USER MOD reduce.3.24.130724 H: found=0, std=0, add=817, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 818 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 Single : A 14 THR OG1 : rot 8:sc= -0.194 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 147:sc= -0.275 (180deg=-1.57!) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 ASN : amide:sc= -3.79! C(o=-3.8!,f=-6.2!) USER MOD Single : A 33 LYS NZ :NH3+ -141:sc= 0.531 (180deg=0.0283) USER MOD Single : A 35 HIS : no HE2:sc= -2.71! C(o=-2.7!,f=-4.7!) USER MOD Single : A 36 SER OG : rot 176:sc= -0.503 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= -0.0434 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 48:sc= 0.369 USER MOD Single : A 53 LYS NZ :NH3+ 149:sc=-0.00145 (180deg=-0.786) USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.0849 USER MOD Single : A 66 ASN : amide:sc= -0.0915 K(o=-0.091,f=-4.7!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 11:sc= 0.28! USER MOD Single : A 73 ASN : amide:sc= -1.61 X(o=-1.6,f=-1.8!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 SER OG : rot 99:sc= 1.11 USER MOD Single : A 83 THR OG1 : rot 132:sc= 1.22 USER MOD Single : A 89 THR OG1 : rot -33:sc= 0.19 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -3.27 K(o=-3.3,f=-4.1!) USER MOD Single : A 99 ASN : amide:sc= -0.0817 K(o=-0.082,f=-5.5!) USER MOD Single : A 102 LYS NZ :NH3+ 155:sc= -0.0214 (180deg=-0.762) USER MOD Single : A 109 LYS NZ :NH3+ -131:sc= 0 (180deg=-1.41!) USER MOD Single : A 114 ASN : amide:sc= -0.922 K(o=-0.92,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 182 N THR A 14 -0.602 6.380 5.922 1.00 0.00 N ATOM 183 CA THR A 14 -1.389 5.480 5.090 1.00 0.00 C ATOM 184 C THR A 14 -2.038 4.383 5.926 1.00 0.00 C ATOM 185 O THR A 14 -1.594 4.093 7.037 1.00 0.00 O ATOM 186 CB THR A 14 -0.526 4.830 3.992 1.00 0.00 C ATOM 187 OG1 THR A 14 0.311 5.817 3.378 1.00 0.00 O ATOM 188 CG2 THR A 14 -1.400 4.171 2.935 1.00 0.00 C ATOM 0 HA THR A 14 -2.166 6.083 4.621 1.00 0.00 H new ATOM 0 HB THR A 14 0.096 4.064 4.456 1.00 0.00 H new ATOM 0 HG1 THR A 14 0.239 6.660 3.872 1.00 0.00 H new ATOM 0 HG21 THR A 14 -0.768 3.719 2.170 1.00 0.00 H new ATOM 0 HG22 THR A 14 -2.015 3.400 3.400 1.00 0.00 H new ATOM 0 HG23 THR A 14 -2.044 4.921 2.476 1.00 0.00 H new ATOM 196 N ALA A 15 -3.089 3.776 5.386 1.00 0.00 N ATOM 197 CA ALA A 15 -3.796 2.708 6.082 1.00 0.00 C ATOM 198 C ALA A 15 -3.060 1.380 5.942 1.00 0.00 C ATOM 199 O ALA A 15 -2.383 1.120 4.947 1.00 0.00 O ATOM 200 CB ALA A 15 -5.218 2.585 5.554 1.00 0.00 C ATOM 0 H ALA A 15 -3.470 4.006 4.468 1.00 0.00 H new ATOM 0 HA ALA A 15 -3.835 2.961 7.141 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -5.734 1.784 6.083 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.748 3.524 5.713 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.192 2.359 4.488 1.00 0.00 H new ATOM 206 N PRO A 16 -3.195 0.517 6.960 1.00 0.00 N ATOM 207 CA PRO A 16 -2.550 -0.799 6.974 1.00 0.00 C ATOM 208 C PRO A 16 -3.162 -1.755 5.955 1.00 0.00 C ATOM 209 O PRO A 16 -4.368 -2.004 5.970 1.00 0.00 O ATOM 210 CB PRO A 16 -2.800 -1.302 8.397 1.00 0.00 C ATOM 211 CG PRO A 16 -4.030 -0.588 8.841 1.00 0.00 C ATOM 212 CD PRO A 16 -3.987 0.761 8.177 1.00 0.00 C ATOM 0 HA PRO A 16 -1.495 -0.738 6.709 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -2.941 -2.383 8.416 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -1.956 -1.079 9.050 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -4.926 -1.137 8.552 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -4.053 -0.488 9.926 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -4.987 1.124 7.940 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -3.520 1.509 8.817 1.00 0.00 H new ATOM 220 N VAL A 17 -2.324 -2.287 5.072 1.00 0.00 N ATOM 221 CA VAL A 17 -2.783 -3.217 4.047 1.00 0.00 C ATOM 222 C VAL A 17 -2.919 -4.629 4.607 1.00 0.00 C ATOM 223 O VAL A 17 -2.054 -5.101 5.344 1.00 0.00 O ATOM 224 CB VAL A 17 -1.822 -3.245 2.843 1.00 0.00 C ATOM 225 CG1 VAL A 17 -2.302 -4.241 1.799 1.00 0.00 C ATOM 226 CG2 VAL A 17 -1.682 -1.855 2.242 1.00 0.00 C ATOM 0 H VAL A 17 -1.324 -2.090 5.045 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.760 -2.865 3.715 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.840 -3.566 3.191 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -1.611 -4.247 0.956 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -2.345 -5.237 2.239 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -3.295 -3.954 1.452 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -1.000 -1.893 1.393 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -2.658 -1.503 1.908 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -1.288 -1.171 2.994 1.00 0.00 H new ATOM 236 N ALA A 18 -4.011 -5.297 4.251 1.00 0.00 N ATOM 237 CA ALA A 18 -4.260 -6.656 4.716 1.00 0.00 C ATOM 238 C ALA A 18 -4.846 -7.519 3.603 1.00 0.00 C ATOM 239 O ALA A 18 -5.920 -7.226 3.077 1.00 0.00 O ATOM 240 CB ALA A 18 -5.191 -6.640 5.919 1.00 0.00 C ATOM 0 H ALA A 18 -4.737 -4.919 3.642 1.00 0.00 H new ATOM 0 HA ALA A 18 -3.306 -7.092 5.014 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.368 -7.661 6.256 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -4.734 -6.066 6.725 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.139 -6.181 5.639 1.00 0.00 H new ATOM 246 N LEU A 19 -4.132 -8.582 3.247 1.00 0.00 N ATOM 247 CA LEU A 19 -4.581 -9.487 2.195 1.00 0.00 C ATOM 248 C LEU A 19 -4.685 -10.917 2.715 1.00 0.00 C ATOM 249 O LEU A 19 -4.476 -11.174 3.901 1.00 0.00 O ATOM 250 CB LEU A 19 -3.622 -9.433 1.005 1.00 0.00 C ATOM 251 CG LEU A 19 -3.386 -8.051 0.395 1.00 0.00 C ATOM 252 CD1 LEU A 19 -2.056 -8.013 -0.342 1.00 0.00 C ATOM 253 CD2 LEU A 19 -4.527 -7.679 -0.541 1.00 0.00 C ATOM 0 H LEU A 19 -3.240 -8.838 3.671 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.571 -9.165 1.871 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -2.660 -9.838 1.320 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -4.005 -10.092 0.225 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.352 -7.320 1.203 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.905 -7.022 -0.770 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -1.248 -8.235 0.355 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.061 -8.755 -1.140 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -4.342 -6.692 -0.966 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -4.593 -8.413 -1.344 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -5.464 -7.665 0.016 1.00 0.00 H new ATOM 265 N ARG A 20 -5.007 -11.845 1.819 1.00 0.00 N ATOM 266 CA ARG A 20 -5.137 -13.250 2.188 1.00 0.00 C ATOM 267 C ARG A 20 -4.214 -14.121 1.342 1.00 0.00 C ATOM 268 O ARG A 20 -4.146 -13.968 0.123 1.00 0.00 O ATOM 269 CB ARG A 20 -6.586 -13.711 2.020 1.00 0.00 C ATOM 270 CG ARG A 20 -6.786 -15.196 2.272 1.00 0.00 C ATOM 271 CD ARG A 20 -8.261 -15.554 2.356 1.00 0.00 C ATOM 272 NE ARG A 20 -8.962 -15.286 1.103 1.00 0.00 N ATOM 273 CZ ARG A 20 -10.256 -15.524 0.919 1.00 0.00 C ATOM 274 NH1 ARG A 20 -10.986 -16.032 1.902 1.00 0.00 N ATOM 275 NH2 ARG A 20 -10.822 -15.253 -0.251 1.00 0.00 N ATOM 0 H ARG A 20 -5.182 -11.649 0.833 1.00 0.00 H new ATOM 0 HA ARG A 20 -4.849 -13.354 3.234 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.220 -13.147 2.704 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -6.919 -13.475 1.009 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.317 -15.768 1.472 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -6.289 -15.479 3.200 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -8.364 -16.609 2.610 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -8.727 -14.985 3.161 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.429 -14.895 0.327 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -10.554 -16.241 2.802 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -11.979 -16.214 1.758 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.263 -14.862 -1.009 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -11.816 -15.436 -0.391 1.00 0.00 H new ATOM 289 N GLU A 21 -3.505 -15.034 1.998 1.00 0.00 N ATOM 290 CA GLU A 21 -2.585 -15.929 1.306 1.00 0.00 C ATOM 291 C GLU A 21 -3.333 -17.106 0.687 1.00 0.00 C ATOM 292 O GLU A 21 -4.397 -17.499 1.163 1.00 0.00 O ATOM 293 CB GLU A 21 -1.514 -16.442 2.271 1.00 0.00 C ATOM 294 CG GLU A 21 -2.071 -16.908 3.606 1.00 0.00 C ATOM 295 CD GLU A 21 -1.045 -17.655 4.437 1.00 0.00 C ATOM 296 OE1 GLU A 21 -0.017 -18.080 3.870 1.00 0.00 O ATOM 297 OE2 GLU A 21 -1.271 -17.813 5.655 1.00 0.00 O ATOM 0 H GLU A 21 -3.550 -15.173 3.007 1.00 0.00 H new ATOM 0 HA GLU A 21 -2.104 -15.366 0.507 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -0.979 -17.268 1.802 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.786 -15.650 2.447 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.429 -16.045 4.167 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -2.931 -17.554 3.431 1.00 0.00 H new ATOM 304 N GLY A 22 -2.767 -17.664 -0.380 1.00 0.00 N ATOM 305 CA GLY A 22 -3.394 -18.790 -1.048 1.00 0.00 C ATOM 306 C GLY A 22 -3.383 -18.647 -2.557 1.00 0.00 C ATOM 307 O GLY A 22 -2.581 -19.283 -3.240 1.00 0.00 O ATOM 0 H GLY A 22 -1.886 -17.356 -0.793 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -2.877 -19.708 -0.769 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -4.423 -18.886 -0.703 1.00 0.00 H new ATOM 311 N GLU A 23 -4.276 -17.812 -3.078 1.00 0.00 N ATOM 312 CA GLU A 23 -4.367 -17.591 -4.516 1.00 0.00 C ATOM 313 C GLU A 23 -3.766 -16.242 -4.899 1.00 