USER MOD reduce.3.24.130724 H: found=0, std=0, add=575, rem=0, adj=12 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 122 HIS : no HD1:sc= -1.51 K(o=-1.5,f=-0.36) USER MOD Set 1.2: A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 101 ASN : amide:sc= -1.25 K(o=-1.3,f=-3.6!) USER MOD Set 2.2: A 102 THR OG1 : rot 18:sc= -0.0263 USER MOD Single : A 88 ASN : amide:sc= -2.51! C(o=-2.5!,f=-2.8!) USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.254 USER MOD Single : A 91 THR OG1 : rot 180:sc=0.000788 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 166:sc= -0.453 USER MOD Single : A 119 THR OG1 : rot 180:sc=-0.00622 USER MOD Single : A 127 SER OG : rot -26:sc= 0.754 USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 GLN : amide:sc= -1.17 K(o=-1.2,f=-4.6!) USER MOD Single : A 133 TYR OH : rot -26:sc= 0.472 USER MOD Single : A 135 SER OG : rot 180:sc= 0 USER MOD Single : A 140 GLN : amide:sc= -4.63 K(o=-4.6,f=-7.3!) USER MOD Single : A 143 CYS SG : rot 177:sc= -0.434! USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 MET CE :methyl -108:sc= -2.7 (180deg=-7.47!) USER MOD ----------------------------------------------------------------- ATOM 174 N ASN A 88 -8.720 12.503 -4.472 1.00 0.00 N ATOM 175 CA ASN A 88 -8.061 12.751 -5.749 1.00 0.00 C ATOM 176 C ASN A 88 -6.750 11.976 -5.844 1.00 0.00 C ATOM 177 O ASN A 88 -6.003 11.852 -4.874 1.00 0.00 O ATOM 178 CB ASN A 88 -7.797 14.247 -5.928 1.00 0.00 C ATOM 179 CG ASN A 88 -7.820 14.668 -7.385 1.00 0.00 C ATOM 180 OD1 ASN A 88 -8.852 14.585 -8.051 1.00 0.00 O ATOM 181 ND2 ASN A 88 -6.678 15.123 -7.888 1.00 0.00 N ATOM 0 HA ASN A 88 -8.723 12.408 -6.544 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -8.547 14.814 -5.377 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -6.828 14.496 -5.496 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -6.633 15.421 -8.863 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -5.846 15.175 -7.300 1.00 0.00 H new ATOM 188 N PRO A 89 -6.464 11.443 -7.041 1.00 0.00 N ATOM 189 CA PRO A 89 -5.242 10.673 -7.292 1.00 0.00 C ATOM 190 C PRO A 89 -3.992 11.545 -7.272 1.00 0.00 C ATOM 191 O PRO A 89 -4.064 12.758 -7.477 1.00 0.00 O ATOM 192 CB PRO A 89 -5.469 10.095 -8.692 1.00 0.00 C ATOM 193 CG PRO A 89 -6.422 11.039 -9.341 1.00 0.00 C ATOM 194 CD PRO A 89 -7.309 11.552 -8.241 1.00 0.00 C ATOM 0 HA PRO A 89 -5.072 9.917 -6.526 1.00 0.00 H new ATOM 0 HB2 PRO A 89 -4.535 10.030 -9.250 1.00 0.00 H new ATOM 0 HB3 PRO A 89 -5.882 9.087 -8.642 1.00 0.00 H new ATOM 0 HG2 PRO A 89 -5.891 11.857 -9.828 1.00 0.00 H new ATOM 0 HG3 PRO A 89 -7.007 10.536 -10.111 1.00 0.00 H new ATOM 0 HD2 PRO A 89 -7.619 12.581 -8.422 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -8.218 10.957 -8.148 1.00 0.00 H new ATOM 202 N THR A 90 -2.844 10.922 -7.024 1.00 0.00 N ATOM 203 CA THR A 90 -1.578 11.641 -6.976 1.00 0.00 C ATOM 204 C THR A 90 -0.397 10.678 -6.996 1.00 0.00 C ATOM 205 O THR A 90 -0.570 9.463 -6.890 1.00 0.00 O ATOM 206 CB THR A 90 -1.482 12.527 -5.719 1.00 0.00 C ATOM 207 OG1 THR A 90 -0.293 13.324 -5.771 1.00 0.00 O ATOM 208 CG2 THR A 90 -1.475 11.677 -4.458 1.00 0.00 C ATOM 0 H THR A 90 -2.766 9.919 -6.853 1.00 0.00 H new ATOM 0 HA THR A 90 -1.541 12.275 -7.862 1.00 0.00 H new ATOM 0 HB THR A 90 -2.355 13.180 -5.693 1.00 0.00 H new ATOM 0 HG1 THR A 90 -0.240 13.885 -4.970 1.00 0.00 H new ATOM 0 HG21 THR A 90 -1.407 12.324 -3.583 1.00 0.00 H new ATOM 0 HG22 THR A 90 -2.395 11.094 -4.407 1.00 0.00 H new ATOM 0 HG23 THR A 90 -0.619 11.003 -4.478 1.00 0.00 H new ATOM 216 N THR A 91 0.807 11.227 -7.132 1.00 0.00 N ATOM 217 CA THR A 91 2.017 10.416 -7.166 1.00 0.00 C ATOM 218 C THR A 91 2.505 10.097 -5.758 1.00 0.00 C ATOM 219 O THR A 91 3.708 9.999 -5.515 1.00 0.00 O ATOM 220 CB THR A 91 3.145 11.123 -7.941 1.00 0.00 C ATOM 221 OG1 THR A 91 3.332 12.448 -7.433 1.00 0.00 O ATOM 222 CG2 THR A 91 2.826 11.184 -9.427 1.00 0.00 C ATOM 0 H THR A 91 0.969 12.230 -7.220 1.00 0.00 H new ATOM 0 HA THR A 91 1.761 9.488 -7.677 1.00 0.00 H new ATOM 0 HB THR A 91 4.062 10.550 -7.807 1.00 0.00 H new ATOM 0 HG1 THR A 91 4.052 12.890 -7.930 1.00 0.00 H new ATOM 0 HG21 THR A 91 3.637 11.688 -9.953 1.00 0.00 H new ATOM 0 HG22 THR A 91 2.714 10.172 -9.817 1.00 0.00 H new ATOM 0 HG23 THR A 91 1.898 11.736 -9.578 1.00 0.00 H new ATOM 230 N ARG A 92 1.564 9.934 -4.833 1.00 0.00 N ATOM 231 CA ARG A 92 1.900 9.626 -3.448 1.00 0.00 C ATOM 232 C ARG A 92 0.739 8.922 -2.752 1.00 0.00 C ATOM 233 O ARG A 92 -0.389 9.416 -2.748 1.00 0.00 O ATOM 234 CB ARG A 92 2.261 10.906 -2.692 1.00 0.00 C ATOM 235 CG ARG A 92 2.911 10.652 -1.342 1.00 0.00 C ATOM 236 CD ARG A 92 2.762 11.851 -0.418 1.00 0.00 C ATOM 237 NE ARG A 92 3.547 12.995 -0.876 1.00 0.00 N ATOM 238 CZ ARG A 92 3.646 14.135 -0.202 1.00 0.00 C ATOM 239 NH1 ARG A 92 3.014 14.283 0.954 1.00 0.00 N ATOM 240 NH2 ARG A 92 4.380 15.130 -0.683 1.00 0.00 N ATOM 0 H ARG A 92 0.564 10.010 -5.018 1.00 0.00 H new ATOM 0 HA ARG A 92 2.761 8.958 -3.449 1.00 0.00 H new ATOM 0 HB2 ARG A 92 2.937 11.502 -3.305 1.00 0.00 H new ATOM 0 HB3 ARG A 92 1.358 11.499 -2.545 1.00 0.00 H new ATOM 0 HG2 ARG A 92 2.459 9.775 -0.878 1.00 0.00 H new ATOM 0 HG3 ARG A 92 3.969 10.428 -1.482 1.00 0.00 H new ATOM 0 HD2 ARG A 92 1.711 12.133 -0.357 1.00 0.00 H new ATOM 0 HD3 ARG A 92 3.077 11.575 0.588 1.00 0.00 H new ATOM 0 HE ARG A 92 4.046 12.914 -1.762 1.00 0.00 H new ATOM 0 HH11 ARG A 92 2.450 13.520 1.328 1.00 0.00 H new ATOM 0 HH12 ARG A 92 3.092 15.160 1.469 1.00 0.00 H new ATOM 0 HH21 ARG A 92 4.869 15.020 -1.571 1.00 0.00 H new ATOM 0 HH22 ARG A 92 4.455 16.005 -0.164 1.00 0.00 H new ATOM 254 N LEU A 93 1.023 7.765 -2.163 1.00 0.00 N ATOM 255 CA LEU A 93 0.003 6.992 -1.463 1.00 0.00 C ATOM 256 C LEU A 93 0.323 6.889 0.024 1.00 0.00 C ATOM 257 O LEU A 93 1.487 6.931 0.423 1.00 0.00 O ATOM 258 CB LEU A 93 -0.110 5.592 -2.070 1.00 0.00 C ATOM 259 CG LEU A 93 -0.163 5.525 -3.597 1.00 0.00 C ATOM 260 CD1 LEU A 93 -0.238 4.080 -4.065 1.00 0.00 C ATOM 261 CD2 LEU A 93 -1.347 6.321 -4.125 1.00 0.00 C ATOM 0 H LEU A 93 1.951 7.342 -2.156 1.00 0.00 H new ATOM 0 HA LEU A 93 -0.950 7.509 -1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.740 5.000 -1.730 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -1.008 5.117 -1.674 1.00 0.00 H new ATOM 0 HG LEU A 93 0.751 5.967 -3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -0.275 4.052 -5.154 1.00 0.00 H new ATOM 0 HD12 LEU A 93 0.642 3.539 -3.718 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -1.135 3.612 -3.659 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -1.369 6.262 -5.213 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -2.272 5.909 -3.721 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -1.250 7.363 -3.820 1.00 0.00 H new ATOM 273 N TRP A 94 -0.716 6.752 0.839 1.00 0.00 N ATOM 274 CA TRP A 94 -0.546 6.641 2.284 1.00 0.00 C ATOM 275 C TRP A 94 -0.786 5.210 2.752 1.00 0.00 C ATOM 276 O TRP A 94 -1.894 4.687 2.637 1.00 0.00 O ATOM 277 CB TRP A 94 -1.500 7.594 3.006 1.00 0.00 C ATOM 278 CG TRP A 94 -1.556 7.369 4.486 1.00 0.00 C ATOM 279 CD1 TRP A 94 -0.775 7.963 5.436 1.00 0.00 C ATOM 280 CD2 TRP A 94 -2.440 6.485 5.186 1.00 0.00 C ATOM 281 NE1 TRP A 94 -1.120 7.502 6.684 1.00 0.00 N ATOM 282 CE2 TRP A 94 -2.139 6.595 6.558 1.00 0.00 C ATOM 283 CE3 TRP A 94 -3.457 5.613 4.787 1.00 0.00 C ATOM 284 CZ2 TRP A 94 -2.819 5.866 7.529 1.00 0.00 C ATOM 285 CZ3 TRP A 94 -4.130 4.890 5.753 1.00 0.00 C ATOM 286 CH2 TRP A 94 -3.809 5.020 7.111 1.00 0.00 C ATOM 0 H TRP A 94 -1.686 6.715 0.525 1.00 0.00 H new ATOM 0 HA TRP A 94 0.481 6.915 2.526 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.191 8.621 2.813 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -2.501 7.479 2.590 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -0.000 8.688 5.236 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -0.687 7.789 7.562 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -3.712 5.506 3.743 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -2.574 5.965 8.576 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -4.917 4.213 5.456 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -4.354 4.441 7.842 1.00 0.00 H new ATOM 297 N VAL A 95 0.260 4.581 3.279 1.00 0.00 N ATOM 298 CA VAL A 95 0.161 3.210 3.766 1.00 0.00 C ATOM 299 C VAL A 95 0.192 3.164 5.289 1.00 0.00 C ATOM 300 O VAL A 95 1.174 3.566 5.913 