0.835 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.862 11.402 0.113 1.00 0.00 C ATOM 1328 C ALA A 163 -3.495 12.740 -0.254 1.00 0.00 C ATOM 1329 O ALA A 163 -4.146 13.378 0.574 1.00 0.00 O ATOM 1330 CB ALA A 163 -1.348 11.531 0.172 1.00 0.00 C ATOM 0 H ALA A 163 -2.531 10.141 -1.529 1.00 0.00 H new ATOM 0 HA ALA A 163 -3.229 11.114 1.098 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -1.077 12.311 0.884 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -0.914 10.583 0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.966 11.792 -0.815 1.00 0.00 H new