0.00 C ATOM 314 O GLU A 23 -3.778 -15.299 -4.108 1.00 0.00 O ATOM 315 CB GLU A 23 -5.825 -17.661 -4.975 1.00 0.00 C ATOM 316 CG GLU A 23 -5.985 -17.988 -6.450 1.00 0.00 C ATOM 317 CD GLU A 23 -7.413 -17.822 -6.933 1.00 0.00 C ATOM 318 OE1 GLU A 23 -8.199 -18.783 -6.798 1.00 0.00 O ATOM 319 OE2 GLU A 23 -7.743 -16.733 -7.446 1.00 0.00 O ATOM 0 H GLU A 23 -4.947 -17.278 -2.526 1.00 0.00 H new ATOM 0 HA GLU A 23 -3.799 -18.377 -5.014 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -6.346 -18.415 -4.386 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.308 -16.706 -4.769 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -5.330 -17.342 -7.035 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -5.662 -19.014 -6.628 1.00 0.00 H new ATOM 326 N ASP A 24 -3.240 -16.159 -6.116 1.00 0.00 N ATOM 327 CA ASP A 24 -2.634 -14.926 -6.605 1.00 0.00 C ATOM 328 C ASP A 24 -3.531 -13.727 -6.313 1.00 0.00 C ATOM 329 O ASP A 24 -4.729 -13.749 -6.601 1.00 0.00 O ATOM 330 CB ASP A 24 -2.367 -15.025 -8.107 1.00 0.00 C ATOM 331 CG ASP A 24 -1.946 -13.698 -8.709 1.00 0.00 C ATOM 332 OD1 ASP A 24 -1.305 -12.899 -7.994 1.00 0.00 O ATOM 333 OD2 ASP A 24 -2.257 -13.459 -9.894 1.00 0.00 O ATOM 0 H ASP A 24 -3.221 -16.931 -6.782 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.687 -14.784 -6.084 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.588 -15.766 -8.287 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.266 -15.380 -8.610 1.00 0.00 H new ATOM 338 N LEU A 25 -2.945 -12.682 -5.739 1.00 0.00 N ATOM 339 CA LEU A 25 -3.691 -11.473 -5.407 1.00 0.00 C ATOM 340 C LEU A 25 -3.584 -10.443 -6.526 1.00 0.00 C ATOM 341 O LEU A 25 -2.882 -9.440 -6.395 1.00 0.00 O ATOM 342 CB LEU A 25 -3.175 -10.876 -4.097 1.00 0.00 C ATOM 343 CG LEU A 25 -3.414 -11.711 -2.838 1.00 0.00 C ATOM 344 CD1 LEU A 25 -4.798 -12.340 -2.870 1.00 0.00 C ATOM 345 CD2 LEU A 25 -2.342 -12.781 -2.697 1.00 0.00 C ATOM 0 H LEU A 25 -1.956 -12.647 -5.494 1.00 0.00 H new ATOM 0 HA LEU A 25 -4.740 -11.744 -5.287 1.00 0.00 H new ATOM 0 HB2 LEU A 25 -2.103 -10.704 -4.197 1.00 0.00 H new ATOM 0 HB3 LEU A 25 -3.642 -9.901 -3.956 1.00 0.00 H new ATOM 0 HG LEU A 25 -3.357 -11.052 -1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 25 -4.950 -12.930 -1.966 1.00 0.00 H new ATOM 0 HD12 LEU A 25 -5.553 -11.556 -2.923 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -4.884 -12.986 -3.744 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -2.528 -13.366 -1.796 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -2.366 -13.437 -3.567 1.00 0.00 H new ATOM 0 HD23 LEU A 25 -1.363 -12.308 -2.627 1.00 0.00 H new ATOM 357 N SER A 26 -4.288 -10.695 -7.625 1.00 0.00 N ATOM 358 CA SER A 26 -4.271 -9.790 -8.768 1.00 0.00 C ATOM 359 C SER A 26 -5.485 -8.866 -8.748 1.00 0.00 C ATOM 360 O SER A 26 -5.399 -7.700 -9.134 1.00 0.00 O ATOM 361 CB SER A 26 -4.243 -10.585 -10.075 1.00 0.00 C ATOM 362 OG SER A 26 -5.343 -11.475 -10.154 1.00 0.00 O ATOM 0 H SER A 26 -4.877 -11.518 -7.748 1.00 0.00 H new ATOM 0 HA SER A 26 -3.370 -9.180 -8.703 1.00 0.00 H new ATOM 0 HB2 SER A 26 -4.264 -9.899 -10.922 1.00 0.00 H new ATOM 0 HB3 SER A 26 -3.311 -11.146 -10.143 1.00 0.00 H new ATOM 0 HG SER A 26 -5.303 -11.970 -10.999 1.00 0.00 H new ATOM 368 N LYS A 27 -6.616 -9.396 -8.294 1.00 0.00 N ATOM 369 CA LYS A 27 -7.849 -8.621 -8.221 1.00 0.00 C ATOM 370 C LYS A 27 -7.773 -7.583 -7.106 1.00 0.00 C ATOM 371 O LYS A 27 -8.251 -6.458 -7.257 1.00 0.00 O ATOM 372 CB LYS A 27 -9.044 -9.548 -7.989 1.00 0.00 C ATOM 373 CG LYS A 27 -9.380 -10.419 -9.187 1.00 0.00 C ATOM 374 CD LYS A 27 -10.093 -9.627 -10.270 1.00 0.00 C ATOM 375 CE LYS A 27 -11.597 -9.599 -10.041 1.00 0.00 C ATOM 376 NZ LYS A 27 -11.999 -8.491 -9.131 1.00 0.00 N ATOM 0 H LYS A 27 -6.704 -10.359 -7.971 1.00 0.00 H new ATOM 0 HA LYS A 27 -7.979 -8.100 -9.170 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -8.835 -10.188 -7.132 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -9.916 -8.946 -7.732 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -8.465 -10.850 -9.593 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -10.009 -11.250 -8.869 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -9.708 -8.608 -10.290 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -9.880 -10.067 -11.244 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -12.108 -9.487 -10.997 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.918 -10.551 -9.618 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.937 -8.138 -9.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.035 -8.841 -8.152 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -11.305 -7.719 -9.197 1.00 0.00 H new ATOM 390 N LYS A 28 -7.169 -7.966 -5.986 1.00 0.00 N ATOM 391 CA LYS A 28 -7.027 -7.068 -4.846 1.00 0.00 C ATOM 392 C LYS A 28 -6.433 -5.731 -5.277 1.00 0.00 C ATOM 393 O LYS A 28 -7.031 -4.678 -5.065 1.00 0.00 O ATOM 394 CB LYS A 28 -6.145 -7.709 -3.773 1.00 0.00 C ATOM 395 CG LYS A 28 -6.608 -9.092 -3.350 1.00 0.00 C ATOM 396 CD LYS A 28 -7.574 -9.023 -2.179 1.00 0.00 C ATOM 397 CE LYS A 28 -9.018 -8.939 -2.651 1.00 0.00 C ATOM 398 NZ LYS A 28 -9.903 -8.323 -1.624 1.00 0.00 N ATOM 0 H LYS A 28 -6.769 -8.894 -5.843 1.00 0.00 H new ATOM 0 HA LYS A 28 -8.019 -6.887 -4.432 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.123 -7.776 -4.147 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -6.122 -7.059 -2.898 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -7.090 -9.588 -4.192 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -5.744 -9.698 -3.075 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -7.447 -9.903 -1.549 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -7.340 -8.154 -1.564 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -9.066 -8.354 -3.570 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -9.381 -9.939 -2.890 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.878 -8.284 -1.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -9.877 -8.895 -0.756 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -9.573 -7.359 -1.414 1.00 0.00 H new ATOM 412 N ASN A 29 -5.251 -5.782 -5.885 1.00 0.00 N ATOM 413 CA ASN A 29 -4.576 -4.575 -6.346 1.00 0.00 C ATOM 414 C ASN A 29 -5.497 -3.743 -7.234 1.00 0.00 C ATOM 415 O ASN A 29 -6.387 -4.263 -7.908 1.00 0.00 O ATOM 416 CB ASN A 29 -3.302 -4.939 -7.112 1.00 0.00 C ATOM 417 CG ASN A 29 -3.597 -5.534 -8.475 1.00 0.00 C ATOM 418 OD1 ASN A 29 -4.322 -4.945 -9.278 1.00 0.00 O ATOM 419 ND2 ASN A 29 -3.035 -6.707 -8.742 1.00 0.00 N ATOM 0 H ASN A 29 -4.742 -6.646 -6.069 1.00 0.00 H new ATOM 0 HA ASN A 29 -4.309 -3.981 -5.472 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -2.687 -4.047 -7.233 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -2.720 -5.650 -6.526 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -3.197 -7.157 -9.643 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -2.441 -7.158 -8.046 1.00 0.00 H new ATOM 426 N PRO A 30 -5.278 -2.420 -7.238 1.00 0.00 N ATOM 427 CA PRO A 30 -4.222 -1.790 -6.440 1.00 0.00 C ATOM 428 C PRO A 30 -4.520 -1.836 -4.945 1.00 0.00 C ATOM 429 O PRO A 30 -5.667 -1.677 -4.525 1.00 0.00 O ATOM 430 CB PRO A 30 -4.216 -0.343 -6.939 1.00 0.00 C ATOM 431 CG PRO A 30 -5.592 -0.116 -7.461 1.00 0.00 C ATOM 432 CD PRO A 30 -6.046 -1.436 -8.020 1.00 0.00 C ATOM 0 HA PRO A 30 -3.265 -2.299 -6.555 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -3.978 0.352 -6.134 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -3.468 -0.196 -7.718 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -6.259 0.222 -6.668 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -5.595 0.656 -8.231 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -7.120 -1.576 -7.898 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.833 -1.516 -9.086 1.00 0.00 H new ATOM 440 N ILE A 31 -3.481 -2.054 -4.146 1.00 0.00 N ATOM 441 CA ILE A 31 -3.631 -2.120 -2.698 1.00 0.00 C ATOM 442 C ILE A 31 -3.163 -0.827 -2.037 1.00 0.00 C ATOM 443 O ILE A 31 -3.291 -0.656 -0.825 1.00 0.00 O ATOM 444 CB ILE A 31 -2.844 -3.302 -2.102 1.00 0.00 C ATOM 445 CG1 ILE A 31 -1.377 -3.235 -2.533 1.00 0.00 C ATOM 446 CG2 ILE A 31 -3.467 -4.622 -2.530 1.00 0.00 C ATOM 447 CD1 ILE A 31 -0.499 -4.260 -1.851 1.00 0.00 C ATOM 0 H ILE A 31 -2.526 -2.188 -4.477 1.00 0.00 H new ATOM 0 HA ILE A 31 -4.693 -2.264 -2.498 1.00 0.00 H new ATOM 0 HB ILE A 31 -2.887 -3.237 -1.015 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -1.317 -3.378 -3.612 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -0.990 -2.238 -2.321 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -2.900 -5.448 -2.101 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -4.498 -4.669 -2.179 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -3.450 -4.697 -3.617 1.00 0.00 H new ATOM 0 HD11 ILE A 31 0.527 -4.154 -2.205 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -0.529 -4.105 -0.773 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -0.861 -5.262 -2.083 1.00 0.00 H new ATOM 459 N ALA A 32 -2.622 0.080 -2.843 1.00 0.00 N ATOM 460 CA ALA A 32 -2.138 1.359 -2.338 1.00 0.00 C ATOM 461 C ALA A 32 -1.690 2.266 -3.479 1.00 0.00 C ATOM 462 O ALA A 32 -0.819 1.902 -4.270 1.00 0.00 O ATOM 463 CB ALA A 32 -0.997 1.141 -1.356 1.00 0.00 C ATOM 0 H ALA A 32 -2.508 -0.047 -3.849 1.00 0.00 H new ATOM 0 HA ALA A 32 -2.961 1.851 -1.819 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -0.645 2.105 -0.987 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.348 0.538 -0.519 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.179 0.624 -1.858 1.00 0.00 H new ATOM 469 N LYS A 33 -2.291 3.448 -3.560 1.00 0.00 N ATOM 470 CA LYS A 33 -1.954 4.409 -4.604 1.00 0.00 C ATOM 471 C LYS A 33 -1.641 5.776 -4.004 1.00 0.00 C ATOM 472 O LYS A 33 -2.399 6.730 -4.182 1.00 0.00 O ATOM 473 CB LYS A 33 -3.105 4.530 -5.604 1.00 0.00 C ATOM 474 CG LYS A 33 -2.661 4.955 -6.994 1.00 0.00 C ATOM 475 CD LYS A 33 -3.846 5.126 -7.929 1.00 0.00 C ATOM 476 CE LYS A 33 -3.435 4.963 -9.385 1.00 0.00 C ATOM 477 NZ LYS A 33 -2.659 6.135 -9.877 1.00 0.00 N ATOM 0 H LYS A 33 -3.015 3.764 -2.914 1.00 0.00 H new ATOM 0 HA LYS A 33 -1.066 4.048 -5.123 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -3.618 3.571 -5.673 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -3.829 5.252 -5.226 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.109 5.892 -6.930 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -1.978 4.210 -7.403 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -4.614 4.393 -7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -4.287 6.112 -7.782 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -2.836 4.059 -9.494 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -4.325 4.832 -10.