1.00 0.00 O ATOM 301 CB VAL A 95 1.302 2.335 3.213 1.00 0.00 C ATOM 302 CG1 VAL A 95 1.155 0.899 3.694 1.00 0.00 C ATOM 303 CG2 VAL A 95 1.333 2.397 1.694 1.00 0.00 C ATOM 0 H VAL A 95 1.185 4.999 3.380 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.792 2.817 3.414 1.00 0.00 H new ATOM 0 HB VAL A 95 2.249 2.723 3.588 1.00 0.00 H new ATOM 0 HG11 VAL A 95 1.970 0.296 3.293 1.00 0.00 H new ATOM 0 HG12 VAL A 95 1.187 0.875 4.783 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.202 0.496 3.350 1.00 0.00 H new ATOM 0 HG21 VAL A 95 2.145 1.773 1.321 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.385 2.035 1.296 1.00 0.00 H new ATOM 0 HG23 VAL A 95 1.491 3.427 1.375 1.00 0.00 H new ATOM 313 N GLY A 96 -0.890 2.670 5.883 1.00 0.00 N ATOM 314 CA GLY A 96 -0.967 2.580 7.330 1.00 0.00 C ATOM 315 C GLY A 96 -1.231 1.167 7.809 1.00 0.00 C ATOM 316 O GLY A 96 -1.401 0.252 7.005 1.00 0.00 O ATOM 0 H GLY A 96 -1.715 2.330 5.388 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -0.034 2.939 7.764 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.759 3.237 7.690 1.00 0.00 H new ATOM 320 N GLY A 97 -1.264 0.987 9.127 1.00 0.00 N ATOM 321 CA GLY A 97 -1.508 -0.328 9.690 1.00 0.00 C ATOM 322 C GLY A 97 -0.348 -1.278 9.468 1.00 0.00 C ATOM 323 O GLY A 97 -0.530 -2.384 8.956 1.00 0.00 O ATOM 0 H GLY A 97 -1.126 1.728 9.814 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -1.696 -0.233 10.759 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -2.409 -0.749 9.244 1.00 0.00 H new ATOM 327 N LEU A 98 0.849 -0.848 9.852 1.00 0.00 N ATOM 328 CA LEU A 98 2.045 -1.667 9.691 1.00 0.00 C ATOM 329 C LEU A 98 2.497 -2.240 11.030 1.00 0.00 C ATOM 330 O LEU A 98 2.498 -1.546 12.046 1.00 0.00 O ATOM 331 CB LEU A 98 3.173 -0.842 9.070 1.00 0.00 C ATOM 332 CG LEU A 98 2.854 -0.164 7.737 1.00 0.00 C ATOM 333 CD1 LEU A 98 3.942 0.833 7.371 1.00 0.00 C ATOM 334 CD2 LEU A 98 2.688 -1.203 6.637 1.00 0.00 C ATOM 0 H LEU A 98 1.017 0.064 10.277 1.00 0.00 H new ATOM 0 HA LEU A 98 1.801 -2.495 9.026 1.00 0.00 H new ATOM 0 HB2 LEU A 98 3.469 -0.073 9.784 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.035 -1.493 8.926 1.00 0.00 H new ATOM 0 HG LEU A 98 1.914 0.378 7.843 1.00 0.00 H new ATOM 0 HD11 LEU A 98 3.698 1.305 6.420 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.013 1.595 8.147 1.00 0.00 H new ATOM 0 HD13 LEU A 98 4.897 0.314 7.284 1.00 0.00 H new ATOM 0 HD21 LEU A 98 2.461 -0.703 5.695 1.00 0.00 H new ATOM 0 HD22 LEU A 98 3.611 -1.773 6.532 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.872 -1.878 6.895 1.00 0.00 H new ATOM 346 N GLY A 99 2.881 -3.513 11.024 1.00 0.00 N ATOM 347 CA GLY A 99 3.332 -4.158 12.244 1.00 0.00 C ATOM 348 C GLY A 99 4.796 -4.546 12.187 1.00 0.00 C ATOM 349 O GLY A 99 5.547 -4.097 11.321 1.00 0.00 O ATOM 0 H GLY A 99 2.888 -4.109 10.196 1.00 0.00 H new ATOM 0 HA2 GLY A 99 3.170 -3.487 13.088 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.730 -5.049 12.425 1.00 0.00 H new ATOM 353 N PRO A 100 5.223 -5.399 13.130 1.00 0.00 N ATOM 354 CA PRO A 100 6.611 -5.866 13.206 1.00 0.00 C ATOM 355 C PRO A 100 6.971 -6.801 12.058 1.00 0.00 C ATOM 356 O PRO A 100 8.097 -6.785 11.562 1.00 0.00 O ATOM 357 CB PRO A 100 6.661 -6.613 14.541 1.00 0.00 C ATOM 358 CG PRO A 100 5.257 -7.047 14.786 1.00 0.00 C ATOM 359 CD PRO A 100 4.383 -5.975 14.195 1.00 0.00 C ATOM 0 HA PRO A 100 7.323 -5.043 13.136 1.00 0.00 H new ATOM 0 HB2 PRO A 100 7.336 -7.467 14.491 1.00 0.00 H new ATOM 0 HB3 PRO A 100 7.021 -5.968 15.342 1.00 0.00 H new ATOM 0 HG2 PRO A 100 5.060 -8.012 14.320 1.00 0.00 H new ATOM 0 HG3 PRO A 100 5.065 -7.163 15.853 1.00 0.00 H new ATOM 0 HD2 PRO A 100 3.456 -6.387 13.797 1.00 0.00 H new ATOM 0 HD3 PRO A 100 4.107 -5.227 14.938 1.00 0.00 H new ATOM 367 N ASN A 101 6.008 -7.616 11.640 1.00 0.00 N ATOM 368 CA ASN A 101 6.225 -8.559 10.549 1.00 0.00 C ATOM 369 C ASN A 101 6.507 -7.824 9.242 1.00 0.00 C ATOM 370 O ASN A 101 7.541 -8.036 8.607 1.00 0.00 O ATOM 371 CB ASN A 101 5.006 -9.469 10.383 1.00 0.00 C ATOM 372 CG ASN A 101 3.703 -8.694 10.381 1.00 0.00 C ATOM 373 OD1 ASN A 101 3.271 -8.186 9.346 1.00 0.00 O ATOM 374 ND2 ASN A 101 3.069 -8.599 11.545 1.00 0.00 N ATOM 0 H ASN A 101 5.070 -7.642 12.040 1.00 0.00 H new ATOM 0 HA ASN A 101 7.094 -9.169 10.797 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.096 -10.026 9.450 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.989 -10.201 11.191 1.00 0.00 H new ATOM 0 HD21 ASN A 101 2.188 -8.089 11.606 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.464 -9.036 12.378 1.00 0.00 H new ATOM 381 N THR A 102 5.580 -6.959 8.844 1.00 0.00 N ATOM 382 CA THR A 102 5.727 -6.192 7.614 1.00 0.00 C ATOM 383 C THR A 102 7.113 -5.565 7.519 1.00 0.00 C ATOM 384 O THR A 102 7.536 -4.834 8.414 1.00 0.00 O ATOM 385 CB THR A 102 4.665 -5.081 7.513 1.00 0.00 C ATOM 386 OG1 THR A 102 3.357 -5.636 7.685 1.00 0.00 O ATOM 387 CG2 THR A 102 4.749 -4.372 6.170 1.00 0.00 C ATOM 0 H THR A 102 4.718 -6.772 9.357 1.00 0.00 H new ATOM 0 HA THR A 102 5.590 -6.891 6.789 1.00 0.00 H new ATOM 0 HB THR A 102 4.856 -4.354 8.302 1.00 0.00 H new ATOM 0 HG1 THR A 102 3.429 -6.521 8.100 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.989 -3.592 6.122 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.736 -3.925 6.056 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.582 -5.091 5.368 1.00 0.00 H new ATOM 395 N SER A 103 7.816 -5.856 6.429 1.00 0.00 N ATOM 396 CA SER A 103 9.157 -5.322 6.218 1.00 0.00 C ATOM 397 C SER A 103 9.180 -4.365 5.031 1.00 0.00 C ATOM 398 O SER A 103 8.572 -4.629 3.993 1.00 0.00 O ATOM 399 CB SER A 103 10.152 -6.462 5.990 1.00 0.00 C ATOM 400 OG SER A 103 11.484 -5.981 5.980 1.00 0.00 O ATOM 0 H SER A 103 7.479 -6.459 5.678 1.00 0.00 H new ATOM 0 HA SER A 103 9.447 -4.770 7.112 1.00 0.00 H new ATOM 0 HB2 SER A 103 10.038 -7.211 6.774 1.00 0.00 H new ATOM 0 HB3 SER A 103 9.933 -6.956 5.043 1.00 0.00 H new ATOM 0 HG SER A 103 12.101 -6.729 5.834 1.00 0.00 H new ATOM 406 N LEU A 104 9.887 -3.252 5.191 1.00 0.00 N ATOM 407 CA LEU A 104 9.992 -2.253 4.133 1.00 0.00 C ATOM 408 C LEU A 104 10.109 -2.919 2.765 1.00 0.00 C ATOM 409 O LEU A 104 9.217 -2.797 1.927 1.00 0.00 O ATOM 410 CB LEU A 104 11.201 -1.347 4.377 1.00 0.00 C ATOM 411 CG LEU A 104 11.255 -0.063 3.549 1.00 0.00 C ATOM 412 CD1 LEU A 104 11.418 -0.386 2.072 1.00 0.00 C ATOM 413 CD2 LEU A 104 10.004 0.773 3.779 1.00 0.00 C ATOM 0 H LEU A 104 10.396 -3.018 6.043 1.00 0.00 H new ATOM 0 HA LEU A 104 9.085 -1.649 4.146 1.00 0.00 H new ATOM 0 HB2 LEU A 104 11.220 -1.076 5.433 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.106 -1.921 4.179 1.00 0.00 H new ATOM 0 HG LEU A 104 12.120 0.517 3.870 1.00 0.00 H new ATOM 0 HD11 LEU A 104 11.454 0.540 1.499 1.00 0.00 H new ATOM 0 HD12 LEU A 104 12.343 -0.943 1.921 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.574 -0.988 1.736 1.00 0.00 H new ATOM 0 HD21 LEU A 104 10.060 1.683 3.182 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.124 0.200 3.486 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.931 1.036 4.834 1.00 0.00 H new ATOM 425 N ALA A 105 11.214 -3.625 2.549 1.00 0.00 N ATOM 426 CA ALA A 105 11.445 -4.313 1.285 1.00 0.00 C ATOM 427 C ALA A 105 10.176 -5.004 0.796 1.00 0.00 C ATOM 428 O ALA A 105 9.733 -4.784 -0.330 1.00 0.00 O ATOM 429 CB ALA A 105 12.574 -5.322 1.433 1.00 0.00 C ATOM 0 H ALA A 105 11.963 -3.735 3.233 1.00 0.00 H new ATOM 0 HA ALA A 105 11.732 -3.569 0.542 1.00 0.00 H new ATOM 0 HB1 ALA A 105 12.736 -5.829 0.482 1.00 0.00 H new ATOM 0 HB2 ALA A 105 13.487 -4.806 1.729 1.00 0.00 H new ATOM 0 HB3 ALA A 105 12.309 -6.056 2.194 1.00 0.00 H new ATOM 435 N ALA A 106 9.597 -5.841 1.651 1.00 0.00 N ATOM 436 CA ALA A 106 8.378 -6.562 1.306 1.00 0.00 C ATOM 437 C ALA A 106 7.421 -5.677 0.516 1.00 0.00 C ATOM 438 O ALA A 106 7.130 -5.945 -0.650 1.00 0.00 O ATOM 439 CB ALA A 106 7.701 -7.086 2.564 1.00 0.00 C ATOM 0 H ALA A 106 9.952 -6.036 2.587 1.00 0.00 H new ATOM 0 HA ALA A 106 8.652 -7.408 0.675 1.00 0.00 H new ATOM 0 HB1 ALA A 106 6.792 -7.622 2.292 1.00 0.00 H new ATOM 0 HB2 ALA A 106 8.378 -7.762 3.087 1.00 0.00 H new ATOM 0 HB3 ALA A 106 7.447 -6.250 3.216 1.00 0.00 H new ATOM 445 N LEU A 107 6.933 -4.621 1.158 1.00 0.00 N ATOM 446 CA LEU A 107 6.006 -3.696 0.516 1.00 0.00 C ATOM 447 C LEU A 107 6.645 -3.049 -0.710 1.00 0.00 C ATOM 448 O LEU A 