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -2.940 6.352 -10.855 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.851 6.958 -9.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -1.643 5.915 -9.850 1.00 0.00 H new ATOM 491 N ILE A 34 -0.520 5.864 -3.297 1.00 0.00 N ATOM 492 CA ILE A 34 -0.106 7.116 -2.674 1.00 0.00 C ATOM 493 C ILE A 34 0.295 8.146 -3.725 1.00 0.00 C ATOM 494 O ILE A 34 0.873 7.804 -4.757 1.00 0.00 O ATOM 495 CB ILE A 34 1.073 6.900 -1.707 1.00 0.00 C ATOM 496 CG1 ILE A 34 2.273 6.315 -2.453 1.00 0.00 C ATOM 497 CG2 ILE A 34 0.658 5.989 -0.561 1.00 0.00 C ATOM 498 CD1 ILE A 34 3.160 7.362 -3.088 1.00 0.00 C ATOM 0 H ILE A 34 0.118 5.084 -3.141 1.00 0.00 H new ATOM 0 HA ILE A 34 -0.963 7.488 -2.112 1.00 0.00 H new ATOM 0 HB ILE A 34 1.364 7.865 -1.291 1.00 0.00 H new ATOM 0 HG12 ILE A 34 2.867 5.720 -1.759 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.914 5.637 -3.227 1.00 0.00 H new ATOM 0 HG21 ILE A 34 1.502 5.846 0.114 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -0.169 6.444 -0.016 1.00 0.00 H new ATOM 0 HG23 ILE A 34 0.344 5.024 -0.959 1.00 0.00 H new ATOM 0 HD11 ILE A 34 3.990 6.874 -3.599 1.00 0.00 H new ATOM 0 HD12 ILE A 34 2.581 7.942 -3.807 1.00 0.00 H new ATOM 0 HD13 ILE A 34 3.549 8.026 -2.316 1.00 0.00 H new ATOM 510 N HIS A 35 -0.014 9.410 -3.454 1.00 0.00 N ATOM 511 CA HIS A 35 0.316 10.492 -4.375 1.00 0.00 C ATOM 512 C HIS A 35 1.027 11.628 -3.646 1.00 0.00 C ATOM 513 O HIS A 35 1.121 11.628 -2.419 1.00 0.00 O ATOM 514 CB HIS A 35 -0.950 11.018 -5.052 1.00 0.00 C ATOM 515 CG HIS A 35 -1.970 9.956 -5.325 1.00 0.00 C ATOM 516 ND1 HIS A 35 -3.193 9.905 -4.690 1.00 0.00 N ATOM 517 CD2 HIS A 35 -1.943 8.900 -6.172 1.00 0.00 C ATOM 518 CE1 HIS A 35 -3.873 8.863 -5.133 1.00 0.00 C ATOM 519 NE2 HIS A 35 -3.138 8.237 -6.034 1.00 0.00 N ATOM 0 H HIS A 35 -0.492 9.710 -2.605 1.00 0.00 H new ATOM 0 HA HIS A 35 0.988 10.096 -5.136 1.00 0.00 H new ATOM 0 HB2 HIS A 35 -1.397 11.786 -4.421 1.00 0.00 H new ATOM 0 HB3 HIS A 35 -0.677 11.498 -5.992 1.00 0.00 H new ATOM 0 HD1 HIS A 35 -3.521 10.568 -3.988 1.00 0.00 H new ATOM 0 HD2 HIS A 35 -1.133 8.629 -6.833 1.00 0.00 H new ATOM 0 HE1 HIS A 35 -4.863 8.572 -4.813 1.00 0.00 H new ATOM 528 N SER A 36 1.528 12.593 -4.411 1.00 0.00 N ATOM 529 CA SER A 36 2.235 13.732 -3.838 1.00 0.00 C ATOM 530 C SER A 36 1.334 14.962 -3.788 1.00 0.00 C ATOM 531 O SER A 36 0.686 15.311 -4.775 1.00 0.00 O ATOM 532 CB SER A 36 3.493 14.041 -4.652 1.00 0.00 C ATOM 533 OG SER A 36 4.480 14.664 -3.849 1.00 0.00 O ATOM 0 H SER A 36 1.457 12.609 -5.428 1.00 0.00 H new ATOM 0 HA SER A 36 2.524 13.473 -2.819 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.892 13.119 -5.074 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.238 14.691 -5.489 1.00 0.00 H new ATOM 0 HG SER A 36 5.297 14.792 -4.375 1.00 0.00 H new ATOM 539 N ASP A 37 1.298 15.615 -2.632 1.00 0.00 N ATOM 540 CA ASP A 37 0.477 16.807 -2.452 1.00 0.00 C ATOM 541 C ASP A 37 0.586 17.730 -3.662 1.00 0.00 C ATOM 542 O ASP A 37 -0.420 18.221 -4.174 1.00 0.00 O ATOM 543 CB ASP A 37 0.896 17.554 -1.185 1.00 0.00 C ATOM 544 CG ASP A 37 2.402 17.673 -1.055 1.00 0.00 C ATOM 545 OD1 ASP A 37 3.021 16.755 -0.478 1.00 0.00 O ATOM 546 OD2 ASP A 37 2.961 18.684 -1.528 1.00 0.00 O ATOM 0 H ASP A 37 1.828 15.339 -1.805 1.00 0.00 H new ATOM 0 HA ASP A 37 -0.561 16.491 -2.351 1.00 0.00 H new ATOM 0 HB2 ASP A 37 0.455 18.551 -1.192 1.00 0.00 H new ATOM 0 HB3 ASP A 37 0.499 17.035 -0.313 1.00 0.00 H new ATOM 551 N LEU A 38 1.814 17.962 -4.113 1.00 0.00 N ATOM 552 CA LEU A 38 2.056 18.827 -5.263 1.00 0.00 C ATOM 553 C LEU A 38 1.412 18.253 -6.521 1.00 0.00 C ATOM 554 O LEU A 38 0.913 18.994 -7.367 1.00 0.00 O ATOM 555 CB LEU A 38 3.559 19.008 -5.482 1.00 0.00 C ATOM 556 CG LEU A 38 4.281 19.904 -4.476 1.00 0.00 C ATOM 557 CD1 LEU A 38 5.787 19.733 -4.593 1.00 0.00 C ATOM 558 CD2 LEU A 38 3.890 21.361 -4.682 1.00 0.00 C ATOM 0 H LEU A 38 2.657 17.563 -3.700 1.00 0.00 H new ATOM 0 HA LEU A 38 1.606 19.798 -5.058 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.029 18.025 -5.465 1.00 0.00 H new ATOM 0 HB3 LEU A 38 3.714 19.418 -6.480 1.00 0.00 H new ATOM 0 HG LEU A 38 3.979 19.606 -3.472 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.284 20.379 -3.869 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.052 18.694 -4.395 1.00 0.00 H new ATOM 0 HD13 LEU A 38 6.107 20.003 -5.599 1.00 0.00 H new ATOM 0 HD21 LEU A 38 4.414 21.984 -3.957 1.00 0.00 H new ATOM 0 HD22 LEU A 38 4.162 21.672 -5.691 1.00 0.00 H new ATOM 0 HD23 LEU A 38 2.814 21.472 -4.546 1.00 0.00 H new ATOM 570 N ALA A 39 1.426 16.929 -6.635 1.00 0.00 N ATOM 571 CA ALA A 39 0.839 16.256 -7.787 1.00 0.00 C ATOM 572 C ALA A 39 -0.594 16.719 -8.023 1.00 0.00 C ATOM 573 O ALA A 39 -0.970 17.056 -9.146 1.00 0.00 O ATOM 574 CB ALA A 39 0.884 14.747 -7.596 1.00 0.00 C ATOM 0 H ALA A 39 1.837 16.302 -5.944 1.00 0.00 H new ATOM 0 HA ALA A 39 1.426 16.518 -8.667 1.00 0.00 H new ATOM 0 HB1 ALA A 39 0.442 14.257 -8.464 1.00 0.00 H new ATOM 0 HB2 ALA A 39 1.919 14.425 -7.485 1.00 0.00 H new ATOM 0 HB3 ALA A 39 0.322 14.477 -6.702 1.00 0.00 H new ATOM 580 N GLU A 40 -1.390 16.733 -6.959 1.00 0.00 N ATOM 581 CA GLU A 40 -2.783 17.154 -7.052 1.00 0.00 C ATOM 582 C GLU A 40 -2.900 18.672 -6.953 1.00 0.00 C ATOM 583 O GLU A 40 -3.561 19.308 -7.773 1.00 0.00 O ATOM 584 CB GLU A 40 -3.613 16.494 -5.949 1.00 0.00 C ATOM 585 CG GLU A 40 -5.105 16.756 -6.071 1.00 0.00 C ATOM 586 CD GLU A 40 -5.518 18.075 -5.448 1.00 0.00 C ATOM 587 OE1 GLU A 40 -5.461 19.106 -6.151 1.00 0.00 O ATOM 588 OE2 GLU A 40 -5.898 18.076 -4.258 1.00 0.00 O ATOM 0 H GLU A 40 -1.094 16.458 -6.022 1.00 0.00 H new ATOM 0 HA GLU A 40 -3.167 16.840 -8.023 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -3.439 15.418 -5.969 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -3.267 16.855 -4.980 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -5.386 16.752 -7.124 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -5.653 15.945 -5.592 1.00 0.00 H new ATOM 595 N GLU A 41 -2.254 19.245 -5.942 1.00 0.00 N ATOM 596 CA GLU A 41 -2.288 20.688 -5.734 1.00 0.00 C ATOM 597 C GLU A 41 -2.113 21.431 -7.055 1.00 0.00 C ATOM 598 O GLU A 41 -2.863 22.358 -7.362 1.00 0.00 O ATOM 599 CB GLU A 41 -1.195 21.109 -4.750 1.00 0.00 C ATOM 600 CG GLU A 41 -1.498 20.740 -3.308 1.00 0.00 C ATOM 601 CD GLU A 41 -2.307 21.804 -2.592 1.00 0.00 C ATOM 602 OE1 GLU A 41 -3.488 21.994 -2.952 1.00 0.00 O ATOM 603 OE2 GLU A 41 -1.760 22.446 -1.671 1.00 0.00 O ATOM 0 H GLU A 41 -1.701 18.732 -5.255 1.00 0.00 H new ATOM 0 HA GLU A 41 -3.261 20.947 -5.317 1.00 0.00 H new ATOM 0 HB2 GLU A 41 -0.254 20.644 -5.045 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -1.053 22.188 -4.818 1.00 0.00 H new ATOM 0 HG2 GLU A 41 -2.044 19.797 -3.285 1.00 0.00 H new ATOM 0 HG3 GLU A 41 -0.562 20.579 -2.773 1.00 0.00 H new ATOM 610 N ARG A 42 -1.116 21.019 -7.832 1.00 0.00 N ATOM 611 CA ARG A 42 -0.841 21.646 -9.119 1.00 0.00 C ATOM 612 C ARG A 42 -1.408 20.811 -10.263 1.00 0.00 C ATOM 613 O ARG A 42 -2.415 21.174 -10.870 1.00 0.00 O ATOM 614 CB ARG A 42 0.666 21.833 -9.307 1.00 0.00 C ATOM 615 CG ARG A 42 1.284 22.819 -8.330 1.00 0.00 C ATOM 616 CD ARG A 42 0.917 24.253 -8.678 1.00 0.00 C ATOM 617 NE ARG A 42 1.807 24.816 -9.690 1.00 0.00 N ATOM 618 CZ ARG A 42 3.106 25.013 -9.498 1.00 0.00 C ATOM 619 NH1 ARG A 42 3.664 24.694 -8.338 1.00 0.00 N ATOM 620 NH2 ARG A 42 3.851 25.530 -10.467 1.00 0.00 N ATOM 0 H ARG A 42 -0.486 20.254 -7.592 1.00 0.00 H new ATOM 0 HA ARG A 42 -1.326 22.622 -9.131 1.00 0.00 H new ATOM 0 HB2 ARG A 42 1.160 20.868 -9.197 1.00 0.00 H new ATOM 0 HB3 ARG A 42 0.857 22.175 -10.324 1.00 0.00 H new ATOM 0 HG2 ARG A 42 0.946 22.591 -7.319 1.00 0.00 H new ATOM 0 HG3 ARG A 42 2.368 22.708 -8.337 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -0.111 24.286 -9.040 1.00 0.00 H new ATOM 0 HD3 ARG A 42 0.958 24.866 -7.778 1.00 0.00 H new ATOM 0 HE ARG A 42 1.409 25.072 -10.594 1.00 0.00 H new ATOM 0 HH11 ARG A 42 3.095 24.296 -7.591 1.00 0.00 H new ATOM 0 HH12 ARG A 42 4.662 24.846 -8.193 1.00 0.00 H new ATOM 0 HH21 ARG A 42 3.426 25.777 -11.361 1.00 0.00 H new ATOM 0 HH22 ARG A 42 4.849 25.681 -10.318 1.00 0.00 H new ATOM 634 N GLY A 43 -0.753 19.691 -10.553 1.00 0.00 N ATOM 635 CA GLY A 43 -1.206 18.823 -11.624 1.00 0.00 C ATOM 636 C GLY A 43 -0.066 18.337 -12.498 1.00 0.00 C ATOM 637 O GLY A 43 -0.206 18.244 -13.718 1.00 0.00 O ATOM 0 H GLY A 43 0.083 19.369 -10.065 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.724 17.964 -11.197 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -1.929 19.358 -12.240 1.00 0.00 H new ATOM 641 N LEU A 44 1.065 18.028 -11.874 1.00 0.00 N ATOM 642 CA LEU A 44 2.235 17.551 -12.603 1.00 0.00 C ATOM 643 C LEU A 44 2.377 16.038 -12.474 1.00 0.00 C ATOM 644 O LEU A 44 1.572 15.382 -11.813 1.00 0.00 O ATOM 645 CB LEU A 44 3.499 18.240 -12.085 1.00 0.00 C ATOM 646 CG LEU A 44 3.518 19.766 -12.177 1.00 0.00 C ATOM 647 CD1 LEU A 44 2.876 20.383 -10.944 1.00 0.00 C ATOM 648 CD2 LEU A 44 4.942 20.273 -12.349 1.00 0.00 C ATOM 0 H LEU A 44 1.197 18.099 -10.865 1.00 0.00 H new ATOM 0 HA LEU A 44 2.101 17.796 -13.657 1.00 0.00 H new ATOM 0 HB2 LEU A 44 3.641 17.957 -11.042 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.353 17.852 -12.640 1.00 0.00 H new ATOM 0 HG LEU A 44 2.940 20.065 -13.051 1.00 0.00 H new ATOM 0 HD11 LEU A 44 2.899 21.470 -11.027 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.842 20.047 -10.865 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.426 20.076 -10.055 1.00 0.00 H new ATOM 0 HD21 LEU A 44 4.936 21.361 -12.413 1.00 0.00 H new ATOM 0 HD22 LEU A 44 5.544 19.963 -11.495 1.00 0.00 H new ATOM 0 HD23 LEU A 44 5.368 19.859 -13.263 1.00 0.00 H new ATOM 660 N LYS A 45 3.409 15.490 -13.108 1.00 0.00 N ATOM 661 CA LYS A 45 3.660 14.054 -13.062 1.00 0.00 C ATOM 662 C LYS A 45 4.733 13.723 -12.029 1.00 0.00 C ATOM 663 O LYS A 45 5.921 13.673 -12.350 1.00 0.00 O ATOM 664 CB LYS A 45 4.089 13.546 -14.440 1.00 0.00 C ATOM 665 CG LYS A 45 3.766 12.081 -14.676 1.00 0.00 C ATOM 666 CD LYS A 45 4.314 11.597 -16.008 1.00 0.00 C ATOM 667 CE LYS A 45 5.821 11.398 -15.951 1.00 0.00 C ATOM 668 NZ LYS A 45 6.283 10.376 -16.931 1.00 0.00 N ATOM 0 H LYS A 45 4.085 16.019 -13.660 1.00 0.00 H new ATOM 0 HA LYS A 45 2.734 13.557 -12.771 1.00 0.00 H new ATOM 0 HB2 LYS A 45 3.599 14.145 -15.207 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.163 13.696 -14.555 1.00 0.00 H new ATOM 0 HG2 LYS A 45 4.186 11.480 -13.869 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.686 11.937 -14.652 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.832 10.658 -16.282 1.00 0.00 H new ATOM 0 HD3 LYS A 45 4.070 12.319 -16.787 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.320 12.346 -16.152 1.00 0.00 H new ATOM 0 HE3 LYS A 45 6.109 11.093 -14.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 7.315 10.270 -16.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 5.826 9.465 -16.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 6.031 10.679 -17.893 1.00 0.00 H new ATOM 682 N ILE A 46 4.307 13.495 -10.792 1.00 0.00 N ATOM 683 CA ILE A 46 5.231 13.165 -9.714 1.00 0.00 C ATOM 684 C ILE A 46 5.638 11.697 -9.769 1.00 0.00 C ATOM 685 O ILE A 46 4.803 10.816 -9.979 1.00 0.00 O ATOM 686 CB ILE A 46 4.618 13.465 -8.334 1.00 0.00 C ATOM 687 CG1 ILE A 46 4.224 14.941 -8.237 1.00 0.00 C ATOM 688 CG2 ILE A 46 5.596 13.098 -7.228 1.00 0.00 C ATOM 689 CD1 ILE A 46 5.399 15.865 -8.007 1.00 0.00 C ATOM 0 H ILE A 46 3.327 13.533 -10.511 1.00 0.00 H new ATOM 0 HA ILE A 46 6.113 13.790 -9.853 1.00 0.00 H new ATOM 0 HB ILE A 46 3.720 12.860 -8.212 1.00 0.00 H new ATOM 0 HG12 ILE A 46 3.716 15.234 -9.155 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.509 15.065 -7.423 1.00 0.00 H new ATOM 0 HG21 ILE A 46 5.148 13.316 -6.259 1.00 0.00 H new ATOM 0 HG22 ILE A 46 5.831 12.035 -7.288 1.00 0.00 H new ATOM 0 HG23 ILE A 46 6.511 13.679 -7.344 1.00 0.00 H new ATOM 0 HD11 ILE A 46 5.046 16.895 -7.949 1.00 0.00 H new ATOM 0 HD12 ILE A 46 5.895 15.598 -7.074 1.00 0.00 H new ATOM 0 HD13 ILE A 46 6.104 15.769 -8.833 1.00 0.00 H new ATOM 701 N THR A 47 6.928 11.438 -9.576 1.00 0.00 N ATOM 702 CA THR A 47 7.447 10.076 -9.602 1.00 0.00 C ATOM 703 C THR A 47 7.557 9.502 -8.195 1.00 0.00 C ATOM 704 O THR A 47 7.929 10.206 -7.255 1.00 0.00 O ATOM 705 CB THR A 47 8.829 10.014 -10.280 1.00 0.00 C ATOM 706 OG1 THR A 47 8.742 10.522 -11.616 1.00 0.00 O ATOM 707 CG2 THR A 47 9.354 8.587 -10.307 1.00 0.00 C ATOM 0 H THR A 47 7.633 12.154 -9.400 1.00 0.00 H new ATOM 0 HA THR A 47 6.740 9.480 -10.180 1.00 0.00 H new ATOM 0 HB THR A 47 9.521 10.628 -9.703 1.00 0.00 H new ATOM 0 HG1 THR A 47 9.625 10.481 -12.040 1.00 0.00 H new ATOM 0 HG21 THR A 47 10.331 8.568 -10.790 1.00 0.00 H new ATOM 0 HG22 THR A 47 9.446 8.214 -9.287 1.00 0.00 H new ATOM 0 HG23 THR A 47 8.662 7.955 -10.863 1.00 0.00 H new ATOM 715 N TYR A 48 7.233 8.222 -8.055 1.00 0.00 N ATOM 716 CA TYR A 48 7.295 7.554 -6.761 1.00 0.00 C ATOM 717 C TYR A 48 8.365 6.467 -6.759 1.00 0.00 C ATOM 718 O TYR A 48 9.070 6.270 -7.749 1.00 0.00 O ATOM 719 CB TYR A 48 5.935 6.948 -6.411 1.00 0.00 C ATOM 720 CG TYR A 48 4.769 7.861 -6.715 1.00 0.00 C ATOM 721 CD1 TYR A 48 4.410 8.877 -5.838 1.00 0.00 C ATOM 722 CD2 TYR A 48 4.025 7.706 -7.878 1.00 0.00 C ATOM 723 CE1 TYR A 48 3.344 9.713 -6.112 1.00 0.00 C ATOM 724 CE2 TYR A 48 2.959 8.538 -8.161 1.00 0.00 C ATOM 725 CZ TYR A 48 2.623 9.540 -7.274 1.00 0.00 C ATOM 726 OH TYR A 48 1.561 10.370 -7.551 1.00 0.00 O ATOM 0 H TYR A 48 6.924 7.626 -8.823 1.00 0.00 H new ATOM 0 HA TYR A 48 7.558 8.298 -6.009 1.00 0.00 H new ATOM 0 HB2 TYR A 48 5.809 6.016 -6.962 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.921 6.696 -5.351 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.973 9.016 -4.927 1.00 0.00 H new ATOM 0 HD2 TYR A 48 4.285 6.921 -8.573 1.00 0.00 H new ATOM 0 HE1 TYR A 48 3.077 10.498 -5.419 1.00 0.00 H new ATOM 0 HE2 TYR A 48 2.392 8.405 -9.071 1.00 0.00 H new ATOM 0 HH TYR A 48 1.161 10.115 -8.409 1.00 0.00 H new ATOM 736 N LYS A 49 8.480 5.761 -5.639 1.00 0.00 N ATOM 737 CA LYS A 49 9.461 4.691 -5.506 1.00 0.00 C ATOM 738 C LYS A 49 9.203 3.869 -4.247 1.00 0.00 C ATOM 739 O LYS A 49 8.750 4.398 -3.231 1.00 0.00 O ATOM 740 CB LYS A 49 10.877 5.271 -5.467 1.00 0.00 C ATOM 741 CG LYS A 49 11.967 4.214 -5.453 1.00 0.00 C ATOM 742 CD LYS A 49 13.349 4.836 -5.566 1.00 0.00 C ATOM 743 CE LYS A 49 13.836 5.357 -4.223 1.00 0.00 C ATOM 744 NZ LYS A 49 15.323 5.379 -4.143 1.00 0.00 N ATOM 0 H LYS A 49 7.905 5.911 -4.810 1.00 0.00 H new ATOM 0 HA LYS A 49 9.366 4.036 -6.372 1.00 0.00 H new ATOM 0 HB2 LYS A 49 11.020 5.917 -6.333 1.00 0.00 H new ATOM 0 HB3 LYS A 49 10.979 5.898 -4.581 1.00 0.00 H new ATOM 0 HG2 LYS A 49 11.902 3.635 -4.532 1.00 0.00 H new ATOM 0 HG3 LYS A 49 11.811 3.519 -6.278 1.00 0.00 H new ATOM 0 HD2 LYS A 49 14.052 4.096 -5.947 1.00 0.00 H new ATOM 0 HD3 LYS A 49 13.324 5.653 -6.287 1.00 0.00 H new ATOM 0 HE2 LYS A 49 13.449 6.363 -4.062 1.00 0.00 H new ATOM 0 HE3 LYS A 49 13.439 4.730 -3.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 15.615 5.740 -3.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 15.692 4.415 -4.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 15.702 5.997 -4.889 1.00 0.00 H new ATOM 758 N TYR A 50 9.495 2.575 -4.320 1.00 0.00 N ATOM 759 CA TYR A 50 9.293 1.681 -3.187 1.00 0.00 C ATOM 760 C TYR A 50 10.572 0.916 -2.862 1.00 0.00 C ATOM 761 O TYR A 50 11.196 0.321 -3.742 1.00 0.00 O ATOM 762 CB TYR A 50 8.159 0.698 -3.481 1.00 0.00 C ATOM 763 CG TYR A 50 6.795 1.348 -3.547 1.00 0.00 C ATOM 764 CD1 TYR A 50 6.437 2.148 -4.626 1.00 0.00 C ATOM 765 CD2 TYR A 50 5.866 1.164 -2.532 1.00 0.00 C ATOM 766 CE1 TYR A 50 5.193 2.745 -4.691 1.00 0.00 C ATOM 767 CE2 TYR A 50 4.619 1.756 -2.589 1.00 0.00 C ATOM 768 CZ TYR A 50 4.287 2.546 -3.670 1.00 0.00 C ATOM 769 OH TYR A 50 3.047 3.138 -3.730 1.00 0.00 O ATOM 0 H TYR A 50 9.872 2.122 -5.152 1.00 0.00 H new ATOM 0 HA TYR A 50 9.024 2.288 -2.322 1.00 0.00 H new ATOM 0 HB2 TYR A 50 8.360 0.198 -4.428 1.00 0.00 H new ATOM 0 HB3 TYR A 50 8.148 -0.072 -2.710 1.00 0.00 H new ATOM 0 HD1 TYR A 50 7.144 2.306 -5.427 1.00 0.00 H new ATOM 0 HD2 TYR A 50 6.122 0.547 -1.683 1.00 0.00 H new ATOM 0 HE1 TYR A 50 4.931 3.364 -5.536 1.00 0.00 H new ATOM 0 HE2 TYR A 50 3.908 1.601 -1.791 1.00 0.00 H new ATOM 0 HH TYR A 50 2.530 2.896 -2.933 1.00 0.00 H new ATOM 779 N THR A 51 10.959 0.936 -1.590 1.00 0.00 N ATOM 780 CA THR A 51 12.164 0.246 -1.146 1.00 0.00 C ATOM 781 C THR A 51 11.892 -0.589 0.100 1.00 0.00 C ATOM 782 O THR A 51 11.644 -0.051 1.178 1.00 0.00 O ATOM 783 CB THR A 51 13.302 1.239 -0.847 1.00 0.00 C ATOM 784 OG1 THR A 51 12.840 2.260 0.045 1.00 0.00 O ATOM 785 CG2 THR A 51 13.818 1.874 -2.129 1.00 0.00 C ATOM 0 H THR A 51 10.455 1.423 -0.849 1.00 0.00 H new ATOM 0 HA THR A 51 12.470 -0.411 -1.960 1.00 0.00 H new ATOM 0 HB THR A 51 14.119 0.690 -0.378 1.00 0.00 H new ATOM 0 HG1 THR A 51 12.371 1.847 0.800 1.00 0.00 H new ATOM 0 HG21 THR A 51 14.621 2.572 -1.892 1.00 0.00 H new ATOM 0 HG22 THR A 51 14.196 1.097 -2.793 1.00 0.00 H new ATOM 0 HG23 THR A 51 13.007 2.409 -2.622 1.00 0.00 H new ATOM 793 N GLY A 52 11.941 -1.909 -0.055 1.00 0.00 N ATOM 794 CA GLY A 52 11.698 -2.797 1.067 1.00 0.00 C ATOM 795 C GLY A 52 11.564 -4.246 0.641 1.00 0.00 C ATOM 796 O GLY A 52 11.551 -4.552 -0.551 1.00 0.00 O ATOM 0 H GLY A 52 12.145 -2.379 -0.937 1.00 0.00 H new ATOM 0 HA2 GLY A 52 12.515 -2.706 1.782 1.00 0.00 H new ATOM 0 HA3 GLY A 52 10.788 -2.487 1.581 1.00 0.00 H new ATOM 800 N LYS A 53 11.467 -5.141 1.618 1.00 0.00 N ATOM 801 CA LYS A 53 11.334 -6.566 1.339 1.00 0.00 C ATOM 802 C LYS A 53 10.415 -6.804 0.146 1.00 0.00 C ATOM 803 O LYS A 53 9.369 -6.169 0.019 1.00 0.00 O ATOM 804 CB LYS A 53 10.791 -7.298 2.569 1.00 0.00 C ATOM 805 CG LYS A 53 11.026 -8.799 2.536 1.00 0.00 C ATOM 806 CD LYS A 53 10.065 -9.534 3.455 1.00 0.00 C ATOM 807 CE LYS A 53 10.560 -9.534 4.894 1.00 0.00 C ATOM 808 NZ LYS A 53 10.199 -8.276 5.605 1.00 0.00 N ATOM 0 H LYS A 53 11.478 -4.905 2.610 1.00 0.00 H new ATOM 0 HA LYS A 53 12.322 -6.957 1.097 1.00 0.00 H new ATOM 0 HB2 LYS A 53 11.258 -6.885 3.463 1.00 0.00 H new ATOM 0 HB3 LYS A 53 9.721 -7.108 2.652 1.00 0.00 H new ATOM 0 HG2 LYS A 53 10.907 -9.165 1.516 1.00 0.00 H new ATOM 0 HG3 LYS A 53 12.052 -9.014 2.834 1.00 0.00 H new ATOM 0 HD2 LYS A 53 9.083 -9.064 3.407 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.944 -10.561 3.111 1.00 0.00 H new ATOM 0 HE2 LYS A 53 10.134 -10.386 5.424 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.643 -9.660 4.