107 6.147 -3.188 -1.827 1.00 0.00 O ATOM 449 CB LEU A 107 5.566 -2.615 1.505 1.00 0.00 C ATOM 450 CG LEU A 107 4.985 -3.114 2.829 1.00 0.00 C ATOM 451 CD1 LEU A 107 4.871 -1.971 3.826 1.00 0.00 C ATOM 452 CD2 LEU A 107 3.629 -3.766 2.604 1.00 0.00 C ATOM 0 H LEU A 107 7.164 -4.384 2.123 1.00 0.00 H new ATOM 0 HA LEU A 107 5.132 -4.262 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 107 6.424 -1.980 1.724 1.00 0.00 H new ATOM 0 HB3 LEU A 107 4.821 -1.986 1.018 1.00 0.00 H new ATOM 0 HG LEU A 107 5.661 -3.863 3.242 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.456 -2.345 4.762 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.859 -1.549 4.010 1.00 0.00 H new ATOM 0 HD13 LEU A 107 4.216 -1.199 3.421 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.231 -4.115 3.557 1.00 0.00 H new ATOM 0 HD22 LEU A 107 2.943 -3.039 2.169 1.00 0.00 H new ATOM 0 HD23 LEU A 107 3.740 -4.612 1.925 1.00 0.00 H new ATOM 464 N ALA A 108 7.750 -2.345 -0.492 1.00 0.00 N ATOM 465 CA ALA A 108 8.459 -1.681 -1.579 1.00 0.00 C ATOM 466 C ALA A 108 8.417 -2.517 -2.853 1.00 0.00 C ATOM 467 O ALA A 108 8.112 -2.008 -3.932 1.00 0.00 O ATOM 468 CB ALA A 108 9.899 -1.400 -1.176 1.00 0.00 C ATOM 0 H ALA A 108 8.174 -2.219 0.427 1.00 0.00 H new ATOM 0 HA ALA A 108 7.959 -0.734 -1.781 1.00 0.00 H new ATOM 0 HB1 ALA A 108 10.416 -0.904 -1.997 1.00 0.00 H new ATOM 0 HB2 ALA A 108 9.912 -0.755 -0.297 1.00 0.00 H new ATOM 0 HB3 ALA A 108 10.402 -2.339 -0.945 1.00 0.00 H new ATOM 474 N ARG A 109 8.727 -3.803 -2.722 1.00 0.00 N ATOM 475 CA ARG A 109 8.727 -4.709 -3.864 1.00 0.00 C ATOM 476 C ARG A 109 7.356 -4.741 -4.532 1.00 0.00 C ATOM 477 O ARG A 109 7.224 -4.425 -5.714 1.00 0.00 O ATOM 478 CB ARG A 109 9.124 -6.119 -3.423 1.00 0.00 C ATOM 479 CG ARG A 109 9.766 -6.945 -4.526 1.00 0.00 C ATOM 480 CD ARG A 109 10.756 -7.952 -3.964 1.00 0.00 C ATOM 481 NE ARG A 109 10.883 -9.130 -4.819 1.00 0.00 N ATOM 482 CZ ARG A 109 11.863 -10.020 -4.703 1.00 0.00 C ATOM 483 NH1 ARG A 109 12.795 -9.866 -3.773 1.00 0.00 N ATOM 484 NH2 ARG A 109 11.910 -11.066 -5.517 1.00 0.00 N ATOM 0 H ARG A 109 8.981 -4.241 -1.836 1.00 0.00 H new ATOM 0 HA ARG A 109 9.456 -4.343 -4.587 1.00 0.00 H new ATOM 0 HB2 ARG A 109 9.817 -6.047 -2.585 1.00 0.00 H new ATOM 0 HB3 ARG A 109 8.238 -6.640 -3.060 1.00 0.00 H new ATOM 0 HG2 ARG A 109 8.992 -7.469 -5.087 1.00 0.00 H new ATOM 0 HG3 ARG A 109 10.276 -6.284 -5.227 1.00 0.00 H new ATOM 0 HD2 ARG A 109 11.731 -7.478 -3.852 1.00 0.00 H new ATOM 0 HD3 ARG A 109 10.435 -8.259 -2.969 1.00 0.00 H new ATOM 0 HE ARG A 109 10.181 -9.277 -5.544 1.00 0.00 H new ATOM 0 HH11 ARG A 109 12.761 -9.063 -3.145 1.00 0.00 H new ATOM 0 HH12 ARG A 109 13.546 -10.550 -3.686 1.00 0.00 H new ATOM 0 HH21 ARG A 109 11.194 -11.188 -6.233 1.00 0.00 H new ATOM 0 HH22 ARG A 109 12.663 -11.749 -5.427 1.00 0.00 H new ATOM 498 N GLU A 110 6.339 -5.127 -3.768 1.00 0.00 N ATOM 499 CA GLU A 110 4.978 -5.201 -4.287 1.00 0.00 C ATOM 500 C GLU A 110 4.578 -3.888 -4.953 1.00 0.00 C ATOM 501 O GLU A 110 4.038 -3.879 -6.060 1.00 0.00 O ATOM 502 CB GLU A 110 3.997 -5.536 -3.162 1.00 0.00 C ATOM 503 CG GLU A 110 3.784 -7.027 -2.963 1.00 0.00 C ATOM 504 CD GLU A 110 3.009 -7.662 -4.102 1.00 0.00 C ATOM 505 OE1 GLU A 110 2.279 -6.932 -4.804 1.00 0.00 O ATOM 506 OE2 GLU A 110 3.134 -8.891 -4.291 1.00 0.00 O ATOM 0 H GLU A 110 6.432 -5.393 -2.788 1.00 0.00 H new ATOM 0 HA GLU A 110 4.944 -5.993 -5.036 1.00 0.00 H new ATOM 0 HB2 GLU A 110 4.363 -5.103 -2.231 1.00 0.00 H new ATOM 0 HB3 GLU A 110 3.037 -5.066 -3.377 1.00 0.00 H new ATOM 0 HG2 GLU A 110 4.752 -7.519 -2.868 1.00 0.00 H new ATOM 0 HG3 GLU A 110 3.249 -7.192 -2.028 1.00 0.00 H new ATOM 513 N PHE A 111 4.845 -2.780 -4.270 1.00 0.00 N ATOM 514 CA PHE A 111 4.512 -1.460 -4.794 1.00 0.00 C ATOM 515 C PHE A 111 5.309 -1.160 -6.060 1.00 0.00 C ATOM 516 O PHE A 111 4.792 -0.563 -7.005 1.00 0.00 O ATOM 517 CB PHE A 111 4.784 -0.386 -3.739 1.00 0.00 C ATOM 518 CG PHE A 111 3.654 -0.199 -2.768 1.00 0.00 C ATOM 519 CD1 PHE A 111 2.629 0.693 -3.040 1.00 0.00 C ATOM 520 CD2 PHE A 111 3.617 -0.915 -1.582 1.00 0.00 C ATOM 521 CE1 PHE A 111 1.587 0.867 -2.148 1.00 0.00 C ATOM 522 CE2 PHE A 111 2.577 -0.745 -0.687 1.00 0.00 C ATOM 523 CZ PHE A 111 1.562 0.147 -0.970 1.00 0.00 C ATOM 0 H PHE A 111 5.291 -2.770 -3.353 1.00 0.00 H new ATOM 0 HA PHE A 111 3.451 -1.453 -5.044 1.00 0.00 H new ATOM 0 HB2 PHE A 111 5.686 -0.650 -3.187 1.00 0.00 H new ATOM 0 HB3 PHE A 111 4.983 0.562 -4.240 1.00 0.00 H new ATOM 0 HD1 PHE A 111 2.644 1.259 -3.960 1.00 0.00 H new ATOM 0 HD2 PHE A 111 4.409 -1.613 -1.354 1.00 0.00 H new ATOM 0 HE1 PHE A 111 0.794 1.565 -2.372 1.00 0.00 H new ATOM 0 HE2 PHE A 111 2.559 -1.310 0.233 1.00 0.00 H new ATOM 0 HZ PHE A 111 0.750 0.281 -0.271 1.00 0.00 H new ATOM 533 N ASP A 112 6.570 -1.577 -6.070 1.00 0.00 N ATOM 534 CA ASP A 112 7.440 -1.354 -7.220 1.00 0.00 C ATOM 535 C ASP A 112 6.847 -1.979 -8.479 1.00 0.00 C ATOM 536 O ASP A 112 6.709 -1.316 -9.507 1.00 0.00 O ATOM 537 CB ASP A 112 8.830 -1.932 -6.954 1.00 0.00 C ATOM 538 CG ASP A 112 9.908 -1.246 -7.769 1.00 0.00 C ATOM 539 OD1 ASP A 112 10.340 -0.143 -7.374 1.00 0.00 O ATOM 540 OD2 ASP A 112 10.321 -1.813 -8.803 1.00 0.00 O ATOM 0 H ASP A 112 7.013 -2.071 -5.295 1.00 0.00 H new ATOM 0 HA ASP A 112 7.527 -0.279 -7.376 1.00 0.00 H new ATOM 0 HB2 ASP A 112 9.064 -1.835 -5.894 1.00 0.00 H new ATOM 0 HB3 ASP A 112 8.827 -2.997 -7.184 1.00 0.00 H new ATOM 545 N ARG A 113 6.501 -3.259 -8.391 1.00 0.00 N ATOM 546 CA ARG A 113 5.926 -3.974 -9.524 1.00 0.00 C ATOM 547 C ARG A 113 5.044 -3.050 -10.359 1.00 0.00 C ATOM 548 O ARG A 113 5.046 -3.117 -11.589 1.00 0.00 O ATOM 549 CB ARG A 113 5.110 -5.173 -9.037 1.00 0.00 C ATOM 550 CG ARG A 113 5.960 -6.371 -8.648 1.00 0.00 C ATOM 551 CD ARG A 113 5.101 -7.532 -8.171 1.00 0.00 C ATOM 552 NE ARG A 113 4.662 -8.379 -9.277 1.00 0.00 N ATOM 553 CZ ARG A 113 3.569 -8.143 -9.994 1.00 0.00 C ATOM 554 NH1 ARG A 113 2.808 -7.092 -9.723 1.00 0.00 N ATOM 555 NH2 ARG A 113 3.235 -8.960 -10.985 1.00 0.00 N ATOM 0 H ARG A 113 6.609 -3.822 -7.547 1.00 0.00 H new ATOM 0 HA ARG A 113 6.744 -4.330 -10.150 1.00 0.00 H new ATOM 0 HB2 ARG A 113 4.511 -4.869 -8.179 1.00 0.00 H new ATOM 0 HB3 ARG A 113 4.415 -5.471 -9.822 1.00 0.00 H new ATOM 0 HG2 ARG A 113 6.558 -6.687 -9.503 1.00 0.00 H new ATOM 0 HG3 ARG A 113 6.656 -6.084 -7.860 1.00 0.00 H new ATOM 0 HD2 ARG A 113 5.666 -8.132 -7.457 1.00 0.00 H new ATOM 0 HD3 ARG A 113 4.230 -7.145 -7.643 1.00 0.00 H new ATOM 0 HE ARG A 113 5.225 -9.196 -9.512 1.00 0.00 H new ATOM 0 HH11 ARG A 113 3.061 -6.462 -8.962 1.00 0.00 H new ATOM 0 HH12 ARG A 113 1.969 -6.914 -10.275 1.00 0.00 H new ATOM 0 HH21 ARG A 113 3.818 -9.770 -11.197 1.00 0.00 H new ATOM 0 HH22 ARG A 113 2.396 -8.778 -11.535 1.00 0.00 H new ATOM 569 N PHE A 114 4.291 -2.189 -9.683 1.00 0.00 N ATOM 570 CA PHE A 114 3.403 -1.253 -10.363 1.00 0.00 C ATOM 571 C PHE A 114 4.203 -0.179 -11.095 1.00 0.00 C ATOM 572 O PHE A 114 4.011 0.046 -12.290 1.00 0.00 O ATOM 573 CB PHE A 114 2.452 -0.599 -9.358 1.00 0.00 C ATOM 574 CG PHE A 114 1.535 -1.576 -8.678 1.00 0.00 C ATOM 575 CD1 PHE A 114 0.385 -2.022 -9.309 1.00 0.00 C ATOM 576 CD2 PHE A 114 1.824 -2.048 -7.408 1.00 0.00 C ATOM 577 CE1 PHE A 114 -0.460 -2.919 -8.685 1.00 0.00 C ATOM 578 CE2 PHE A 114 0.983 -2.946 -6.779 1.00 0.00 C ATOM 579 CZ PHE A 114 -0.161 -3.383 -7.419 1.00 0.00 C ATOM 0 H PHE A 114 4.278 -2.120 -8.665 1.00 0.00 H new ATOM 0 HA PHE A 114 2.820 -1.811 -11.096 1.00 0.00 H new ATOM 0 HB2 PHE A 114 3.038 -0.076 -8.602 1.00 0.00 H new ATOM 0 HB3 PHE A 114 1.853 0.152 -9.872 1.00 0.00 H new ATOM 0 HD1 PHE A 114 0.147 -1.664 -10.300 1.00 0.00 H new ATOM 0 HD2 PHE A 114 2.717 -1.710 -6.904 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -1.354 -3.257 -9.187 1.00 0.00 H new ATOM 0 HE2 PHE A 114 1.219 -3.306 -5.789 1.00 0.00 H new ATOM 0 HZ PHE A 114 -0.820 -4.086 -6.930 1.00 0.00 H new ATOM 589 N GLY A 115 5.100 0.481 -10.370 1.00 0.00 N ATOM 590 CA GLY A 115 5.915 1.523 -10.966 1.00 0.00 C ATOM 591 C GLY A 115 7.126 1.867 -10.122 1.00 0.00 C ATOM 592 O GLY A 115 7.226 1.450 -8.968 1.00 0.00 O ATOM 0 H GLY A 115 5.277 0.313 -9.380 1.00 0.00 H new ATOM 0 HA2 GLY A 115 6.244 1.202 -11.954 1.00 0.00 H new ATOM 0 HA3 GLY A 115 5.309 2.418 -11.107 1.00 0.00 H new ATOM 596 N SER A 116 8.050 2.629 -10.698 1.00 0.00 N ATOM 597 CA SER