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 10.057 -8.477 6.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 10.966 -7.582 5.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 9.322 -7.889 5.202 1.00 0.00 H new ATOM 822 N GLY A 54 10.812 -7.725 -0.728 1.00 0.00 N ATOM 823 CA GLY A 54 10.012 -8.031 -1.899 1.00 0.00 C ATOM 824 C GLY A 54 10.598 -7.450 -3.170 1.00 0.00 C ATOM 825 O GLY A 54 10.675 -8.130 -4.193 1.00 0.00 O ATOM 0 H GLY A 54 11.674 -8.264 -0.645 1.00 0.00 H new ATOM 0 HA2 GLY A 54 9.926 -9.113 -2.004 1.00 0.00 H new ATOM 0 HA3 GLY A 54 9.003 -7.643 -1.757 1.00 0.00 H new ATOM 829 N ILE A 55 11.012 -6.189 -3.106 1.00 0.00 N ATOM 830 CA ILE A 55 11.593 -5.517 -4.262 1.00 0.00 C ATOM 831 C ILE A 55 13.116 -5.579 -4.224 1.00 0.00 C ATOM 832 O ILE A 55 13.751 -6.094 -5.145 1.00 0.00 O ATOM 833 CB ILE A 55 11.152 -4.043 -4.337 1.00 0.00 C ATOM 834 CG1 ILE A 55 9.626 -3.946 -4.374 1.00 0.00 C ATOM 835 CG2 ILE A 55 11.761 -3.369 -5.558 1.00 0.00 C ATOM 836 CD1 ILE A 55 9.098 -2.574 -4.014 1.00 0.00 C ATOM 0 H ILE A 55 10.956 -5.612 -2.267 1.00 0.00 H new ATOM 0 HA ILE A 55 11.232 -6.041 -5.147 1.00 0.00 H new ATOM 0 HB ILE A 55 11.509 -3.527 -3.446 1.00 0.00 H new ATOM 0 HG12 ILE A 55 9.277 -4.210 -5.372 1.00 0.00 H new ATOM 0 HG13 ILE A 55 9.207 -4.680 -3.686 1.00 0.00 H new ATOM 0 HG21 ILE A 55 11.440 -2.328 -5.597 1.00 0.00 H new ATOM 0 HG22 ILE A 55 12.848 -3.411 -5.493 1.00 0.00 H new ATOM 0 HG23 ILE A 55 11.432 -3.884 -6.460 1.00 0.00 H new ATOM 0 HD11 ILE A 55 8.009 -2.579 -4.061 1.00 0.00 H new ATOM 0 HD12 ILE A 55 9.416 -2.315 -3.004 1.00 0.00 H new ATOM 0 HD13 ILE A 55 9.488 -1.838 -4.717 1.00 0.00 H new ATOM 848 N THR A 56 13.699 -5.051 -3.152 1.00 0.00 N ATOM 849 CA THR A 56 15.147 -5.047 -2.993 1.00 0.00 C ATOM 850 C THR A 56 15.647 -6.387 -2.464 1.00 0.00 C ATOM 851 O THR A 56 16.585 -6.967 -3.008 1.00 0.00 O ATOM 852 CB THR A 56 15.604 -3.928 -2.038 1.00 0.00 C ATOM 853 OG1 THR A 56 15.012 -4.114 -0.747 1.00 0.00 O ATOM 854 CG2 THR A 56 15.223 -2.561 -2.584 1.00 0.00 C ATOM 0 H THR A 56 13.189 -4.620 -2.381 1.00 0.00 H new ATOM 0 HA THR A 56 15.572 -4.868 -3.981 1.00 0.00 H new ATOM 0 HB THR A 56 16.689 -3.976 -1.950 1.00 0.00 H new ATOM 0 HG1 THR A 56 15.309 -3.400 -0.145 1.00 0.00 H new ATOM 0 HG21 THR A 56 15.556 -1.787 -1.892 1.00 0.00 H new ATOM 0 HG22 THR A 56 15.699 -2.411 -3.553 1.00 0.00 H new ATOM 0 HG23 THR A 56 14.141 -2.504 -2.698 1.00 0.00 H new ATOM 862 N GLU A 57 15.012 -6.872 -1.401 1.00 0.00 N ATOM 863 CA GLU A 57 15.394 -8.144 -0.799 1.00 0.00 C ATOM 864 C GLU A 57 14.412 -9.246 -1.188 1.00 0.00 C ATOM 865 O GLU A 57 13.248 -8.993 -1.499 1.00 0.00 O ATOM 866 CB GLU A 57 15.456 -8.015 0.724 1.00 0.00 C ATOM 867 CG GLU A 57 16.777 -7.465 1.235 1.00 0.00 C ATOM 868 CD GLU A 57 16.956 -7.668 2.727 1.00 0.00 C ATOM 869 OE1 GLU A 57 16.959 -8.835 3.171 1.00 0.00 O ATOM 870 OE2 GLU A 57 17.093 -6.659 3.450 1.00 0.00 O ATOM 0 H GLU A 57 14.232 -6.404 -0.940 1.00 0.00 H new ATOM 0 HA GLU A 57 16.382 -8.412 -1.174 1.00 0.00 H new ATOM 0 HB2 GLU A 57 14.648 -7.365 1.058 1.00 0.00 H new ATOM 0 HB3 GLU A 57 15.283 -8.994 1.170 1.00 0.00 H new ATOM 0 HG2 GLU A 57 17.597 -7.950 0.705 1.00 0.00 H new ATOM 0 HG3 GLU A 57 16.835 -6.401 1.007 1.00 0.00 H new ATOM 877 N PRO A 58 14.891 -10.498 -1.171 1.00 0.00 N ATOM 878 CA PRO A 58 14.073 -11.664 -1.518 1.00 0.00 C ATOM 879 C PRO A 58 13.004 -11.954 -0.471 1.00 0.00 C ATOM 880 O PRO A 58 13.090 -11.518 0.677 1.00 0.00 O ATOM 881 CB PRO A 58 15.090 -12.806 -1.575 1.00 0.00 C ATOM 882 CG PRO A 58 16.201 -12.370 -0.683 1.00 0.00 C ATOM 883 CD PRO A 58 16.269 -10.873 -0.810 1.00 0.00 C ATOM 0 HA PRO A 58 13.526 -11.516 -2.449 1.00 0.00 H new ATOM 0 HB2 PRO A 58 14.652 -13.743 -1.232 1.00 0.00 H new ATOM 0 HB3 PRO A 58 15.442 -12.972 -2.593 1.00 0.00 H new ATOM 0 HG2 PRO A 58 16.012 -12.666 0.349 1.00 0.00 H new ATOM 0 HG3 PRO A 58 17.143 -12.830 -0.980 1.00 0.00 H new ATOM 0 HD2 PRO A 58 16.582 -10.404 0.123 1.00 0.00 H new ATOM 0 HD3 PRO A 58 16.982 -10.567 -1.575 1.00 0.00 H new ATOM 891 N PRO A 59 11.970 -12.708 -0.873 1.00 0.00 N ATOM 892 CA PRO A 59 11.856 -13.232 -2.238 1.00 0.00 C ATOM 893 C PRO A 59 11.579 -12.134 -3.259 1.00 0.00 C ATOM 894 O PRO A 59 10.925 -11.137 -2.951 1.00 0.00 O ATOM 895 CB PRO A 59 10.668 -14.193 -2.150 1.00 0.00 C ATOM 896 CG PRO A 59 9.853 -13.686 -1.011 1.00 0.00 C ATOM 897 CD PRO A 59 10.833 -13.107 -0.027 1.00 0.00 C ATOM 0 HA PRO A 59 12.780 -13.704 -2.572 1.00 0.00 H new ATOM 0 HB2 PRO A 59 10.094 -14.198 -3.076 1.00 0.00 H new ATOM 0 HB3 PRO A 59 10.999 -15.217 -1.975 1.00 0.00 H new ATOM 0 HG2 PRO A 59 9.143 -12.930 -1.345 1.00 0.00 H new ATOM 0 HG3 PRO A 59 9.273 -14.490 -0.558 1.00 0.00 H new ATOM 0 HD2 PRO A 59 10.411 -12.255 0.507 1.00 0.00 H new ATOM 0 HD3 PRO A 59 11.129 -13.839 0.724 1.00 0.00 H new ATOM 905 N PHE A 60 12.080 -12.324 -4.475 1.00 0.00 N ATOM 906 CA PHE A 60 11.887 -11.349 -5.542 1.00 0.00 C ATOM 907 C PHE A 60 10.583 -11.613 -6.291 1.00 0.00 C ATOM 908 O PHE A 60 9.880 -12.583 -6.012 1.00 0.00 O ATOM 909 CB PHE A 60 13.065 -11.387 -6.517 1.00 0.00 C ATOM 910 CG PHE A 60 14.331 -10.810 -5.951 1.00 0.00 C ATOM 911 CD1 PHE A 60 15.040 -11.487 -4.973 1.00 0.00 C ATOM 912 CD2 PHE A 60 14.810 -9.589 -6.397 1.00 0.00 C ATOM 913 CE1 PHE A 60 16.206 -10.959 -4.450 1.00 0.00 C ATOM 914 CE2 PHE A 60 15.975 -9.055 -5.878 1.00 0.00 C ATOM 915 CZ PHE A 60 16.673 -9.740 -4.903 1.00 0.00 C ATOM 0 H PHE A 60 12.623 -13.144 -4.746 1.00 0.00 H new ATOM 0 HA PHE A 60 11.832 -10.359 -5.089 1.00 0.00 H new ATOM 0 HB2 PHE A 60 13.247 -12.420 -6.814 1.00 0.00 H new ATOM 0 HB3 PHE A 60 12.797 -10.838 -7.420 1.00 0.00 H new ATOM 0 HD1 PHE A 60 14.678 -12.439 -4.614 1.00 0.00 H new ATOM 0 HD2 PHE A 60 14.267 -9.048 -7.158 1.00 0.00 H new ATOM 0 HE1 PHE A 60 16.751 -11.498 -3.689 1.00 0.00 H new ATOM 0 HE2 PHE A 60 16.339 -8.103 -6.235 1.00 0.00 H new ATOM 0 HZ PHE A 60 17.582 -9.324 -4.495 1.00 0.00 H new ATOM 925 N GLY A 61 10.268 -10.740 -7.243 1.00 0.00 N ATOM 926 CA GLY A 61 9.050 -10.895 -8.017 1.00 0.00 C ATOM 927 C GLY A 61 7.815 -10.982 -7.143 1.00 0.00 C ATOM 928 O GLY A 61 6.938 -11.816 -7.377 1.00 0.00 O ATOM 0 H GLY A 61 10.834 -9.929 -7.492 1.00 0.00 H new ATOM 0 HA2 GLY A 61 8.948 -10.053 -8.701 1.00 0.00 H new ATOM 0 HA3 GLY A 61 9.123 -11.795 -8.628 1.00 0.00 H new ATOM 932 N ILE A 62 7.745 -10.122 -6.133 1.00 0.00 N ATOM 933 CA ILE A 62 6.608 -10.106 -5.221 1.00 0.00 C ATOM 934 C ILE A 62 5.717 -8.894 -5.474 1.00 0.00 C ATOM 935 O ILE A 62 4.517 -9.031 -5.713 1.00 0.00 O ATOM 936 CB ILE A 62 7.066 -10.095 -3.751 1.00 0.00 C ATOM 937 CG1 ILE A 62 8.063 -11.227 -3.496 1.00 0.00 C ATOM 938 CG2 ILE A 62 5.867 -10.218 -2.822 1.00 0.00 C ATOM 939 CD1 ILE A 62 7.410 -12.583 -3.342 1.00 0.00 C ATOM 0 H ILE A 62 8.462 -9.427 -5.925 1.00 0.00 H new ATOM 0 HA ILE A 62 6.040 -11.017 -5.409 1.00 0.00 H new ATOM 0 HB ILE A 62 7.563 -9.146 -3.548 1.00 0.00 H new ATOM 0 HG12 ILE A 62 8.774 -11.267 -4.321 1.00 0.00 H new ATOM 0 HG13 ILE A 62 8.633 -11.002 -2.594 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.207 -10.209 -1.786 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.190 -9.380 -2.989 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.345 -11.153 -3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 62 8.176 -13.338 -3.164 1.00 0.00 H new ATOM 0 HD12 ILE A 62 6.719 -12.561 -2.499 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.863 -12.829 -4.252 1.00 0.00 H new ATOM 951 N PHE A 63 6.313 -7.708 -5.422 1.00 0.00 N ATOM 952 CA PHE A 63 5.574 -6.471 -5.646 1.00 0.00 C ATOM 953 C PHE A 63 6.199 -5.662 -6.780 1.00 0.00 C ATOM 954 O PHE A 63 7.421 -5.605 -6.917 1.00 0.00 O ATOM 955 CB PHE A 63 5.540 -5.633 -4.366 1.00 0.00 C ATOM 956 CG PHE A 63 5.019 -6.382 -3.173 1.00 0.00 C ATOM 957 CD1 PHE A 63 3.693 -6.778 -3.112 1.00 0.00 C ATOM 958 CD2 PHE A 63 5.856 -6.691 -2.113 1.00 0.00 C ATOM 959 CE1 PHE A 63 3.211 -7.467 -2.015 1.00 0.00 C ATOM 960 CE2 PHE A 63 5.380 -7.380 -1.013 1.00 0.00 C ATOM 961 CZ PHE A 63 4.055 -7.769 -0.965 1.00 0.00 C ATOM 0 H PHE A 63 7.306 -7.577 -5.227 1.00 0.00 H new ATOM 0 HA PHE A 63 4.554 -6.732 -5.928 1.00 0.00 H new ATOM 0 HB2 PHE A 63 6.546 -5.275 -4.149 1.00 0.00 H new ATOM 0 HB3 PHE A 63 4.918 -4.754 -4.533 1.00 0.00 H new ATOM 0 HD1 PHE A 63 3.028 -6.546 -3.931 1.00 0.00 H new ATOM 0 HD2 PHE A 63 6.893 -6.390 -2.146 1.00 0.00 H new ATOM 0 HE1 PHE A 63 2.175 -7.769 -1.979 1.00 0.00 H new ATOM 0 HE2 PHE A 63 6.043 -7.614 -0.193 1.00 0.00 H new ATOM 0 HZ PHE A 63 3.680 -8.308 -0.108 1.00 0.00 H new ATOM 971 N VAL A 64 5.350 -5.039 -7.591 1.00 0.00 N ATOM 972 CA VAL A 64 5.817 -4.233 -8.713 1.00 0.00 C ATOM 973 C VAL A 64 5.253 -2.818 -8.645 1.00 0.00 C ATOM 974 O VAL A 64 4.252 -2.568 -7.973 1.00 0.00 O ATOM 975 CB VAL A 64 5.424 -4.866 -10.061 1.00 0.00 C ATOM 976 CG1 VAL A 64 6.400 -5.971 -10.437 1.00 0.00 C ATOM 977 CG2 VAL A 64 4.000 -5.398 -10.004 1.00 0.00 C ATOM 0 H VAL A 64 4.336 -5.077 -7.492 1.00 0.00 H new ATOM 0 HA VAL A 64 6.904 -4.192 -8.643 1.00 0.00 H new ATOM 0 HB VAL A 64 5.470 -4.096 -10.831 1.00 0.00 H new ATOM 0 HG11 VAL A 64 6.106 -6.406 -11.392 1.00 0.00 H new ATOM 0 HG12 VAL A 64 7.404 -5.556 -10.521 1.00 0.00 H new ATOM 0 HG13 VAL A 64 6.389 -6.743 -9.668 1.00 0.00 H new ATOM 0 HG21 VAL A 64 3.739 -5.842 -10.965 1.00 0.00 H new ATOM 0 HG22 VAL A 64 3.925 -6.154 -9.223 1.00 0.00 H new ATOM 0 HG23 VAL A 64 3.314 -4.580 -9.784 1.00 0.00 H new ATOM 987 N PHE A 65 5.903 -1.894 -9.346 1.00 0.00 N ATOM 988 CA PHE A 65 5.467 -0.503 -9.366 1.00 0.00 C ATOM 989 C PHE A 65 6.031 0.227 -10.582 1.00 0.00 C ATOM 990 O PHE A 65 7.200 0.065 -10.928 1.00 0.00 O ATOM 991 CB PHE A 65 5.902 0.208 -8.083 1.00 0.00 C ATOM 992 CG PHE A 65 7.349 0.612 -8.082 1.00 0.00 C ATOM 993 CD1 PHE A 65 7.785 1.677 -8.853 1.00 0.00 C ATOM 994 CD2 PHE A 65 8.273 -0.075 -7.312 1.00 0.00 C ATOM 995 CE1 PHE A 65 9.115 2.052 -8.855 1.00 0.00 C ATOM 996 CE2 PHE A 65 9.605 0.295 -7.309 1.00 0.00 C ATOM 997 CZ PHE A 65 10.027 1.359 -8.083 1.00 0.00 C ATOM 0 H PHE A 65 6.733 -2.084 -9.907 1.00 0.00 H new ATOM 0 HA PHE A 65 4.379 -0.490 -9.429 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.285 1.096 -7.942 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.716 -0.448 -7.233 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.077 2.221 -9.460 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.949 -0.909 -6.707 1.00 0.00 H new ATOM 0 HE1 PHE A 65 9.441 2.886 -9.459 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.315 -0.247 -6.702 1.00 0.00 H new ATOM 0 HZ PHE A 65 11.068 1.648 -8.084 1.00 0.00 H new ATOM 1007 N ASN A 66 5.190 1.030 -11.225 1.00 0.00 N ATOM 1008 CA ASN A 66 5.603 1.784 -12.403 1.00 0.00 C ATOM 1009 C ASN A 66 5.249 3.260 -12.256 1.00 0.00 C ATOM 1010 O ASN A 66 4.176 3.607 -11.761 1.00 0.00 O ATOM 1011 CB ASN A 66 4.942 1.212 -13.658 1.00 0.00 C ATOM 1012 CG ASN A 66 5.692 1.578 -14.925 1.00 0.00 C ATOM 1013 OD1 ASN A 66 6.633 2.371 -14.895 1.00 0.00 O ATOM 1014 ND2 ASN A 66 5.276 1.001 -16.046 1.00 0.00 N ATOM 0 H ASN A 66 4.219 1.175 -10.950 1.00 0.00 H new ATOM 0 HA ASN A 66 6.685 1.696 -12.498 1.00 0.00 H new ATOM 0 HB2 ASN A 66 4.886 0.127 -13.573 1.00 0.00 H new ATOM 0 HB3 ASN A 66 3.918 1.580 -13.726 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.741 1.209 -16.930 1.00 0.00 H new ATOM 0 HD22 ASN A 66 4.491 0.350 -16.024 1.00 0.00 H new ATOM 1021 N LYS A 67 6.158 4.127 -12.689 1.00 0.00 N ATOM 1022 CA LYS A 67 5.942 5.567 -12.608 1.00 0.00 C ATOM 1023 C LYS A 67 4.999 6.039 -13.711 1.00 0.00 C ATOM 1024 O LYS A 67 4.199 6.952 -13.507 1.00 0.00 O ATOM 1025 CB LYS A 67 7.276 6.310 -12.711 1.00 0.00 C ATOM 1026 CG LYS A 67 8.035 6.023 -13.995 1.00 0.00 C ATOM 1027 CD LYS A 67 9.532 6.206 -13.811 1.00 0.00 C ATOM 1028 CE LYS A 67 10.320 5.463 -14.879 1.00 0.00 C ATOM 1029 NZ LYS A 67 10.085 6.028 -16.236 1.00 0.00 N ATOM 0 H LYS A 67 7.052 3.857 -13.100 1.00 0.00 H new ATOM 0 HA LYS A 67 5.484 5.787 -11.644 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.092 7.382 -12.640 1.00 0.00 H new ATOM 0 HB3 LYS A 67 7.901 6.037 -11.861 1.00 0.00 H new ATOM 0 HG2 LYS A 67 7.830 5.003 -14.320 1.00 0.00 H new ATOM 0 HG3 LYS A 67 7.681 6.686 -14.784 1.00 0.00 H new ATOM 0 HD2 LYS A 67 9.777 7.267 -13.849 1.00 0.00 H new ATOM 0 HD3 LYS A 67 9.825 5.846 -12.825 1.00 0.00 H new ATOM 0 HE2 LYS A 67 11.383 5.511 -14.645 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.039 4.410 -14.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 10.640 5.494 -16.935 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 9.074 5.959 -16.470 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 10.377 7.026 -16.252 1.00 0.00 H new ATOM 1043 N ASP A 68 5.097 5.409 -14.876 1.00 0.00 N ATOM 1044 CA ASP A 68 4.251 5.763 -16.010 1.00 0.00 C ATOM 1045 C ASP A 68 2.824 6.051 -15.554 1.00 0.00 C ATOM 1046 O ASP A 68 2.175 6.971 -16.053 1.00 0.00 O ATOM 1047 CB ASP A 68 4.252 4.637 -17.045 1.00 0.00 C ATOM 1048 CG ASP A 68 5.473 4.675 -17.942 1.00 0.00 C ATOM 1049 OD1 ASP A 68 6.597 4.800 -17.410 1.00 0.00 O ATOM 1050 OD2 ASP A 68 5.307 4.579 -19.175 1.00 0.00 O ATOM 0 H ASP A 68 5.754 4.651 -15.060 1.00 0.00 H new ATOM 0 HA ASP A 68 4.656 6.666 -16.467 1.00 0.00 H new ATOM 0 HB2 ASP A 68 4.212 3.676 -16.532 1.00 0.00 H new ATOM 0 HB3 ASP A 68 3.353 4.710 -17.657 1.00 0.00 H new ATOM 1055 N THR A 69 2.340 5.258 -14.603 1.00 0.00 N ATOM 1056 CA THR A 69 0.990 5.425 -14.081 1.00 0.00 C ATOM 1057 C THR A 69 1.001 5.568 -12.564 1.00 0.00 C ATOM 1058 O THR A 69 0.000 5.950 -11.959 1.00 0.00 O ATOM 1059 CB THR A 69 0.087 4.239 -14.468 1.00 0.00 C ATOM 1060 OG1 THR A 69 -1.058 4.195 -13.609 1.00 0.00 O ATOM 1061 CG2 THR A 69 0.849 2.926 -14.373 1.00 0.00 C ATOM 0 H THR A 69 2.864 4.493 -14.178 1.00 0.00 H new ATOM 0 HA THR A 69 0.590 6.336 -14.526 1.00 0.00 H new ATOM 0 HB THR A 69 -0.238 4.379 -15.499 1.00 0.00 H new ATOM 0 HG1 THR A 69 -1.105 5.021 -13.084 1.00 0.00 H new ATOM 0 HG21 THR A 69 0.191 2.103 -14.651 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.704 2.952 -15.049 1.00 0.00 H new ATOM 0 HG23 THR A 69 1.199 2.782 -13.351 1.00 0.00 H new ATOM 1069 N GLY A 70 2.141 5.260 -11.953 1.00 0.00 N ATOM 1070 CA GLY A 70 2.260 5.361 -10.510 1.00 0.00 C ATOM 1071 C GLY A 70 1.231 4.519 -9.783 1.00 0.00 C ATOM 1072 O GLY A 70 0.088 4.939 -9.608 1.00 0.00 O ATOM 0 H GLY A 70 2.984 4.942 -12.431 1.00 0.00 H new ATOM 0 HA2 GLY A 70 3.260 5.048 -10.208 1.00 0.00 H new ATOM 0 HA3 GLY A 70 2.148 6.403 -10.211 1.00 0.00 H new ATOM 1076 N GLU A 71 1.636 3.325 -9.360 1.00 0.00 N ATOM 1077 CA GLU A 71 0.739 2.422 -8.650 1.00 0.00 C ATOM 1078 C GLU A 71 1.500 1.220 -8.099 1.00 0.00 C ATOM 1079 O GLU A 71 2.546 0.838 -8.627 1.00 0.00 O ATOM 1080 CB GLU A 71 -0.382 1.948 -9.577 1.00 0.00 C ATOM 1081 CG GLU A 71 -0.020 0.716 -10.389 1.00 0.00 C ATOM 1082 CD GLU A 71 -1.111 0.319 -11.365 1.00 0.00 C ATOM 1083 OE1 GLU A 71 -1.128 0.865 -12.489 1.00 0.00 O ATOM 1084 OE2 GLU A 71 -1.948 -0.535 -11.006 1.00 0.00 O ATOM 0 H GLU A 71 2.579 2.961 -9.497 1.00 0.00 H new ATOM 0 HA GLU A 71 0.303 2.968 -7.814 1.00 0.00 H new ATOM 0 HB2 GLU A 71 -1.268 1.732 -8.981 1.00 0.00 H new ATOM 0 HB3 GLU A 71 -0.645 2.757 -10.258 1.00 0.00 H new ATOM 0 HG2 GLU A 71 0.902 0.906 -10.938 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.177 -0.115 -9.712 1.00 0.00 H new ATOM 1091 N LEU A 72 0.970 0.627 -7.035 1.00 0.00 N ATOM 1092 CA LEU A 72 1.599 -0.532 -6.411 1.00 0.00 C ATOM 1093 C LEU A 72 0.672 -1.742 -6.452 1.00 0.00 C ATOM 1094 O LEU A 72 -0.477 -1.671 -6.019 1.00 0.00 O ATOM 1095 CB LEU A 72 1.978 -0.214 -4.964 1.00 0.00 C ATOM 1096 CG LEU A 72 2.649 -1.343 -4.182 1.00 0.00 C ATOM 1097 CD1 LEU A 72 4.151 -1.339 -4.420 1.00 0.00 C ATOM 1098 CD2 LEU A 72 2.341 -1.220 -2.696 1.00 0.00 C ATOM 0 H LEU A 72 0.106 0.930 -6.586 1.00 0.00 H new ATOM 0 HA LEU A 72 2.502 -0.770 -6.972 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.646 0.647 -4.966 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.076 0.084 -4.430 1.00 0.00 H new ATOM 0 HG LEU A 72 2.249 -2.292 -4.538 1.00 0.00 H new ATOM 0 HD11 LEU A 72 4.611 -2.150 -3.855 1.00 0.00 H new ATOM 0 HD12 LEU A 72 4.351 -1.478 -5.482 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.569 -0.387 -4.093 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.827 -2.032 -2.155 1.00 0.00 H new ATOM 0 HD22 LEU A 72 2.712 -0.264 -2.325 1.00 0.00 H new ATOM 0 HD23 LEU A 72 1.263 -1.275 -2.542 1.00 0.00 H new ATOM 1110 N ASN A 73 1.181 -2.853 -6.975 1.00 0.00 N ATOM 1111 CA ASN A 73 0.399 -4.081 -7.071 1.00 0.00 C ATOM 1112 C ASN A 73 1.223 -5.287 -6.629 1.00 0.00 C ATOM 1113 O ASN A 73 2.426 -5.177 -6.394 1.00 0.00 O ATOM 1114 CB ASN A 73 -0.096 -4.284 -8.504 1.00 0.00 C ATOM 1115 CG ASN A 73 -0.553 -2.989 -9.147 1.00 0.00 C ATOM 1116 OD1 ASN A 73 -1.112 -2.117 -8.483 1.00 0.00 O ATOM 1117 ND2 ASN A 73 -0.317 -2.859 -10.448 1.00 0.00 N ATOM 0 H ASN A 73 2.131 -2.928 -7.339 1.00 0.00 H new ATOM 0 HA ASN A 73 -0.460 -3.988 -6.407 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.703 -4.722 -9.103 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -0.921 -4.997 -8.503 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -0.603 -2.010 -10.936 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.150 -3.608 -10.959 1.00 0.00 H new ATOM 1124 N VAL A 74 0.566 -6.437 -6.519 1.00 0.00 N ATOM 1125 CA VAL A 74 1.237 -7.664 -6.107 1.00 0.00 C ATOM 1126 C VAL A 74 1.114 -8.743 -7.177 1.00 0.00 C ATOM 1127 O VAL A 74 0.026 -9.004 -7.690 1.00 0.00 O ATOM 1128 CB VAL A 74 0.661 -8.202 -4.783 1.00 0.00 C ATOM 1129 CG1 VAL A 74 -0.829 -8.471 -4.919 1.00 0.00 C ATOM 1130 CG2 VAL A 74 1.401 -9.459 -4.353 1.00 0.00 C ATOM 0 H VAL A 74 -0.430 -6.545 -6.709 1.00 0.00 H new ATOM 0 HA VAL A 74 2.289 -7.416 -5.963 1.00 0.00 H new ATOM 0 HB VAL A 74 0.800 -7.444 -4.012 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -1.218 -8.850 -3.974 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.344 -7.546 -5.178 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -0.995 -9.210 -5.703 1.00 0.00 H new ATOM 0 HG21 VAL A 74 0.981 -9.826 -3.416 1.00 0.00 H new ATOM 0 HG22 VAL A 74 1.296 -10.224 -5.122 1.00 0.00 H new ATOM 0 HG23 VAL A 74 2.457 -9.229 -4.212 1.00 0.00 H new ATOM 1140 N THR A 75 2.239 -9.369 -7.511 1.00 0.00 N ATOM 1141 CA THR A 75 2.259 -10.419 -8.521 1.00 0.00 C ATOM 