A 116 9.264 3.024 -9.993 1.00 0.00 C ATOM 598 C SER A 116 8.927 3.815 -8.732 1.00 0.00 C ATOM 599 O SER A 116 7.983 4.605 -8.717 1.00 0.00 O ATOM 600 CB SER A 116 10.162 3.859 -10.907 1.00 0.00 C ATOM 601 OG SER A 116 9.403 4.801 -11.646 1.00 0.00 O ATOM 0 H SER A 116 7.981 2.985 -11.651 1.00 0.00 H new ATOM 0 HA SER A 116 9.796 2.118 -9.702 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.911 4.379 -10.310 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.700 3.203 -11.592 1.00 0.00 H new ATOM 0 HG SER A 116 10.004 5.463 -12.047 1.00 0.00 H new ATOM 607 N ILE A 117 9.705 3.595 -7.678 1.00 0.00 N ATOM 608 CA ILE A 117 9.490 4.288 -6.413 1.00 0.00 C ATOM 609 C ILE A 117 10.627 5.260 -6.119 1.00 0.00 C ATOM 610 O ILE A 117 11.801 4.896 -6.182 1.00 0.00 O ATOM 611 CB ILE A 117 9.363 3.295 -5.242 1.00 0.00 C ATOM 612 CG1 ILE A 117 8.161 2.373 -5.456 1.00 0.00 C ATOM 613 CG2 ILE A 117 9.235 4.044 -3.925 1.00 0.00 C ATOM 614 CD1 ILE A 117 8.135 1.187 -4.516 1.00 0.00 C ATOM 0 H ILE A 117 10.489 2.943 -7.674 1.00 0.00 H new ATOM 0 HA ILE A 117 8.557 4.843 -6.511 1.00 0.00 H new ATOM 0 HB ILE A 117 10.264 2.683 -5.203 1.00 0.00 H new ATOM 0 HG12 ILE A 117 7.244 2.949 -5.328 1.00 0.00 H new ATOM 0 HG13 ILE A 117 8.169 2.011 -6.484 1.00 0.00 H new ATOM 0 HG21 ILE A 117 9.146 3.329 -3.107 1.00 0.00 H new ATOM 0 HG22 ILE A 117 10.119 4.663 -3.771 1.00 0.00 H new ATOM 0 HG23 ILE A 117 8.348 4.677 -3.951 1.00 0.00 H new ATOM 0 HD11 ILE A 117 7.256 0.577 -4.724 1.00 0.00 H new ATOM 0 HD12 ILE A 117 9.035 0.589 -4.660 1.00 0.00 H new ATOM 0 HD13 ILE A 117 8.096 1.540 -3.486 1.00 0.00 H new ATOM 626 N ARG A 118 10.270 6.499 -5.796 1.00 0.00 N ATOM 627 CA ARG A 118 11.260 7.525 -5.492 1.00 0.00 C ATOM 628 C ARG A 118 11.894 7.279 -4.126 1.00 0.00 C ATOM 629 O ARG A 118 13.113 7.145 -4.009 1.00 0.00 O ATOM 630 CB ARG A 118 10.615 8.912 -5.525 1.00 0.00 C ATOM 631 CG ARG A 118 11.592 10.030 -5.851 1.00 0.00 C ATOM 632 CD ARG A 118 11.789 10.176 -7.352 1.00 0.00 C ATOM 633 NE ARG A 118 13.123 10.670 -7.683 1.00 0.00 N ATOM 634 CZ ARG A 118 13.440 11.201 -8.858 1.00 0.00 C ATOM 635 NH1 ARG A 118 12.523 11.307 -9.810 1.00 0.00 N ATOM 636 NH2 ARG A 118 14.676 11.629 -9.084 1.00 0.00 N ATOM 0 H ARG A 118 9.302 6.816 -5.738 1.00 0.00 H new ATOM 0 HA ARG A 118 12.041 7.478 -6.250 1.00 0.00 H new ATOM 0 HB2 ARG A 118 9.814 8.914 -6.264 1.00 0.00 H new ATOM 0 HB3 ARG A 118 10.156 9.113 -4.557 1.00 0.00 H new ATOM 0 HG2 ARG A 118 11.223 10.969 -5.438 1.00 0.00 H new ATOM 0 HG3 ARG A 118 12.551 9.827 -5.375 1.00 0.00 H new ATOM 0 HD2 ARG A 118 11.630 9.212 -7.834 1.00 0.00 H new ATOM 0 HD3 ARG A 118 11.040 10.860 -7.751 1.00 0.00 H new ATOM 0 HE ARG A 118 13.851 10.603 -6.972 1.00 0.00 H new ATOM 0 HH11 ARG A 118 11.572 10.980 -9.640 1.00 0.00 H new ATOM 0 HH12 ARG A 118 12.769 11.715 -10.712 1.00 0.00 H new ATOM 0 HH21 ARG A 118 15.384 11.550 -8.354 1.00 0.00 H new ATOM 0 HH22 ARG A 118 14.917 12.037 -9.987 1.00 0.00 H new ATOM 650 N THR A 119 11.059 7.222 -3.093 1.00 0.00 N ATOM 651 CA THR A 119 11.537 6.995 -1.735 1.00 0.00 C ATOM 652 C THR A 119 10.399 6.567 -0.815 1.00 0.00 C ATOM 653 O THR A 119 9.227 6.801 -1.113 1.00 0.00 O ATOM 654 CB THR A 119 12.204 8.256 -1.155 1.00 0.00 C ATOM 655 OG1 THR A 119 12.883 7.936 0.064 1.00 0.00 O ATOM 656 CG2 THR A 119 11.172 9.344 -0.897 1.00 0.00 C ATOM 0 H THR A 119 10.048 7.330 -3.171 1.00 0.00 H new ATOM 0 HA THR A 119 12.276 6.196 -1.791 1.00 0.00 H new ATOM 0 HB THR A 119 12.925 8.626 -1.884 1.00 0.00 H new ATOM 0 HG1 THR A 119 13.306 8.743 0.425 1.00 0.00 H new ATOM 0 HG21 THR A 119 11.667 10.225 -0.488 1.00 0.00 H new ATOM 0 HG22 THR A 119 10.679 9.607 -1.833 1.00 0.00 H new ATOM 0 HG23 THR A 119 10.430 8.981 -0.186 1.00 0.00 H new ATOM 664 N ILE A 120 10.751 5.941 0.303 1.00 0.00 N ATOM 665 CA ILE A 120 9.758 5.484 1.266 1.00 0.00 C ATOM 666 C ILE A 120 10.157 5.861 2.689 1.00 0.00 C ATOM 667 O ILE A 120 11.213 5.457 3.176 1.00 0.00 O ATOM 668 CB ILE A 120 9.560 3.958 1.189 1.00 0.00 C ATOM 669 CG1 ILE A 120 9.110 3.551 -0.216 1.00 0.00 C ATOM 670 CG2 ILE A 120 8.547 3.502 2.228 1.00 0.00 C ATOM 671 CD1 ILE A 120 9.219 2.066 -0.479 1.00 0.00 C ATOM 0 H ILE A 120 11.716 5.739 0.564 1.00 0.00 H new ATOM 0 HA ILE A 120 8.821 5.978 1.011 1.00 0.00 H new ATOM 0 HB ILE A 120 10.512 3.472 1.401 1.00 0.00 H new ATOM 0 HG12 ILE A 120 8.076 3.863 -0.362 1.00 0.00 H new ATOM 0 HG13 ILE A 120 9.711 4.087 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 120 8.418 2.422 2.161 1.00 0.00 H new ATOM 0 HG22 ILE A 120 8.904 3.764 3.224 1.00 0.00 H new ATOM 0 HG23 ILE A 120 7.591 3.993 2.045 1.00 0.00 H new ATOM 0 HD11 ILE A 120 8.883 1.851 -1.493 1.00 0.00 H new ATOM 0 HD12 ILE A 120 10.256 1.752 -0.366 1.00 0.00 H new ATOM 0 HD13 ILE A 120 8.596 1.524 0.232 1.00 0.00 H new ATOM 683 N ASP A 121 9.305 6.637 3.350 1.00 0.00 N ATOM 684 CA ASP A 121 9.567 7.068 4.718 1.00 0.00 C ATOM 685 C ASP A 121 8.956 6.094 5.721 1.00 0.00 C ATOM 686 O ASP A 121 7.777 5.750 5.629 1.00 0.00 O ATOM 687 CB ASP A 121 9.010 8.473 4.949 1.00 0.00 C ATOM 688 CG ASP A 121 9.924 9.555 4.409 1.00 0.00 C ATOM 689 OD1 ASP A 121 10.385 9.420 3.256 1.00 0.00 O ATOM 690 OD2 ASP A 121 10.180 10.535 5.139 1.00 0.00 O ATOM 0 H ASP A 121 8.427 6.980 2.960 1.00 0.00 H new ATOM 0 HA ASP A 121 10.647 7.085 4.866 1.00 0.00 H new ATOM 0 HB2 ASP A 121 8.033 8.556 4.473 1.00 0.00 H new ATOM 0 HB3 ASP A 121 8.858 8.629 6.017 1.00 0.00 H new ATOM 695 N HIS A 122 9.766 5.651 6.677 1.00 0.00 N ATOM 696 CA HIS A 122 9.306 4.715 7.697 1.00 0.00 C ATOM 697 C HIS A 122 9.185 5.405 9.052 1.00 0.00 C ATOM 698 O HIS A 122 9.925 6.342 9.351 1.00 0.00 O ATOM 699 CB HIS A 122 10.263 3.527 7.800 1.00 0.00 C ATOM 700 CG HIS A 122 9.940 2.593 8.924 1.00 0.00 C ATOM 701 ND1 HIS A 122 10.895 2.085 9.779 1.00 0.00 N ATOM 702 CD2 HIS A 122 8.758 2.076 9.334 1.00 0.00 C ATOM 703 CE1 HIS A 122 10.315 1.295 10.665 1.00 0.00 C ATOM 704 NE2 HIS A 122 9.018 1.272 10.417 1.00 0.00 N ATOM 0 H HIS A 122 10.744 5.925 6.767 1.00 0.00 H new ATOM 0 HA HIS A 122 8.321 4.353 7.404 1.00 0.00 H new ATOM 0 HB2 HIS A 122 10.244 2.973 6.861 1.00 0.00 H new ATOM 0 HB3 HIS A 122 11.279 3.900 7.929 1.00 0.00 H new ATOM 0 HD2 HIS A 122 7.790 2.261 8.892 1.00 0.00 H new ATOM 0 HE1 HIS A 122 10.816 0.759 11.457 1.00 0.00 H new ATOM 0 HE2 HIS A 122 8.323 0.743 10.944 1.00 0.00 H new ATOM 713 N VAL A 123 8.247 4.936 9.869 1.00 0.00 N ATOM 714 CA VAL A 123 8.030 5.507 11.193 1.00 0.00 C ATOM 715 C VAL A 123 7.532 4.450 12.172 1.00 0.00 C ATOM 716 O VAL A 123 6.701 3.609 11.827 1.00 0.00 O ATOM 717 CB VAL A 123 7.015 6.665 11.144 1.00 0.00 C ATOM 718 CG1 VAL A 123 7.127 7.525 12.394 1.00 0.00 C ATOM 719 CG2 VAL A 123 7.222 7.502 9.891 1.00 0.00 C ATOM 0 H VAL A 123 7.625 4.162 9.637 1.00 0.00 H new ATOM 0 HA VAL A 123 8.991 5.890 11.535 1.00 0.00 H new ATOM 0 HB VAL A 123 6.010 6.244 11.110 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.403 8.338 12.342 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.926 6.915 13.275 1.00 0.00 H new ATOM 0 HG13 VAL A 123 8.133 7.939 12.462 1.00 0.00 H new ATOM 0 HG21 VAL A 123 6.497 8.315 9.873 1.00 0.00 H new ATOM 0 HG22 VAL A 123 8.231 7.915 9.892 1.00 0.00 H new ATOM 0 HG23 VAL A 123 7.087 6.876 9.009 1.00 0.00 H new ATOM 729 N LYS A 124 8.045 4.499 13.397 1.00 0.00 N ATOM 730 CA LYS A 124 7.652 3.547 14.430 1.00 0.00 C ATOM 731 C LYS A 124 6.460 4.069 15.226 1.00 0.00 C ATOM 732 O LYS A 124 5.439 3.393 15.349 1.00 0.00 O ATOM 733 CB LYS A 124 8.826 3.271 15.371 1.00 0.00 C ATOM 734 CG LYS A 124 10.070 2.767 14.661 1.00 0.00 C ATOM 735 CD LYS A 124 10.907 3.914 14.120 1.00 0.00 C ATOM 736 CE LYS A 124 12.383 3.550 14.066 1.00 0.00 C ATOM 737 NZ LYS A 124 12.678 2.589 12.967 1.00 0.00 N ATOM 0 H LYS A 124 8.734 5.188 13.699 1.00 0.00 H new ATOM 0 HA LYS A 124 7.360 2.618 13.941 1.00 0.00 H new ATOM 0 HB2 LYS A 124 9.071 4.186 15.910 1.00 0.00 H new ATOM 0 HB3 LYS A 124 8.519 2.535 16.115 1.00 0.00 H new ATOM 0 HG2 LYS A 124 10.669 2.173 15.352 1.00 0.00 H new ATOM 0 HG3 LYS A 124 9.781 2.109 13.842 1.00 0.00 H new ATOM 0 HD2 LYS A 124 10.560 4.180 13.121 1.00 0.00 H new ATOM 0 HD3 LYS A 124 10.771 4.794 14.749 1.00 0.00 H new ATOM 0 HE2 LYS A 124 12.975 4.454 13.926 1.00 0.00 H new ATOM 0 HE3 LYS A 124 12.685 3.116 15.019 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 13.694 2.366 12.