1142 C THR A 75 2.767 -11.733 -7.938 1.00 0.00 C ATOM 1143 O THR A 75 3.486 -12.480 -8.601 1.00 0.00 O ATOM 1144 CB THR A 75 3.141 -10.028 -9.721 1.00 0.00 C ATOM 1145 OG1 THR A 75 4.490 -9.821 -9.290 1.00 0.00 O ATOM 1146 CG2 THR A 75 2.617 -8.766 -10.390 1.00 0.00 C ATOM 0 H THR A 75 3.148 -9.166 -7.096 1.00 0.00 H new ATOM 0 HA THR A 75 1.232 -10.549 -8.862 1.00 0.00 H new ATOM 0 HB THR A 75 3.112 -10.842 -10.445 1.00 0.00 H new ATOM 0 HG1 THR A 75 5.045 -9.574 -10.059 1.00 0.00 H new ATOM 0 HG21 THR A 75 3.256 -8.510 -11.235 1.00 0.00 H new ATOM 0 HG22 THR A 75 1.600 -8.937 -10.743 1.00 0.00 H new ATOM 0 HG23 THR A 75 2.619 -7.946 -9.672 1.00 0.00 H new ATOM 1154 N SER A 76 2.388 -12.009 -6.694 1.00 0.00 N ATOM 1155 CA SER A 76 2.808 -13.232 -6.020 1.00 0.00 C ATOM 1156 C SER A 76 1.847 -13.587 -4.890 1.00 0.00 C ATOM 1157 O SER A 76 1.126 -12.729 -4.381 1.00 0.00 O ATOM 1158 CB SER A 76 4.226 -13.073 -5.468 1.00 0.00 C ATOM 1159 OG SER A 76 5.195 -13.285 -6.481 1.00 0.00 O ATOM 0 H SER A 76 1.791 -11.402 -6.133 1.00 0.00 H new ATOM 0 HA SER A 76 2.798 -14.042 -6.749 1.00 0.00 H new ATOM 0 HB2 SER A 76 4.346 -12.074 -5.049 1.00 0.00 H new ATOM 0 HB3 SER A 76 4.385 -13.781 -4.655 1.00 0.00 H new ATOM 0 HG SER A 76 5.505 -12.421 -6.823 1.00 0.00 H new ATOM 1165 N ILE A 77 1.844 -14.858 -4.503 1.00 0.00 N ATOM 1166 CA ILE A 77 0.973 -15.328 -3.432 1.00 0.00 C ATOM 1167 C ILE A 77 1.662 -15.223 -2.076 1.00 0.00 C ATOM 1168 O ILE A 77 2.613 -15.953 -1.793 1.00 0.00 O ATOM 1169 CB ILE A 77 0.536 -16.787 -3.662 1.00 0.00 C ATOM 1170 CG1 ILE A 77 -0.159 -16.927 -5.018 1.00 0.00 C ATOM 1171 CG2 ILE A 77 -0.383 -17.247 -2.539 1.00 0.00 C ATOM 1172 CD1 ILE A 77 -0.001 -18.297 -5.638 1.00 0.00 C ATOM 0 H ILE A 77 2.434 -15.581 -4.915 1.00 0.00 H new ATOM 0 HA ILE A 77 0.091 -14.687 -3.439 1.00 0.00 H new ATOM 0 HB ILE A 77 1.423 -17.421 -3.663 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -1.221 -16.712 -4.897 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.242 -16.179 -5.702 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.684 -18.280 -2.715 1.00 0.00 H new ATOM 0 HG22 ILE A 77 0.144 -17.180 -1.587 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -1.268 -16.611 -2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.519 -18.324 -6.597 1.00 0.00 H new ATOM 0 HD12 ILE A 77 1.058 -18.507 -5.791 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -0.428 -19.048 -4.974 1.00 0.00 H new ATOM 1184 N LEU A 78 1.176 -14.311 -1.241 1.00 0.00 N ATOM 1185 CA LEU A 78 1.745 -14.111 0.088 1.00 0.00 C ATOM 1186 C LEU A 78 1.882 -15.438 0.827 1.00 0.00 C ATOM 1187 O LEU A 78 0.991 -16.285 0.772 1.00 0.00 O ATOM 1188 CB LEU A 78 0.871 -13.151 0.898 1.00 0.00 C ATOM 1189 CG LEU A 78 0.686 -11.752 0.308 1.00 0.00 C ATOM 1190 CD1 LEU A 78 -0.303 -10.949 1.139 1.00 0.00 C ATOM 1191 CD2 LEU A 78 2.022 -11.029 0.219 1.00 0.00 C ATOM 0 H LEU A 78 0.390 -13.699 -1.460 1.00 0.00 H new ATOM 0 HA LEU A 78 2.738 -13.678 -0.030 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.113 -13.604 1.023 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.304 -13.050 1.893 1.00 0.00 H new ATOM 0 HG LEU A 78 0.284 -11.854 -0.700 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.422 -9.957 0.704 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.267 -11.458 1.150 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.070 -10.856 2.159 1.00 0.00 H new ATOM 0 HD21 LEU A 78 1.871 -10.035 -0.203 1.00 0.00 H new ATOM 0 HD22 LEU A 78 2.454 -10.938 1.216 1.00 0.00 H new ATOM 0 HD23 LEU A 78 2.700 -11.595 -0.420 1.00 0.00 H new ATOM 1203 N ASP A 79 3.003 -15.610 1.518 1.00 0.00 N ATOM 1204 CA ASP A 79 3.256 -16.833 2.272 1.00 0.00 C ATOM 1205 C ASP A 79 3.584 -16.516 3.728 1.00 0.00 C ATOM 1206 O ASP A 79 4.746 -16.322 4.084 1.00 0.00 O ATOM 1207 CB ASP A 79 4.404 -17.620 1.637 1.00 0.00 C ATOM 1208 CG ASP A 79 5.535 -16.723 1.176 1.00 0.00 C ATOM 1209 OD1 ASP A 79 5.747 -15.665 1.804 1.00 0.00 O ATOM 1210 OD2 ASP A 79 6.209 -17.078 0.185 1.00 0.00 O ATOM 0 H ASP A 79 3.751 -14.919 1.572 1.00 0.00 H new ATOM 0 HA ASP A 79 2.351 -17.440 2.246 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.788 -18.342 2.358 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.025 -18.188 0.787 1.00 0.00 H new ATOM 1215 N ARG A 80 2.552 -16.464 4.563 1.00 0.00 N ATOM 1216 CA ARG A 80 2.730 -16.169 5.980 1.00 0.00 C ATOM 1217 C ARG A 80 3.935 -16.915 6.544 1.00 0.00 C ATOM 1218 O ARG A 80 4.851 -16.307 7.096 1.00 0.00 O ATOM 1219 CB ARG A 80 1.471 -16.545 6.763 1.00 0.00 C ATOM 1220 CG ARG A 80 1.431 -15.963 8.167 1.00 0.00 C ATOM 1221 CD ARG A 80 0.026 -16.008 8.748 1.00 0.00 C ATOM 1222 NE ARG A 80 0.030 -15.857 10.201 1.00 0.00 N ATOM 1223 CZ ARG A 80 -1.069 -15.672 10.924 1.00 0.00 C ATOM 1224 NH1 ARG A 80 -2.254 -15.617 10.331 1.00 0.00 N ATOM 1225 NH2 ARG A 80 -0.984 -15.544 12.241 1.00 0.00 N ATOM 0 H ARG A 80 1.584 -16.622 4.283 1.00 0.00 H new ATOM 0 HA ARG A 80 2.907 -15.098 6.083 1.00 0.00 H new ATOM 0 HB2 ARG A 80 0.595 -16.203 6.212 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.404 -17.631 6.827 1.00 0.00 H new ATOM 0 HG2 ARG A 80 2.111 -16.519 8.812 1.00 0.00 H new ATOM 0 HG3 ARG A 80 1.784 -14.932 8.145 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.576 -15.216 8.303 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.446 -16.954 8.483 1.00 0.00 H new ATOM 0 HE ARG A 80 0.926 -15.896 10.687 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -2.323 -15.717 9.318 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -3.097 -15.475 10.888 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -0.074 -15.588 12.700 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.828 -15.402 12.795 1.00 0.00 H new ATOM 1239 N GLU A 81 3.926 -18.237 6.400 1.00 0.00 N ATOM 1240 CA GLU A 81 5.018 -19.066 6.897 1.00 0.00 C ATOM 1241 C GLU A 81 6.368 -18.413 6.616 1.00 0.00 C ATOM 1242 O GLU A 81 7.145 -18.150 7.533 1.00 0.00 O ATOM 1243 CB GLU A 81 4.967 -20.454 6.254 1.00 0.00 C ATOM 1244 CG GLU A 81 3.699 -21.227 6.575 1.00 0.00 C ATOM 1245 CD GLU A 81 3.723 -22.640 6.027 1.00 0.00 C ATOM 1246 OE1 GLU A 81 3.409 -22.819 4.832 1.00 0.00 O ATOM 1247 OE2 GLU A 81 4.057 -23.568 6.794 1.00 0.00 O ATOM 0 H GLU A 81 3.176 -18.756 5.944 1.00 0.00 H new ATOM 0 HA GLU A 81 4.901 -19.168 7.976 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.054 -20.348 5.173 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.829 -21.032 6.588 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.564 -21.263 7.656 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.840 -20.696 6.164 1.00 0.00 H new ATOM 1254 N GLU A 82 6.640 -18.154 5.340 1.00 0.00 N ATOM 1255 CA GLU A 82 7.897 -17.533 4.938 1.00 0.00 C ATOM 1256 C GLU A 82 7.978 -16.095 5.442 1.00 0.00 C ATOM 1257 O GLU A 82 8.811 -15.767 6.288 1.00 0.00 O ATOM 1258 CB GLU A 82 8.041 -17.561 3.415 1.00 0.00 C ATOM 1259 CG GLU A 82 9.301 -16.877 2.911 1.00 0.00 C ATOM 1260 CD GLU A 82 9.774 -17.434 1.582 1.00 0.00 C ATOM 1261 OE1 GLU A 82 10.216 -18.602 1.553 1.00 0.00 O ATOM 1262 OE2 GLU A 82 9.704 -16.703 0.573 1.00 0.00 O ATOM 0 H GLU A 82 6.007 -18.364 4.568 1.00 0.00 H new ATOM 0 HA GLU A 82 8.713 -18.102 5.383 1.00 0.00 H new ATOM 0 HB2 GLU A 82 8.040 -18.597 3.077 1.00 0.00 H new ATOM 0 HB3 GLU A 82 7.172 -17.079 2.967 1.00 0.00 H new ATOM 0 HG2 GLU A 82 9.113 -15.808 2.807 1.00 0.00 H new ATOM 0 HG3 GLU A 82 10.093 -16.991 3.651 1.00 0.00 H new ATOM 1269 N THR A 83 7.108 -15.239 4.914 1.00 0.00 N ATOM 1270 CA THR A 83 7.082 -13.836 5.307 1.00 0.00 C ATOM 1271 C THR A 83 5.743 -13.466 5.935 1.00 0.00 C ATOM 1272 O THR A 83 4.714 -13.392 5.263 1.00 0.00 O ATOM 1273 CB THR A 83 7.345 -12.911 4.104 1.00 0.00 C ATOM 1274 OG1 THR A 83 6.462 -13.244 3.027 1.00 0.00 O ATOM 1275 CG2 THR A 83 8.788 -13.026 3.638 1.00 0.00 C ATOM 0 H THR A 83 6.412 -15.494 4.213 1.00 0.00 H new ATOM 0 HA THR A 83 7.875 -13.699 6.042 1.00 0.00 H new ATOM 0 HB THR A 83 7.162 -11.883 4.418 1.00 0.00 H new ATOM 0 HG1 THR A 83 6.052 -12.426 2.675 1.00 0.00 H new ATOM 0 HG21 THR A 83 8.950 -12.364 2.788 1.00 0.00 H new ATOM 0 HG22 THR A 83 9.457 -12.743 4.451 1.00 0.00 H new ATOM 0 HG23 THR A 83 8.994 -14.054 3.341 1.00 0.00 H new ATOM 1283 N PRO A 84 5.754 -13.227 7.255 1.00 0.00 N ATOM 1284 CA PRO A 84 4.547 -12.859 8.002 1.00 0.00 C ATOM 1285 C PRO A 84 4.053 -11.459 7.653 1.00 0.00 C ATOM 1286 O PRO A 84 2.853 -11.187 7.689 1.00 0.00 O ATOM 1287 CB PRO A 84 5.003 -12.916 9.462 1.00 0.00 C ATOM 1288 CG PRO A 84 6.474 -12.684 9.409 1.00 0.00 C ATOM 1289 CD PRO A 84 6.944 -13.296 8.119 1.00 0.00 C ATOM 0 HA PRO A 84 3.710 -13.520 7.776 1.00 0.00 H new ATOM 0 HB2 PRO A 84 4.504 -12.156 10.063 1.00 0.00 H new ATOM 0 HB3 PRO A 84 4.770 -13.881 9.912 1.00 0.00 H new ATOM 0 HG2 PRO A 84 6.702 -11.619 9.441 1.00 0.00 H new ATOM 0 HG3 PRO A 84 6.972 -13.143 10.263 1.00 0.00 H new ATOM 0 HD2 PRO A 84 7.782 -12.743 7.694 1.00 0.00 H new ATOM 0 HD3 PRO A 84 7.279 -14.324 8.260 1.00 0.00 H new ATOM 1297 N PHE A 85 4.986 -10.575 7.316 1.00 0.00 N ATOM 1298 CA PHE A 85 4.645 -9.202 6.960 1.00 0.00 C ATOM 1299 C PHE A 85 5.702 -8.600 6.039 1.00 0.00 C ATOM 1300 O PHE A 85 6.847 -9.053 6.010 1.00 0.00 O ATOM 1301 CB PHE A 85 4.504 -8.347 8.221 1.00 0.00 C ATOM 1302 CG PHE A 85 5.691 -8.428 9.137 1.00 0.00 C ATOM 1303 CD1 PHE A 85 6.904 -7.864 8.772 1.00 0.00 C ATOM 1304 CD2 PHE A 85 5.596 -9.068 10.362 1.00 0.00 C ATOM 1305 CE1 PHE A 85 7.998 -7.937 9.613 1.00 0.00 C ATOM 1306 CE2 PHE A 85 6.687 -9.143 11.207 1.00 0.00 C ATOM 1307 CZ PHE A 85 