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 12.133 1.716 13.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 12.414 3.013 12.055 1.00 0.00 H new ATOM 751 N GLY A 125 6.596 5.277 15.764 1.00 0.00 N ATOM 752 CA GLY A 125 5.523 5.870 16.540 1.00 0.00 C ATOM 753 C GLY A 125 4.204 5.878 15.792 1.00 0.00 C ATOM 754 O GLY A 125 3.243 5.231 16.208 1.00 0.00 O ATOM 0 H GLY A 125 7.431 5.856 15.676 1.00 0.00 H new ATOM 0 HA2 GLY A 125 5.405 5.318 17.473 1.00 0.00 H new ATOM 0 HA3 GLY A 125 5.793 6.892 16.806 1.00 0.00 H new ATOM 758 N ASP A 126 4.157 6.614 14.687 1.00 0.00 N ATOM 759 CA ASP A 126 2.946 6.705 13.880 1.00 0.00 C ATOM 760 C ASP A 126 2.652 5.377 13.189 1.00 0.00 C ATOM 761 O ASP A 126 1.499 4.953 13.101 1.00 0.00 O ATOM 762 CB ASP A 126 3.084 7.816 12.838 1.00 0.00 C ATOM 763 CG ASP A 126 3.552 9.124 13.445 1.00 0.00 C ATOM 764 OD1 ASP A 126 4.705 9.177 13.921 1.00 0.00 O ATOM 765 OD2 ASP A 126 2.766 10.094 13.445 1.00 0.00 O ATOM 0 H ASP A 126 4.944 7.156 14.330 1.00 0.00 H new ATOM 0 HA ASP A 126 2.114 6.941 14.544 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.790 7.503 12.069 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.124 7.970 12.346 1.00 0.00 H new ATOM 770 N SER A 127 3.702 4.725 12.700 1.00 0.00 N ATOM 771 CA SER A 127 3.556 3.447 12.013 1.00 0.00 C ATOM 772 C SER A 127 2.960 3.643 10.622 1.00 0.00 C ATOM 773 O SER A 127 2.130 2.853 10.173 1.00 0.00 O ATOM 774 CB SER A 127 2.673 2.502 12.830 1.00 0.00 C ATOM 775 OG SER A 127 3.007 2.554 14.206 1.00 0.00 O ATOM 0 H SER A 127 4.663 5.061 12.767 1.00 0.00 H new ATOM 0 HA SER A 127 4.547 3.005 11.906 1.00 0.00 H new ATOM 0 HB2 SER A 127 1.625 2.772 12.696 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.789 1.482 12.463 1.00 0.00 H new ATOM 0 HG SER A 127 3.944 2.824 14.305 1.00 0.00 H new ATOM 781 N PHE A 128 3.390 4.703 9.946 1.00 0.00 N ATOM 782 CA PHE A 128 2.899 5.006 8.606 1.00 0.00 C ATOM 783 C PHE A 128 4.037 4.977 7.591 1.00 0.00 C ATOM 784 O PHE A 128 5.207 5.108 7.950 1.00 0.00 O ATOM 785 CB PHE A 128 2.217 6.375 8.587 1.00 0.00 C ATOM 786 CG PHE A 128 3.181 7.524 8.510 1.00 0.00 C ATOM 787 CD1 PHE A 128 3.921 7.749 7.361 1.00 0.00 C ATOM 788 CD2 PHE A 128 3.349 8.378 9.588 1.00 0.00 C ATOM 789 CE1 PHE A 128 4.809 8.806 7.287 1.00 0.00 C ATOM 790 CE2 PHE A 128 4.235 9.437 9.520 1.00 0.00 C ATOM 791 CZ PHE A 128 4.967 9.650 8.368 1.00 0.00 C ATOM 0 H PHE A 128 4.077 5.367 10.304 1.00 0.00 H new ATOM 0 HA PHE A 128 2.171 4.242 8.331 1.00 0.00 H new ATOM 0 HB2 PHE A 128 1.539 6.422 7.735 1.00 0.00 H new ATOM 0 HB3 PHE A 128 1.608 6.481 9.485 1.00 0.00 H new ATOM 0 HD1 PHE A 128 3.803 7.091 6.513 1.00 0.00 H new ATOM 0 HD2 PHE A 128 2.781 8.214 10.492 1.00 0.00 H new ATOM 0 HE1 PHE A 128 5.379 8.971 6.384 1.00 0.00 H new ATOM 0 HE2 PHE A 128 4.355 10.097 10.366 1.00 0.00 H new ATOM 0 HZ PHE A 128 5.662 10.475 8.313 1.00 0.00 H new ATOM 801 N ALA A 129 3.685 4.806 6.321 1.00 0.00 N ATOM 802 CA ALA A 129 4.676 4.762 5.252 1.00 0.00 C ATOM 803 C ALA A 129 4.172 5.481 4.006 1.00 0.00 C ATOM 804 O ALA A 129 3.059 5.232 3.541 1.00 0.00 O ATOM 805 CB ALA A 129 5.034 3.320 4.924 1.00 0.00 C ATOM 0 H ALA A 129 2.721 4.696 6.007 1.00 0.00 H new ATOM 0 HA ALA A 129 5.572 5.277 5.599 1.00 0.00 H new ATOM 0 HB1 ALA A 129 5.775 3.302 4.124 1.00 0.00 H new ATOM 0 HB2 ALA A 129 5.445 2.836 5.810 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.139 2.787 4.602 1.00 0.00 H new ATOM 811 N TYR A 130 4.996 6.373 3.469 1.00 0.00 N ATOM 812 CA TYR A 130 4.632 7.131 2.278 1.00 0.00 C ATOM 813 C TYR A 130 5.418 6.647 1.063 1.00 0.00 C ATOM 814 O TYR A 130 6.645 6.553 1.101 1.00 0.00 O ATOM 815 CB TYR A 130 4.884 8.624 2.501 1.00 0.00 C ATOM 816 CG TYR A 130 3.821 9.299 3.337 1.00 0.00 C ATOM 817 CD1 TYR A 130 2.476 9.189 3.008 1.00 0.00 C ATOM 818 CD2 TYR A 130 4.162 10.046 4.458 1.00 0.00 C ATOM 819 CE1 TYR A 130 1.502 9.806 3.769 1.00 0.00 C ATOM 820 CE2 TYR A 130 3.195 10.664 5.226 1.00 0.00 C ATOM 821 CZ TYR A 130 1.866 10.542 4.877 1.00 0.00 C ATOM 822 OH TYR A 130 0.898 11.156 5.639 1.00 0.00 O ATOM 0 H TYR A 130 5.921 6.589 3.840 1.00 0.00 H new ATOM 0 HA TYR A 130 3.570 6.973 2.088 1.00 0.00 H new ATOM 0 HB2 TYR A 130 5.852 8.752 2.986 1.00 0.00 H new ATOM 0 HB3 TYR A 130 4.944 9.122 1.533 1.00 0.00 H new ATOM 0 HD1 TYR A 130 2.187 8.611 2.143 1.00 0.00 H new ATOM 0 HD2 TYR A 130 5.202 10.145 4.733 1.00 0.00 H new ATOM 0 HE1 TYR A 130 0.461 9.712 3.498 1.00 0.00 H new ATOM 0 HE2 TYR A 130 3.478 11.240 6.095 1.00 0.00 H new ATOM 0 HH TYR A 130 1.321 11.633 6.383 1.00 0.00 H new ATOM 832 N ILE A 131 4.701 6.341 -0.013 1.00 0.00 N ATOM 833 CA ILE A 131 5.330 5.868 -1.240 1.00 0.00 C ATOM 834 C ILE A 131 5.133 6.865 -2.378 1.00 0.00 C ATOM 835 O ILE A 131 4.004 7.225 -2.711 1.00 0.00 O ATOM 836 CB ILE A 131 4.769 4.499 -1.669 1.00 0.00 C ATOM 837 CG1 ILE A 131 5.182 3.419 -0.668 1.00 0.00 C ATOM 838 CG2 ILE A 131 5.250 4.145 -3.068 1.00 0.00 C ATOM 839 CD1 ILE A 131 4.430 2.118 -0.838 1.00 0.00 C ATOM 0 H ILE A 131 3.685 6.412 -0.060 1.00 0.00 H new ATOM 0 HA ILE A 131 6.395 5.765 -1.030 1.00 0.00 H new ATOM 0 HB ILE A 131 3.681 4.556 -1.684 1.00 0.00 H new ATOM 0 HG12 ILE A 131 6.250 3.228 -0.772 1.00 0.00 H new ATOM 0 HG13 ILE A 131 5.022 3.792 0.344 1.00 0.00 H new ATOM 0 HG21 ILE A 131 4.845 3.175 -3.357 1.00 0.00 H new ATOM 0 HG22 ILE A 131 4.911 4.904 -3.772 1.00 0.00 H new ATOM 0 HG23 ILE A 131 6.339 4.101 -3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 131 4.775 1.399 -0.095 1.00 0.00 H new ATOM 0 HD12 ILE A 131 3.363 2.295 -0.705 1.00 0.00 H new ATOM 0 HD13 ILE A 131 4.610 1.722 -1.837 1.00 0.00 H new ATOM 851 N GLN A 132 6.239 7.304 -2.970 1.00 0.00 N ATOM 852 CA GLN A 132 6.187 8.258 -4.072 1.00 0.00 C ATOM 853 C GLN A 132 6.512 7.577 -5.397 1.00 0.00 C ATOM 854 O GLN A 132 7.520 6.880 -5.517 1.00 0.00 O ATOM 855 CB GLN A 132 7.163 9.409 -3.823 1.00 0.00 C ATOM 856 CG GLN A 132 7.131 10.478 -4.904 1.00 0.00 C ATOM 857 CD GLN A 132 6.095 11.551 -4.633 1.00 0.00 C ATOM 858 OE1 GLN A 132 5.169 11.352 -3.846 1.00 0.00 O ATOM 859 NE2 GLN A 132 6.246 12.698 -5.284 1.00 0.00 N ATOM 0 H GLN A 132 7.181 7.015 -2.706 1.00 0.00 H new ATOM 0 HA GLN A 132 5.174 8.656 -4.128 1.00 0.00 H new ATOM 0 HB2 GLN A 132 6.932 9.869 -2.862 1.00 0.00 H new ATOM 0 HB3 GLN A 132 8.174 9.008 -3.750 1.00 0.00 H new ATOM 0 HG2 GLN A 132 8.115 10.940 -4.982 1.00 0.00 H new ATOM 0 HG3 GLN A 132 6.921 10.010 -5.866 1.00 0.00 H new ATOM 0 HE21 GLN A 132 7.028 12.820 -5.927 1.00 0.00 H new ATOM 0 HE22 GLN A 132 5.580 13.457 -5.141 1.00 0.00 H new ATOM 868 N TYR A 133 5.653 7.783 -6.388 1.00 0.00 N ATOM 869 CA TYR A 133 5.847 7.187 -7.705 1.00 0.00 C ATOM 870 C TYR A 133 6.302 8.235 -8.716 1.00 0.00 C ATOM 871 O TYR A 133 5.943 9.407 -8.615 1.00 0.00 O ATOM 872 CB TYR A 133 4.553 6.527 -8.185 1.00 0.00 C ATOM 873 CG TYR A 133 4.318 5.155 -7.593 1.00 0.00 C ATOM 874 CD1 TYR A 133 4.925 4.030 -8.136 1.00 0.00 C ATOM 875 CD2 TYR A 133 3.487 4.985 -6.493 1.00 0.00 C ATOM 876 CE1 TYR A 133 4.712 2.774 -7.600 1.00 0.00 C ATOM 877 CE2 TYR A 133 3.270 3.734 -5.949 1.00 0.00 C ATOM 878 CZ TYR A 133 3.884 2.632 -6.506 1.00 0.00 C ATOM 879 OH TYR A 133 3.669 1.384 -5.968 1.00 0.00 O ATOM 0 H TYR A 133 4.815 8.358 -6.305 1.00 0.00 H new ATOM 0 HA TYR A 133 6.625 6.428 -7.621 1.00 0.00 H new ATOM 0 HB2 TYR A 133 3.711 7.172 -7.933 1.00 0.00 H new ATOM 0 HB3 TYR A 133 4.578 6.445 -9.272 1.00 0.00 H new ATOM 0 HD1 TYR A 133 5.575 4.139 -8.992 1.00 0.00 H new ATOM 0 HD2 TYR A 133 3.002 5.845 -6.056 1.00 0.00 H new ATOM 0 HE1 TYR A 133 5.191 1.909 -8.035 1.00 0.00 H new ATOM 0 HE2 TYR A 133 2.623 3.620 -5.092 1.00 0.00 H new ATOM 0 HH TYR A 133 3.800 0.702 -6.660 1.00 0.00 H new ATOM 889 N GLU A 134 7.095 7.802 -9.691 1.00 0.00 N ATOM 890 CA GLU A 134 7.600 8.702 -10.721 1.00 0.00 C ATOM 891 C GLU A 134 6.505 9.047 -11.727 1.00 0.00 C ATOM 892 O GLU A 134 6.687 9.905 -12.589 1.00 0.00 O ATOM 893 CB GLU A 134 8.791 8.069 -11.444 1.00 0.00 C ATOM 894 CG GLU A 134 10.128 8.365 -10.787 1.00 0.00 C ATOM 895 CD GLU A 134 11.303 8.084 -11.704 1.00 0.00 C ATOM 896 OE1 GLU A 134 11.144 7.273 -12.640 1.00 0.00 O ATOM 897 OE2 GLU A 134 12.381 8.676 -11.486 1.00 0.00 O ATOM 0 H GLU A 134 7.401 6.834 -9.789 1.00 0.00 H new ATOM 0 HA GLU A 134 7.926 9.622 -10.235 1.00 0.00 H new ATOM 0 HB2 GLU A 134 8.648 6.989 -11.486 1.00 0.00 H new ATOM 0 HB3 GLU A 134 8.814 8.428 -12.473 1.00 0.00 H new ATOM 0 HG2 GLU A 134 10.154 9.410 -10.479 1.00 0.00 H new ATOM 0 HG3 GLU A 134 10.225 7.764 -9.883 1.00 0.00 H new ATOM 904 N SER A 135 5.367 8.370 -11.609 1.00 0.00 N ATOM 905 CA SER A 135 4.244 8.600 -12.510 1.00 0.00 C ATOM 906 C SER A 135 2.917 8.468 -11.768 1.00 0.00 C ATOM 907 O SER A 135 2.673 7.477 -11.079 1.00 0.00 O ATOM 908 CB SER A 135 4.289 7.613 -13.678 1.00 0.00 C ATOM 909 OG SER A 135 5.340 7.930 -14.573 1.00 0.00 O ATOM 0 H SER A 135 5.199 7.658 -10.898 1.00 0.00 H new ATOM 0 HA SER A 135 4.324 9.615 -12.899 1.00 0.00 H new ATOM 0 HB2 SER A 135 4.424 6.601 -13.298 1.00 0.00 H new ATOM 0 HB3 SER A 135 3.337 7.630 -14.209 1.00 0.00 H new ATOM 0 HG SER A 135 5.349 7.284 -15.310 1.00 0.00 H new ATOM 915 N LEU A 136 2.062 9.474 -11.915 1.00 0.00 N ATOM 916 CA LEU A 136 0.759 9.472 -11.260 1.00 0.00 C ATOM 917 C LEU A 136 -0.066 8.264 -11.691 1.00 0.00 C ATOM 918 O LEU A 136 -0.699 7.605 -10.866 1.00 0.00 O ATOM 919 CB LEU A 136 0.002 10.762 -11.582 1.00 0.00 C ATOM 920 CG LEU A 136 -1.220 11.059 -10.711 1.00 0.00 C ATOM 921 CD1 LEU A 136 -1.839 12.393 -11.098 1.00 0.00 C ATOM 922 CD2 LEU A 136 -2.244 9.939 -10.829 1.00 0.00 C ATOM 0 H LEU A 136 2.248 10.301 -12.482 1.00 0.00 H new ATOM 0 HA LEU A 136 0.922 9.412 -10.184 1.00 0.00 H new ATOM 0 HB2 LEU A 136 0.696 11.598 -11.496 1.00 0.00 H new ATOM 0 HB3 LEU A 136 -0.320 10.721 -12.623 1.00 0.00 H new ATOM 0 HG LEU A 136 -0.896 11.120 -9.672 1.00 0.00 H new ATOM 0 HD11 LEU A 136 -2.707 12.588 -10.468 1.00 0.00 H new ATOM 0 HD12 LEU A 136 -1.106 13.188 -10.961 1.00 0.00 H new ATOM 0 HD13 LEU A 136 -2.149 12.361 -12.143 1.00 0.00 H new ATOM 0 HD21 LEU A 136 -3.106 10.167 -10.203 1.00 0.00 H new ATOM 0 HD22 LEU A 136 -2.564 9.846 -11.867 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -1.796 9.001 -10.502 1.00 0.00 H new ATOM 934 N ASP A 137 -0.052 7.978 -12.989 1.00 0.00 N ATOM 935 CA ASP A 137 -0.796 6.846 -13.530 1.00 0.00 C ATOM 936 C ASP A 137 -0.443 5.560 -12.791 1.00 0.00 C ATOM 937 O ASP A 137 -1.315 4.745 -12.490 1.00 0.00 O ATOM 938 CB ASP A 137 -0.508 6.687 -15.024 1.00 0.00 C ATOM 939 CG ASP A 137 -1.309 5.563 -15.651 1.00 0.00 C ATOM 940 OD1 ASP A 137 -2.539 5.521 -15.438 1.00 0.00 O ATOM 941 OD2 ASP A 137 -0.707 4.725 -16.355 1.00 0.00 O ATOM 0 H ASP A 137 0.466 8.514 -13.685 1.00 0.00 H new ATOM 0 HA ASP A 137 -1.859 7.042 -13.392 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -0.736 7.622 -15.537 1.00 0.00 H new ATOM 0 HB3 ASP A 137 0.555 6.496 -15.168 1.00 0.00 H new ATOM 946 N ALA A 138 0.842 5.383 -12.502 1.00 0.00 N ATOM 947 CA ALA A 138 1.311 4.197 -11.797 1.00 0.00 C ATOM 948 C ALA A 138 0.844 4.200 -10.345 1.00 0.00 C ATOM 949 O ALA A 138 0.400 3.177 -9.824 1.00 0.00 O ATOM 950 CB ALA A 138 2.829 4.107 -11.865 1.00 0.00 C ATOM 0 H ALA A 138 1.577 6.047 -12.746 1.00 0.00 H new ATOM 0 HA ALA A 138 0.884 3.322 -12.287 1.00 0.00 H new ATOM 0 HB1 ALA A 138 3.165 3.216 -11.334 1.00 0.00 H new ATOM 0 HB2 ALA A 138 3.144 4.049 -12.907 1.00 0.00 H new ATOM 0 HB3 ALA A 138 3.267 4.992 -11.403 1.00 0.00 H new ATOM 956 N ALA A 139 0.949 5.355 -9.697 1.00 0.00 N ATOM 957 CA ALA A 139 0.536 5.491 -8.306 1.00 0.00 C ATOM 958 C ALA A 139 -0.925 5.094 -8.126 1.00 0.00 C ATOM 959 O ALA A 139 -1.286 4.456 -7.137 1.00 0.00 O ATOM 960 CB ALA A 139 0.761 6.918 -7.826 1.00 0.00 C ATOM 0 H ALA A 139 1.317 6.210 -10.113 1.00 0.00 H new ATOM 0 HA ALA A 139 1.145 4.817 -7.704 1.00 0.00 H new ATOM 0 HB1 ALA A 139 0.448 7.005 -6.786 1.00 0.00 H new ATOM 0 HB2 ALA A 139 1.819 7.167 -7.909 1.00 0.00 H new ATOM 0 HB3 ALA A 139 0.177 7.604 -8.439 1.00 0.00 H new ATOM 966 N GLN A 140 -1.760 5.476 -9.086 1.00 0.00 N ATOM 967 CA GLN A 140 -3.182 5.160 -9.031 1.00 0.00 C ATOM 968 C GLN A 140 -3.404 3.651 -9.009 1.00 0.00 C ATOM 969 O GLN A 140 -4.108 3.130 -8.145 1.00 0.00 O ATOM 970 CB GLN A 140 -3.910 5.777 -10.227 1.00 0.00 C ATOM 971 CG GLN A 140 -4.234 7.251 -10.047 1.00 0.00 C ATOM 972 CD GLN A 140 -4.426 7.972 -11.367 1.00 0.00 C ATOM 973 OE1 GLN A 140 -3.603 7.855 -12.277 1.00 0.00 O ATOM 974 NE2 GLN A 140 -5.516 8.722 -11.480 1.00 0.00 N ATOM 0 H GLN A 140 -1.477 6.005 -9.911 1.00 0.00 H new ATOM 0 HA GLN A 140 -3.587 5.582 -8.111 1.00 0.00 H new ATOM 0 HB2 GLN A 140 -3.295 5.655 -11.119 1.00 0.00 H new ATOM 0 HB3 GLN A 140 -4.836 5.229 -10.401 1.00 0.00 H new ATOM 0 HG2 GLN A 140 -5.140 7.350 -9.449 1.00 0.00 H new ATOM 0 HG3 GLN A 140 -3.430 7.730 -9.489 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -6.171 8.790 -10.701 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -5.698 9.230 -12.346 1.00 0.00 H new ATOM 983 N ALA A 141 -2.800 2.955 -9.966 1.00 0.00 N ATOM 984 CA ALA A 141 -2.930 1.506 -10.055 1.00 0.00 C ATOM 985 C ALA A 141 -2.723 0.851 -8.694 1.00 0.00 C ATOM 986 O ALA A 141 -3.617 0.186 -8.172 1.00 0.00 O ATOM 987 CB ALA A 141 -1.940 0.948 -11.067 1.00 0.00 C ATOM 0 H ALA A 141 -2.216 3.371 -10.691 1.00 0.00 H new ATOM 0 HA ALA A 141 -3.942 1.277 -10.389 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -2.048 -0.135 -11.123 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -2.137 1.383 -12.047 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -0.925 1.195 -10.757 1.00 0.00 H new ATOM 993 N ALA A 142 -1.538 1.044 -8.124 1.00 0.00 N ATOM 994 CA ALA A 142 -1.214 0.474 -6.822 1.00 0.00 C ATOM 995 C ALA A 142 -2.208 0.931 -5.760 1.00 0.00 C ATOM 996 O ALA A 142 -2.695 0.126 -4.965 1.00 0.00 O ATOM 997 CB ALA A 142 0.204 0.850 -6.419 1.00 0.00 C ATOM 0 H ALA A 142 -0.786 1.591 -8.544 1.00 0.00 H new ATOM 0 HA ALA A 142 -1.281 -0.611 -6.901 1.00 0.00 H new ATOM 0 HB1 ALA A 142 0.432 0.418 -5.445 1.00 0.00 H new ATOM 0 HB2 ALA A 142 0.906 0.467 -7.159 1.00 0.00 H new ATOM 0 HB3 ALA A 142 0.291 1.935 -6.364 1.00 0.00 H new ATOM 1003 N CYS A 143 -2.503 2.226 -5.751 1.00 0.00 N ATOM 1004 CA CYS A 143 -3.438 2.791 -4.785 1.00 0.00 C ATOM 1005 C CYS A 143 -4.651 1.882 -4.607 1.00 0.00 C ATOM 1006 O CYS A 143 -5.070 1.604 -3.484 1.00 0.00 O ATOM 1007 CB CYS A 143 -3.889 4.182 -5.233 1.00 0.00 C ATOM 1008 SG CYS A 143 -4.862 5.075 -3.998 1.00 0.00 S ATOM 0 H CYS A 143 -2.108 2.905 -6.402 1.00 0.00 H new ATOM 0 HA CYS A 143 -2.926 2.875 -3.827 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -3.009 4.774 -5.484 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -4.479 4.085 -6.144 1.00 0.00 H new ATOM 0 HG CYS A 143 -5.135 6.267 -4.440 1.00 0.00 H new ATOM 1014 N ALA A 144 -5.210 1.425 -5.722 1.00 0.00 N ATOM 1015 CA ALA A 144 -6.374 0.548 -5.689 1.00 0.00 C ATOM 1016 C ALA A 144 -5.970 -0.889 -5.379 1.00 0.00 C ATOM 1017 O ALA A 144 -6.360 -1.447 -4.353 1.00 0.00 O ATOM 1018 CB ALA A 144 -7.121 0.614 -7.013 1.00 0.00 C ATOM 0 H ALA A 144 -4.876 1.647 -6.660 1.00 0.00 H new ATOM 0 HA ALA A 144 -7.035 0.892 -4.893 1.00 0.00 H new ATOM 0 HB1 ALA A 144 -7.988 -0.046 -6.975 1.00 0.00 H new ATOM 0 HB2 ALA A 144 -7.451 1.637 -7.194 1.00 0.00 H new ATOM 0 HB3 ALA A 144 -6.460 0.298 -7.820 1.00 0.00 H new ATOM 1024 N LYS A 145 -5.186 -1.484 -6.271 1.00 0.00 N ATOM 1025 CA LYS A 145 -4.728 -2.857 -6.093 1.00 0.00 C ATOM 1026 C LYS A 145 -4.299 -3.105 -4.651 1.00 0.00 C ATOM 1027 O LYS A 145 -4.846 -3.972 -3.971 1.00 0.00 O ATOM 1028 CB LYS A 145 -3.565 -3.156 -7.041 1.00 0.00 C ATOM 1029 CG LYS A 145 -4.003 -3.692 -8.393 1.00 0.00 C ATOM 1030 CD LYS A 145 -4.467 -2.575 -9.313 1.00 0.00 C ATOM 1031 CE LYS A 145 -5.139 -3.124 -10.562 1.00 0.00 C ATOM 1032 NZ LYS A 145 -4.145 -3.609 -11.559 1.00 0.00 N ATOM 0 H LYS A 145 -4.854 -1.037 -7.125 1.00 0.00 H new ATOM 0 HA LYS A 145 -5.559 -3.523 -6.326 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -2.987 -2.244 -7.191 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -2.901 -3.881 -6.570 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -3.175 -4.228 -8.858 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -4.811 -4.411 -8.256 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -5.163 -1.928 -8.779 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -3.614 -1.959 -9.598 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -5.805 -3.941 -10.286 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.757 -2.347 -11.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -4.643 -3.975 -12.396 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -3.525 -2.823 -11.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -3.572 -4.368 -11.137 1.00 0.00 H new ATOM 1046 N MET A 146 -3.318 -2.335 -4.190 1.00 0.00 N ATOM 1047 CA MET A 146 -2.818 -2.470 -2.827 1.00 0.00 C ATOM 1048 C MET A 146 -3.955 -2.354 -1.816 1.00 0.00 C ATOM 1049 O MET A 146 -4.011 -3.105 -0.843 1.00 0.00 O ATOM 1050 CB MET A 146 -1.757 -1.405 -2.542 1.00 0.00 C ATOM 1051 CG MET A 146 -0.462 -1.617 -3.310 1.00 0.00 C ATOM 1052 SD MET A 146 0.232 -3.263 -3.060 1.00 0.00 S ATOM 1053 CE MET A 146 0.680 -3.182 -1.327 1.00 0.00 C ATOM 0 H MET A 146 -2.854 -1.612 -4.740 1.00 0.00 H new ATOM 0 HA MET A 146 -2.367 -3.458 -2.729 1.00 0.00 H new ATOM 0 HB2 MET A 146 -2.162 -0.424 -2.792 1.00 0.00 H new ATOM 0 HB3 MET A 146 -1.539 -1.397 -1.474 1.00 0.00 H new ATOM 0 HG2 MET A 146 -0.645 -1.462 -4.373 1.00 0.00 H new ATOM 0 HG3 MET A 146 0.267 -0.868 -2.999 1.00 0.00 H new ATOM 0 HE1 MET A 146 1.765 -3.127 -1.234 1.00 0.00 H new ATOM 0 HE2 MET A 146 0.232 -2.296 -0.876 1.00 0.00 H new ATOM 0 HE3 MET A 146 0.316 -4.073 -0.815 1.00 0.00 H new ATOM 1063 N ARG A 147 -4.858 -1.409 -2.055 1.00 0.00 N ATOM 1064 CA ARG A 147 -5.992 -1.194 -1.164 1.00 0.00 C ATOM 1065 C ARG A 147 -6.548 -2.524 -0.662 1.00 0.00 C ATOM 1066 O ARG A 147 -7.052 -3.332 -1.442 1.00 0.00 O ATOM 1067 CB ARG A 147 -7.090 -0.409 -1.883 1.00 0.00 C ATOM 1068 CG ARG A 147 -7.951 0.428 -0.950 1.00 0.00 C ATOM 1069 CD ARG A 147 -9.272 0.808 -1.601 1.00 0.00 C ATOM 1070 NE ARG A 147 -10.313 -0.184 -1.346 1.00 0.00 N ATOM 1071 CZ ARG A 147 -10.805 -0.438 -0.139 1.00 0.00 C ATOM 1072 NH1 ARG A 147 -10.353 0.222 0.918 1.00 0.00 N ATOM 1073 NH2 ARG A 147 -11.752 -1.356 0.013 1.00 0.00 N ATOM 0 H ARG A 147 -4.827 -0.780 -2.858 1.00 0.00 H new ATOM 0 HA ARG A 147 -5.645 -0.618 -0.306 1.00 0.00 H new ATOM 0 HB2 ARG A 147 -6.631 0.245 -2.625 1.00 0.00 H new ATOM 0 HB3 ARG A 147 -7.729 -1.107 -2.425 1.00 0.00 H new ATOM 0 HG2 ARG A 147 -8.143 -0.129 -0.033 1.00 0.00 H new ATOM 0 HG3 ARG A 147 -7.411 1.331 -0.667 1.00 0.00 H new ATOM 0 HD2 ARG A 147 -9.596 1.778 -1.224 1.00 0.00 H new ATOM 0 HD3 ARG A 147 -9.129 0.915 -2.676 1.00 0.00 H new ATOM 0 HE ARG A 147 -10.682 -0.710 -2.138 1.00 0.00 H new ATOM 0 HH11 ARG A 147 -9.625 0.928 0.806 1.00 0.00 H new ATOM 0 HH12 ARG A 147 -10.733 0.024 1.844 1.00 0.00 H new ATOM 0 HH21 ARG A 147 -12.102 -1.867 -0.798 1.00 0.00 H new ATOM 0 HH22 ARG A 147 -12.129 -1.551 0.940 1.00 0.00 H new ATOM 1087 N GLY A 148 -6.453 -2.744 0.645 1.00 0.00 N ATOM 1088 CA GLY A 148 -6.950 -3.976 1.229 1.00 0.00 C ATOM 1089 C GLY A 148 -6.153 -5.188 0.788 1.00 0.00 C ATOM 1090 O GLY A 148 -6.698 -6.113 0.186 1.00 0.00 O ATOM 0 H GLY A 148 -6.040 -2.091 1.311 1.00 0.00 H new ATOM 0 HA2 GLY A 148 -6.917 -3.899 2.316 1.00 0.00 H new ATOM 0 HA3 GLY A 148 -7.995 -4.111 0.951 1.00 0.00 H new ATOM 1094 N PHE A 149 -4.858 -5.184 1.088 1.00 0.00 N ATOM 1095 CA PHE A 149 -3.984 -6.291 0.717 1.00 0.00 C ATOM 1096 C PHE A 149 -4.063 -7.415 1.746 1.00 0.00 C ATOM 1097 O PHE A 149 -4.137 -7.182 2.953 1.00 0.00 O ATOM 1098 CB PHE A 149 -2.539 -5.805 0.585 1.00 0.00 C ATOM 1099 CG PHE A 149 -1.740 -6.570 -0.430 1.00 0.00 C ATOM 1100 CD1 PHE A 149 -1.856 -6.284 -1.781 1.00 0.00 C ATOM 1101 CD2 PHE A 149 -0.872 -7.575 -0.035 1.00 0.00 C ATOM 1102 CE1 PHE A 149 -1.122 -6.986 -2.718 1.00 0.00 C ATOM 1103 CE2 PHE A 149 -0.135 -8.281 -0.967 1.00 0.00 C ATOM 1104 CZ PHE A 149 -0.260 -7.985 -2.310 1.00 0.00 C ATOM 0 H PHE A 149 -4.391 -4.427 1.587 1.00 0.00 H new ATOM 0 HA PHE A 149 -4.319 -6.679 -0.245 1.00 0.00 H new ATOM 0 HB2 PHE A 149 -2.543 -4.750 0.312 1.00 0.00 H new ATOM 0 HB3 PHE A 149 -2.048 -5.882 1.555 1.00 0.00 H new ATOM 0 HD1 PHE A 149 -2.528 -5.503 -2.105 1.00 0.00 H new ATOM 0 HD2 PHE A 149 -0.770 -7.810 1.014 1.00 0.00 H new ATOM 0 HE1 PHE A 149 -1.222 -6.754 -3.768 1.00 0.00 H new ATOM 0 HE2 PHE A 149 0.537 -9.063 -0.646 1.00 0.00 H new ATOM 0 HZ PHE A 149 0.316 -8.534 -3.040 1.00 0.00 H new ATOM 1114 N PRO A 150 -4.047 -8.664 1.259 1.00 0.00 N ATOM 1115 CA PRO A 150 -4.116 -9.850 2.118 1.00 0.00 C ATOM 1116 C PRO A 150 -2.844 -10.048 2.935 1.00 0.00 C ATOM 1117 O PRO A 150 -2.694 -11.051 3.636 1.00 0.00 O ATOM 1118 CB PRO A 150 -4.297 -10.999 1.123 1.00 0.00 C ATOM 1119 CG PRO A 150 -3.703 -10.497 -0.147 1.00 0.00 C ATOM 1120 CD PRO A 150 -3.961 -9.016 -0.169 1.00 0.00 C ATOM 0 HA PRO A 150 -4.917 -9.775 2.853 1.00 0.00 H new ATOM 0 HB2 PRO A 150 -3.793 -11.903 1.466 1.00 0.00 H new ATOM 0 HB3 PRO A 150 -5.350 -11.250 0.995 1.00 0.00 H new ATOM 0 HG2 PRO A 150 -2.634 -10.707 -0.188 1.00 0.00 H new ATOM 0 HG3 PRO A 150 -4.157 -10.985 -1.010 1.00 0.00 H new ATOM 0 HD2 PRO A 150 -3.157 -8.475 -0.669 1.00 0.00 H new ATOM 0 HD3 PRO A 150 -4.883 -8.776 -0.698 1.00 0.00 H new ATOM 1128 N LEU A 151 -1.932 -9.088 2.843 1.00 0.00 N ATOM 1129 CA LEU A 151 -0.671 -9.156 3.575 1.00 0.00 C ATOM 1130 C LEU A 151 -0.863 -9.836 4.926 1.00 0.00 C ATOM 1131 O LEU A 151 -1.908 -9.696 5.561 1.00 0.00 O ATOM 1132 CB LEU A 151 -0.098 -7.753 3.774 1.00 0.00 C ATOM 1133 CG LEU A 151 1.333 -7.682 4.308 1.00 0.00 C ATOM 1134 CD1 LEU A 151 2.293 -8.377 3.356 1.00 0.00 C ATOM 1135 CD2 LEU A 151 1.750 -6.235 4.527 1.00 0.00 C ATOM 0 H LEU A 151 -2.041 -8.252 2.269 1.00 0.00 H new ATOM 0 HA LEU A 151 0.031 -9.748 2.987 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -0.135 -7.229 2.819 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -0.748 -7.211 4.461 1.00 0.00 H new ATOM 0 HG LEU A 151 1.368 -8.198 5.267 1.00 0.00 H new ATOM 0 HD11 LEU A 151 3.306 -8.316 3.753 1.00 0.00 H new ATOM 0 HD12 LEU A 151 2.007 -9.423 3.250 1.00 0.00 H new ATOM 0 HD13 LEU A 151 2.255 -7.890 2.381 1.00 0.00 H new ATOM 0 HD21 LEU A 151 2.771 -6.204 4.907 1.00 0.00 H new ATOM 0 HD22 LEU A 151 1.698 -5.694 3.582 1.00 0.00 H new ATOM 0 HD23 LEU A 151 1.080 -5.769 5.249 1.00 0.00 H new ATOM 1147 N GLY A 152 0.154 -10.572 5.363 1.00 0.00 N ATOM 1148 CA GLY A 152 0.079 -11.261 6.638 1.00 0.00 C ATOM 1149 C GLY A 152 -1.042 -12.281 6.680 1.00 0.00 C ATOM 1150 O GLY A 152 -1.019 -13.270 5.948 1.00 0.00 O ATOM 0 H GLY A 152 1.029 -10.704 4.856 1.00 0.00 H new ATOM 0 HA2 GLY A 152 1.028 -11.760 6.834 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.068 -10.531 7.434 1.00 0.00 H new ATOM 1154 N GLY A 153 -2.026 -12.042 7.541 1.00 0.00 N ATOM 1155 CA GLY A 153 -3.146 -12.957 7.661 1.00 0.00 C ATOM 1156 C GLY A 153 -4.423 -12.392 7.071 1.00 0.00 C ATOM 1157 O GLY A 153 -4.448 -11.282 6.539 1.00 0.00 O ATOM 0 H GLY A 153 -2.068 -11.231 8.158 1.00 0.00 H new ATOM 0 HA2 GLY A 153 -2.901 -13.893 7.160 1.00 0.00 H new ATOM 0 HA3 GLY A 153 -3.308 -13.192 8.713 1.00 0.00 H new ATOM 1161 N PRO A 154 -5.514 -13.167 7.159 1.00 0.00 N ATOM 1162 CA PRO A 154 -6.820 -12.758 6.633 1.00 0.00 C ATOM 1163 C PRO A 154 -7.440 -11.624 7.441 1.00 0.00 C ATOM 1164 O PRO A 154 -8.518 -11.130 7.108 1.00 0.00 O ATOM 1165 CB PRO A 154 -7.666 -14.028 6.758 1.00 0.00 C ATOM 1166 CG PRO A 154 -7.028 -14.801 7.861 1.00 0.00 C ATOM 1167 CD PRO A 154 -5.557 -14.502 7.779 1.00 0.00 C ATOM 0 HA PRO A 154 -6.748 -12.376 5.615 1.00 0.00 H new ATOM 0 HB2 PRO A 154 -8.704 -13.791 6.990 1.00 0.00 H new ATOM 0 HB3 PRO A 154 -7.669 -14.595 5.827 1.00 0.00 H new ATOM 0 HG2 PRO A 154 -7.433 -14.506 8.829 1.00 0.00 H new ATOM 0 HG3 PRO A 154 -7.216 -15.869 7.749 1.00 0.00 H new ATOM 0 HD2 PRO A 154 -5.091 -14.502 8.765 1.00 0.00 H new ATOM 0 HD3 PRO A 154 -5.030 -15.242 7.177 1.00 0.00 H new ATOM 1175 N ASP A 155 -6.754 -11.215 8.502 1.00 0.00 N ATOM 1176 CA ASP A 155 -7.238 -10.136 9.356 1.00 0.00 C ATOM 1177 C ASP A 155 -6.441 -8.857 9.120 1.00 0.00 C ATOM 1178 O ASP A 155 -7.004 -7.763 9.078 1.00 0.00 O ATOM 1179 CB ASP A 155 -7.147 -10.543 10.828 1.00 0.00 C ATOM 1180 CG ASP A 155 -7.778 -11.895 11.095 1.00 0.00 C ATOM 1181 OD1 ASP A 155 -9.024 -11.977 11.104 1.00 0.00 O ATOM 1182 OD2 ASP A 155 -7.026 -12.872 11.295 1.00 0.00 O ATOM 0 H ASP A 155 -5.861 -11.614 8.792 1.00 0.00 H new ATOM 0 HA ASP A 155 -8.281 -9.945 9.103 1.00 0.00 H new ATOM 0 HB2 ASP A 155 -6.100 -10.568 11.131 1.00 0.00 H new ATOM 0 HB3 ASP A 155 -7.639 -9.788 11.442 1.00 0.00 H new ATOM 1187 N ARG A 156 -5.129 -9.002 8.966 1.00 0.00 N ATOM 1188 CA ARG A 156 -4.256 -7.858 8.736 1.00 0.00 C ATOM 1189 C ARG A 156 -4.326 -7.405 7.280 1.00 0.00 C ATOM 1190 O ARG A 156 -3.792 -8.064 6.388 1.00 0.00 O ATOM 1191 CB ARG A 156 -2.813 -8.209 9.102 1.00 0.00 C ATOM 1192 CG ARG A 156 -2.648 -8.689 10.535 1.00 0.00 C ATOM 1193 CD ARG A 156 -2.516 -7.523 11.502 1.00 0.00 C ATOM 1194 NE ARG A 156 -3.800 -6.877 11.760 1.00 0.00 N ATOM 1195 CZ ARG A 156 -4.775 -7.436 12.468 1.00 0.00 C ATOM 1196 NH1 ARG A 156 -4.612 -8.645 12.988 1.00 0.00 N ATOM 1197 NH2 ARG A 156 -5.915 -6.785 12.659 1.00 0.00 N ATOM 0 H ARG A 156 -4.647 -9.901 8.996 1.00 0.00 H new ATOM 0 HA ARG A 156 -4.596 -7.040 9.371 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -2.453 -8.983 8.425 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -2.184 -7.332 8.947 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -3.505 -9.301 10.816 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -1.766 -9.325 10.607 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -2.094 -7.878 12.442 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.818 -6.792 11.095 1.00 0.00 H new ATOM 0 HE ARG A 156 -3.957 -5.945 11.375 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -3.736 -9.148 12.845 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -5.362 -9.072 13.531 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -6.043 -5.854 12.262 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -6.663 -7.215 13.203 1.00 0.00 H new ATOM 1211 N ARG A 157 -4.988 -6.276 7.049 1.00 0.00 N ATOM 1212 CA ARG A 157 -5.130 -5.736 5.702 1.00 0.00 C ATOM 1213 C ARG A 157 -4.470 -4.364 5.594 1.00 0.00 C ATOM 1214 O ARG A 157 -4.552 -3.550 6.515 1.00 0.00 O ATOM 1215 CB ARG A 157 -6.609 -5.633 5.323 1.00 0.00 C ATOM 1216 CG ARG A 157 -7.363 -4.565 6.098 1.00 0.00 C ATOM 1217 CD ARG A 157 -8.803 -4.446 5.624 1.00 0.00 C ATOM 1218 NE ARG A 157 -9.624 -5.563 6.082 1.00 0.00 N ATOM 1219 CZ ARG A 157 -10.889 -5.744 5.717 1.00 0.00 C ATOM 1220 NH1 ARG A 157 -11.473 -4.886 4.893 1.00 0.00 N ATOM 1221 NH2 ARG A 157 -11.570 -6.786 6.177 1.00 0.00 N ATOM 0 H ARG A 157 -5.434 -5.718 7.777 1.00 0.00 H new ATOM 0 HA ARG A 157 -4.632 -6.416 5.011 1.00 0.00 H new ATOM 0 HB2 ARG A 157 -6.688 -5.420 4.257 1.00 0.00 H new ATOM 0 HB3 ARG A 157 -7.087 -6.598 5.492 1.00 0.00 H new ATOM 0 HG2 ARG A 157 -7.347 -4.806 7.161 1.00 0.00 H new ATOM 0 HG3 ARG A 157 -6.860 -3.605 5.981 1.00 0.00 H new ATOM 0 HD2 ARG A 157 -9.228 -3.511 5.988 1.00 0.00 H new ATOM 0 HD3 ARG A 157 -8.824 -4.403 4.535 1.00 0.00 H new ATOM 0 HE ARG A 157 -9.204 -6.242 6.717 1.00 0.00 H new ATOM 0 HH11 ARG A 157 -10.951 -4.085 4.538 1.00 0.00 H new ATOM 0 HH12 ARG A 157 -12.444 -5.027 4.614 1.00 0.00 H new ATOM 0 HH21 ARG A 157 -11.123 -7.448 6.811 1.00 0.00 H new ATOM 0 HH22 ARG A 157 -12.541 -6.925 5.897 1.00 0.00 H new ATOM 1235 N LEU A 158 -3.816 -4.115 4.465 1.00 0.00 N ATOM 1236 CA LEU A 158 -3.141 -2.842 4.237 1.00 0.00 C ATOM 1237 C LEU A 158 -4.148 -1.741 3.920 1.00 0.00 C ATOM 1238 O LEU A 158 -5.131 -1.970 3.215 1.00 0.00 O ATOM 1239 CB LEU A 158 -2.135 -2.974 3.092 1.00 0.00 C ATOM 1240 CG LEU A 158 -1.045 -4.031 3.274 1.00 0.00 C ATOM 1241 CD1 LEU A 158 -0.062 -3.990 2.114 1.00 0.00 C ATOM 1242 CD2 LEU A 158 -0.321 -3.828 4.597 1.00 0.00 C ATOM 0 H LEU A 158 -3.739 -4.777 3.693 1.00 0.00 H new ATOM 0 HA LEU A 158 -2.610 -2.571 5.150 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -2.683 -3.200 2.178 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -1.654 -2.007 2.944 1.00 0.00 H new ATOM 0 HG LEU A 158 -1.517 -5.013 3.288 1.00 0.00 H new ATOM 0 HD11 LEU A 158 0.706 -4.749 2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -0.591 -4.185 1.181 1.00 0.00 H new ATOM 0 HD13 LEU A 158 0.405 -3.006 2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 158 0.451 -4.589 4.710 1.00 0.00 H new ATOM 0 HD22 LEU A 158 0.139 -2.840 4.612 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -1.033 -3.910 5.418 1.00 0.00 H new ATOM 1254 N ARG A 159 -3.894 -0.546 4.444 1.00 0.00 N ATOM 1255 CA ARG A 159 -4.778 0.590 4.216 1.00 0.00 C ATOM 1256 C ARG A 159 -4.098 1.641 3.343 1.00 0.00 C ATOM 1257 O ARG A 159 -3.232 2.383 3.806 1.00 0.00 O ATOM 1258 CB ARG A 159 -5.196 1.214 5.549 1.00 0.00 C ATOM 1259 CG ARG A 159 -6.524 1.951 5.487 1.00 0.00 C ATOM 1260 CD ARG A 159 -7.699 0.989 5.550 1.00 0.00 C ATOM 1261 NE ARG A 159 -7.931 0.497 6.906 1.00 0.00 N ATOM 1262 CZ ARG A 159 -9.064 -0.079 7.295 1.00 0.00 C ATOM 1263 NH1 ARG A 159 -10.062 -0.234 6.436 1.00 0.00 N ATOM 1264 NH2 ARG A 159 -9.199 -0.501 8.545 1.00 0.00 N ATOM 0 H ARG A 159 -3.084 -0.340 5.029 1.00 0.00 H new ATOM 0 HA ARG A 159 -5.666 0.229 3.697 1.00 0.00 H new ATOM 0 HB2 ARG A 159 -5.260 0.430 6.303 1.00 0.00 H new ATOM 0 HB3 ARG A 159 -4.420 1.907 5.875 1.00 0.00 H new ATOM 0 HG2 ARG A 159 -6.587 2.659 6.314 1.00 0.00 H new ATOM 0 HG3 ARG A 159 -6.577 2.531 4.566 1.00 0.00 H new ATOM 0 HD2 ARG A 159 -8.597 1.489 5.187 1.00 0.00 H new ATOM 0 HD3 ARG A 159 -7.513 0.146 4.885 1.00 0.00 H new ATOM 0 HE ARG A 159 -7.183 0.601 7.591 1.00 0.00 H new ATOM 0 HH11 ARG A 159 -9.961 0.089 5.474 1.00 0.00 H new ATOM 0 HH12 ARG A 159 -10.930 -0.676 6.737 1.00 0.00 H new ATOM 0 HH21 ARG A 159 -8.433 -0.384 9.208 1.00 0.00 H new ATOM 0 HH22 ARG A 159 -10.069 -0.943 8.843 1.00 0.00 H new ATOM 1278 N VAL A 160 -4.497 1.697 2.076 1.00 0.00 N ATOM 1279 CA VAL A 160 -3.927 2.656 1.137 1.00 0.00 C ATOM 1280 C VAL A 160 -4.922 3.765 0.812 1.00 0.00 C ATOM 1281 O VAL A 160 -6.045 3.499 0.383 1.00 0.00 O ATOM 1282 CB VAL A 160 -3.494 1.971 -0.172 1.00 0.00 C ATOM 1283 CG1 VAL A 160 -2.745 2.949 -1.065 1.00 0.00 C ATOM 1284 CG2 VAL A 160 -2.640 0.747 0.124 1.00 0.00 C ATOM 0 H VAL A 160 -5.213 1.090 1.676 1.00 0.00 H new ATOM 0 HA VAL A 160 -3.050 3.088 1.620 1.00 0.00 H new ATOM 0 HB VAL A 160 -4.388 1.643 -0.702 1.00 0.00 H new ATOM 0 HG11 VAL A 160 -2.447 2.447 -1.985 1.00 0.00 H new ATOM 0 HG12 VAL A 160 -3.393 3.792 -1.305 1.00 0.00 H new ATOM 0 HG13 VAL A 160 -1.858 3.310 -0.545 1.00 0.00 H new ATOM 0 HG21 VAL A 160 -2.343 0.275 -0.813 1.00 0.00 H new ATOM 0 HG22 VAL A 160 -1.750 1.049 0.676 1.00 0.00 H new ATOM 0 HG23 VAL A 160 -3.214 0.038 0.721 1.00 0.00 H new ATOM 1294 N ASP A 161 -4.503 5.008 1.020 1.00 0.00 N ATOM 1295 CA ASP A 161 -5.356 6.159 0.748 1.00 0.00 C ATOM 1296 C ASP A 161 -4.570 7.266 0.054 1.00 0.00 C ATOM 1297 O ASP A 161 -3.548 7.728 0.561 1.00 0.00 O ATOM 1298 CB ASP A 161 -5.967 6.686 2.047 1.00 0.00 C ATOM 1299 CG ASP A 161 -6.867 5.668 2.719 1.00 0.00 C ATOM 1300 OD1 ASP A 161 -7.724 5.084 2.025 1.00 0.00 O ATOM 1301 OD2 ASP A 161 -6.714 5.456 3.941 1.00 0.00 O ATOM 0 H ASP A 161 -3.577 5.245 1.376 1.00 0.00 H new ATOM 0 HA ASP A 161 -6.158 5.837 0.084 1.00 0.00 H new ATOM 0 HB2 ASP A 161 -5.168 6.968 2.732 1.00 0.00 H new ATOM 0 HB3 ASP A 161 -6.540 7.589 1.835 1.00 0.00 H new ATOM 1306 N PHE A 162 -5.054 7.689 -1.110 1.00 0.00 N ATOM 1307 CA PHE A 162 -4.396 8.741 -1.875 1.00 0.00 C ATOM 1308 C PHE A 162 -3.953 9.881 -0.962 1.00 0.00 C ATOM 1309 O PHE A 162 -4.768 10.484 -0.265 1.00 0.00 O ATOM 1310 CB PHE A 162 -5.335 9.276 -2.959 1.00 0.00 C ATOM 1311 CG PHE A 162 -5.402 8.402 -4.178 1.00 0.00 C ATOM 1312 CD1 PHE A 162 -4.266 8.154 -4.932 1.00 0.00 C ATOM 1313 CD2 PHE A 162 -6.600 7.828 -4.570 1.00 0.00 C ATOM 1314 CE1 PHE A 162 -4.325 7.350 -6.055 1.00 0.00 C ATOM 1315 CE2 PHE A 162 -6.665 7.023 -5.692 1.00 0.00 C ATOM 1316 CZ PHE A 162 -5.526 6.783 -6.435 1.00 0.00 C ATOM 0 H PHE A 162 -5.900 7.319 -1.543 1.00 0.00 H new ATOM 0 HA PHE A 162 -3.512 8.313 -2.348 1.00 0.00 H new ATOM 0 HB2 PHE A 162 -6.336 9.381 -2.542 1.00 0.00 H new ATOM 0 HB3 PHE A 162 -5.006 10.273 -3.254 1.00 0.00 H new ATOM 0 HD1 PHE A 162 -3.324 8.594 -4.639 1.00 0.00 H new ATOM 0 HD2 PHE A 162 -7.494 8.011 -3.992 1.00 0.00 H new ATOM 0 HE1 PHE A 162 -3.433 7.165 -6.635 1.00 0.00 H new ATOM 0 HE2 PHE A 162 -7.606 6.582 -5.987 1.00 0.00 H new ATOM 0 HZ PHE A 162 -5.574 6.153 -7.311 1.00 0.00 H new ATOM 1326 N ALA A 163 -2.656 10.169 -0.973 1.00 0.00 N ATOM 1327 CA ALA A 163 -2.103 11.237 -0.148 1.00 0.00 C ATOM 1328 C ALA A 163 -1.789 12.471 -0.987 1.00 0.00 C ATOM 1329 O ALA A 163 -0.659 12.655 -1.441 1.00 0.00 O ATOM 1330 CB ALA A 163 -0.854 10.754 0.573 1.00 0.00 C ATOM 0 H ALA A 163 -1.968 9.678 -1.544 1.00 0.00 H new ATOM 0 HA ALA A 163 -2.852 11.515 0.594 1.00 0.00 H new ATOM 0 HB1 ALA A 163 -0.452 11.561 1.185 1.00 0.00 H new ATOM 0 HB2 ALA A 163 -1.107 9.907 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 163 -0.107 10.447 -0.159 1.00 0.00 H new