7.890 -8.578 10.831 1.00 0.00 C ATOM 0 H PHE A 85 5.984 -10.784 7.282 1.00 0.00 H new ATOM 0 HA PHE A 85 3.693 -9.216 6.430 1.00 0.00 H new ATOM 0 HB2 PHE A 85 4.350 -7.308 7.930 1.00 0.00 H new ATOM 0 HB3 PHE A 85 3.613 -8.661 8.765 1.00 0.00 H new ATOM 0 HD1 PHE A 85 6.995 -7.362 7.820 1.00 0.00 H new ATOM 0 HD2 PHE A 85 4.658 -9.514 10.660 1.00 0.00 H new ATOM 0 HE1 PHE A 85 8.937 -7.493 9.318 1.00 0.00 H new ATOM 0 HE2 PHE A 85 6.599 -9.643 12.160 1.00 0.00 H new ATOM 0 HZ PHE A 85 8.745 -8.638 11.489 1.00 0.00 H new ATOM 1317 N PHE A 86 5.310 -7.576 5.288 1.00 0.00 N ATOM 1318 CA PHE A 86 6.223 -6.912 4.364 1.00 0.00 C ATOM 1319 C PHE A 86 6.326 -5.423 4.678 1.00 0.00 C ATOM 1320 O PHE A 86 5.322 -4.709 4.696 1.00 0.00 O ATOM 1321 CB PHE A 86 5.754 -7.110 2.921 1.00 0.00 C ATOM 1322 CG PHE A 86 6.013 -8.491 2.390 1.00 0.00 C ATOM 1323 CD1 PHE A 86 7.253 -8.826 1.871 1.00 0.00 C ATOM 1324 CD2 PHE A 86 5.016 -9.453 2.410 1.00 0.00 C ATOM 1325 CE1 PHE A 86 7.495 -10.096 1.382 1.00 0.00 C ATOM 1326 CE2 PHE A 86 5.252 -10.725 1.923 1.00 0.00 C ATOM 1327 CZ PHE A 86 6.492 -11.046 1.407 1.00 0.00 C ATOM 0 H PHE A 86 4.367 -7.188 5.301 1.00 0.00 H new ATOM 0 HA PHE A 86 7.210 -7.359 4.482 1.00 0.00 H new ATOM 0 HB2 PHE A 86 4.686 -6.902 2.863 1.00 0.00 H new ATOM 0 HB3 PHE A 86 6.256 -6.384 2.282 1.00 0.00 H new ATOM 0 HD1 PHE A 86 8.040 -8.086 1.848 1.00 0.00 H new ATOM 0 HD2 PHE A 86 4.044 -9.206 2.810 1.00 0.00 H new ATOM 0 HE1 PHE A 86 8.466 -10.345 0.981 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.467 -11.467 1.946 1.00 0.00 H new ATOM 0 HZ PHE A 86 6.678 -12.038 1.023 1.00 0.00 H new ATOM 1337 N LEU A 87 7.546 -4.960 4.927 1.00 0.00 N ATOM 1338 CA LEU A 87 7.782 -3.555 5.241 1.00 0.00 C ATOM 1339 C LEU A 87 8.265 -2.795 4.010 1.00 0.00 C ATOM 1340 O LEU A 87 9.338 -3.078 3.474 1.00 0.00 O ATOM 1341 CB LEU A 87 8.809 -3.430 6.368 1.00 0.00 C ATOM 1342 CG LEU A 87 8.263 -3.554 7.790 1.00 0.00 C ATOM 1343 CD1 LEU A 87 9.394 -3.797 8.777 1.00 0.00 C ATOM 1344 CD2 LEU A 87 7.478 -2.308 8.172 1.00 0.00 C ATOM 0 H LEU A 87 8.387 -5.537 4.918 1.00 0.00 H new ATOM 0 HA LEU A 87 6.838 -3.118 5.567 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.571 -4.196 6.225 1.00 0.00 H new ATOM 0 HB3 LEU A 87 9.306 -2.465 6.274 1.00 0.00 H new ATOM 0 HG LEU A 87 7.588 -4.409 7.825 1.00 0.00 H new ATOM 0 HD11 LEU A 87 8.986 -3.883 9.784 1.00 0.00 H new ATOM 0 HD12 LEU A 87 9.913 -4.719 8.516 1.00 0.00 H new ATOM 0 HD13 LEU A 87 10.095 -2.963 8.739 1.00 0.00 H new ATOM 0 HD21 LEU A 87 7.097 -2.415 9.188 1.00 0.00 H new ATOM 0 HD22 LEU A 87 8.130 -1.436 8.119 1.00 0.00 H new ATOM 0 HD23 LEU A 87 6.643 -2.179 7.483 1.00 0.00 H new ATOM 1356 N LEU A 88 7.469 -1.829 3.567 1.00 0.00 N ATOM 1357 CA LEU A 88 7.817 -1.026 2.400 1.00 0.00 C ATOM 1358 C LEU A 88 7.878 0.456 2.757 1.00 0.00 C ATOM 1359 O LEU A 88 7.714 0.834 3.917 1.00 0.00 O ATOM 1360 CB LEU A 88 6.799 -1.250 1.280 1.00 0.00 C ATOM 1361 CG LEU A 88 6.658 -2.688 0.779 1.00 0.00 C ATOM 1362 CD1 LEU A 88 5.465 -2.814 -0.155 1.00 0.00 C ATOM 1363 CD2 LEU A 88 7.934 -3.137 0.082 1.00 0.00 C ATOM 0 H LEU A 88 6.578 -1.582 3.998 1.00 0.00 H new ATOM 0 HA LEU A 88 8.803 -1.339 2.055 1.00 0.00 H new ATOM 0 HB2 LEU A 88 5.824 -0.911 1.629 1.00 0.00 H new ATOM 0 HB3 LEU A 88 7.073 -0.617 0.436 1.00 0.00 H new ATOM 0 HG LEU A 88 6.489 -3.337 1.638 1.00 0.00 H new ATOM 0 HD11 LEU A 88 5.381 -3.844 -0.501 1.00 0.00 H new ATOM 0 HD12 LEU A 88 4.555 -2.535 0.377 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.602 -2.154 -1.011 1.00 0.00 H new ATOM 0 HD21 LEU A 88 7.816 -4.162 -0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 88 8.133 -2.484 -0.768 1.00 0.00 H new ATOM 0 HD23 LEU A 88 8.768 -3.086 0.782 1.00 0.00 H new ATOM 1375 N THR A 89 8.112 1.293 1.751 1.00 0.00 N ATOM 1376 CA THR A 89 8.194 2.733 1.958 1.00 0.00 C ATOM 1377 C THR A 89 7.938 3.491 0.660 1.00 0.00 C ATOM 1378 O THR A 89 8.519 3.177 -0.378 1.00 0.00 O ATOM 1379 CB THR A 89 9.570 3.143 2.516 1.00 0.00 C ATOM 1380 OG1 THR A 89 9.965 2.243 3.556 1.00 0.00 O ATOM 1381 CG2 THR A 89 9.533 4.565 3.055 1.00 0.00 C ATOM 0 H THR A 89 8.248 0.998 0.784 1.00 0.00 H new ATOM 0 HA THR A 89 7.424 2.992 2.684 1.00 0.00 H new ATOM 0 HB THR A 89 10.295 3.098 1.703 1.00 0.00 H new ATOM 0 HG1 THR A 89 9.172 1.940 4.046 1.00 0.00 H new ATOM 0 HG21 THR A 89 10.516 4.832 3.444 1.00 0.00 H new ATOM 0 HG22 THR A 89 9.261 5.251 2.253 1.00 0.00 H new ATOM 0 HG23 THR A 89 8.796 4.632 3.855 1.00 0.00 H new ATOM 1389 N GLY A 90 7.064 4.491 0.726 1.00 0.00 N ATOM 1390 CA GLY A 90 6.748 5.278 -0.451 1.00 0.00 C ATOM 1391 C GLY A 90 7.423 6.635 -0.440 1.00 0.00 C ATOM 1392 O GLY A 90 7.452 7.314 0.587 1.00 0.00 O ATOM 0 H GLY A 90 6.570 4.770 1.573 1.00 0.00 H new ATOM 0 HA2 GLY A 90 7.054 4.731 -1.343 1.00 0.00 H new ATOM 0 HA3 GLY A 90 5.668 5.413 -0.515 1.00 0.00 H new ATOM 1396 N TYR A 91 7.970 7.031 -1.584 1.00 0.00 N ATOM 1397 CA TYR A 91 8.652 8.314 -1.701 1.00 0.00 C ATOM 1398 C TYR A 91 8.018 9.171 -2.793 1.00 0.00 C ATOM 1399 O TYR A 91 7.455 8.652 -3.756 1.00 0.00 O ATOM 1400 CB TYR A 91 10.136 8.101 -2.003 1.00 0.00 C ATOM 1401 CG TYR A 91 10.880 7.379 -0.903 1.00 0.00 C ATOM 1402 CD1 TYR A 91 10.868 5.992 -0.822 1.00 0.00 C ATOM 1403 CD2 TYR A 91 11.597 8.085 0.056 1.00 0.00 C ATOM 1404 CE1 TYR A 91 11.546 5.329 0.182 1.00 0.00 C ATOM 1405 CE2 TYR A 91 12.279 7.430 1.063 1.00 0.00 C ATOM 1406 CZ TYR A 91 12.250 6.052 1.123 1.00 0.00 C ATOM 1407 OH TYR A 91 12.928 5.395 2.124 1.00 0.00 O ATOM 0 H TYR A 91 7.954 6.482 -2.443 1.00 0.00 H new ATOM 0 HA TYR A 91 8.553 8.837 -0.750 1.00 0.00 H new ATOM 0 HB2 TYR A 91 10.232 7.533 -2.928 1.00 0.00 H new ATOM 0 HB3 TYR A 91 10.606 9.070 -2.173 1.00 0.00 H new ATOM 0 HD1 TYR A 91 10.319 5.422 -1.557 1.00 0.00 H new ATOM 0 HD2 TYR A 91 11.621 9.164 0.013 1.00 0.00 H new ATOM 0 HE1 TYR A 91 11.525 4.250 0.230 1.00 0.00 H new ATOM 0 HE2 TYR A 91 12.832 7.994 1.800 1.00 0.00 H new ATOM 0 HH TYR A 91 13.373 6.050 2.702 1.00 0.00 H new ATOM 1417 N ALA A 92 8.114 10.487 -2.634 1.00 0.00 N ATOM 1418 CA ALA A 92 7.553 11.417 -3.605 1.00 0.00 C ATOM 1419 C ALA A 92 8.644 12.276 -4.237 1.00 0.00 C ATOM 1420 O ALA A 92 9.084 13.267 -3.652 1.00 0.00 O ATOM 1421 CB ALA A 92 6.501 12.297 -2.947 1.00 0.00 C ATOM 0 H ALA A 92 8.575 10.933 -1.841 1.00 0.00 H new ATOM 0 HA ALA A 92 7.081 10.835 -4.397 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.091 12.987 -3.684 1.00 0.00 H new ATOM 0 HB2 ALA A 92 5.701 11.672 -2.550 1.00 0.00 H new ATOM 0 HB3 ALA A 92 6.957 12.863 -2.135 1.00 0.00 H new ATOM 1427 N LEU A 93 9.076 11.890 -5.432 1.00 0.00 N ATOM 1428 CA LEU A 93 10.116 12.625 -6.143 1.00 0.00 C ATOM 1429 C LEU A 93 9.506 13.649 -7.095 1.00 0.00 C ATOM 1430 O LEU A 93 8.712 13.302 -7.970 1.00 0.00 O ATOM 1431 CB LEU A 93 11.010 11.658 -6.921 1.00 0.00 C ATOM 1432 CG LEU A 93 11.491 10.424 -6.155 1.00 0.00 C ATOM 1433 CD1 LEU A 93 12.214 9.465 -7.088 1.00 0.00 C ATOM 1434 CD2 LEU A 93 12.394 10.832 -5.001 1.00 0.00 C ATOM 0 H LEU A 93 8.722 11.072 -5.929 1.00 0.00 H new ATOM 0 HA LEU A 93 10.719 13.156 -5.406 1.00 0.00 H new ATOM 0 HB2 LEU A 93 10.467 11.323 -7.805 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.884 12.206 -7.273 1.00 0.00 H new ATOM 0 HG LEU A 93 10.621 9.912 -5.745 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.549 8.593 -6.526 1.00 0.00 H new ATOM 0 HD12 LEU A 93 11.536 9.147 -7.880 1.00 0.00 H new ATOM 0 HD13 LEU A 93 13.076 9.966 -7.528 1.00 0.00 H new ATOM 0 HD21 LEU A 93 12.727 9.942 -4.467 1.00 0.00 H new ATOM 0 HD22 LEU A 93 13.260 11.368 -5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 93 11.843 11.479 -4.319 1.00 0.00 H new ATOM 1446 N ASP A 94 9.885 14.910 -6.920 1.00 0.00 N ATOM 1447 CA ASP A 94 9.378 15.985 -7.766 1.00 0.00 C ATOM 1448 C ASP A 94 9.974 15.901 -9.167 1.00 0.00 C ATOM 1449 O ASP A 94 10.736 14.985 -9.474 1.00 0.00 O ATOM 1450 CB ASP A 94 9.695 17.345 -7.143 1.00 0.00 C ATOM 1451 CG ASP A 94 11.181 17.643 -7.129 1.00 0.00 C ATOM 1452 OD1 ASP A 94 11.928 16.975 -7.875 1.00 0.00 O ATOM 1453 OD2 ASP A 94 11.598 18.545 -6.373 1.00 0.00 O ATOM 0 H ASP A 94 10.541 15.213 -6.200 1.00 0.00 H new ATOM 0 HA ASP A 94 8.297 15.874 -7.844 1.00 0.00 H new ATOM 0 HB2 ASP A 94 9.176 18.126 -7.699 1.00 0.00 H new ATOM 0 HB3 ASP A 94 9.312 17.372 -6.123 1.00 0.00 H new ATOM 1458 N ALA A 95 9.622 16.863 -10.013 1.00 0.00 N ATOM 1459 CA ALA A 95 10.123 16.899 -11.382 1.00 0.00 C ATOM 1460 C ALA A 95 11.631 16.676 -11.420 1.00 0.00 C ATOM 1461 O ALA A 95 12.141 15.965 -12.286 1.00 0.00 O ATOM 1462 CB ALA A 95 9.767 18.223 -12.040 1.00 0.00 C ATOM 0 H ALA A 95 8.991 17.628 -9.775 1.00 0.00 H new ATOM 0 HA ALA A 95 9.648 16.091 -11.938 1.00 0.00 H new ATOM 0 HB1 ALA A 95 10.147 18.236 -13.061 1.00 0.00 H new ATOM 0 HB2 ALA A 95 8.684 18.342 -12.055 1.00 0.00 H new ATOM 0 HB3 ALA A 95 10.215 19.041 -11.476 1.00 0.00 H new ATOM 1468 N ARG A 96 12.339 17.289 -10.477 1.00 0.00 N ATOM 1469 CA ARG A 96 13.789 17.158 -10.404 1.00 0.00 C ATOM 1470 C ARG A 96 14.190 15.726 -10.061 1.00 0.00 C ATOM 1471 O ARG A 96 15.190 15.214 -10.561 1.00 0.00 O ATOM 1472 CB ARG A 96 14.358 18.122 -9.361 1.00 0.00 C ATOM 1473 CG ARG A 96 14.511 19.547 -9.868 1.00 0.00 C ATOM 1474 CD ARG A 96 15.057 20.467 -8.787 1.00 0.00 C ATOM 1475 NE ARG A 96 14.125 20.616 -7.673 1.00 0.00 N ATOM 1476 CZ ARG A 96 14.320 21.451 -6.658 1.00 0.00 C ATOM 1477 NH1 ARG A 96 15.408 22.208 -6.618 1.00 0.00 N ATOM 1478 NH2 ARG A 96 13.426 21.529 -5.681 1.00 0.00 N ATOM 0 H ARG A 96 11.932 17.881 -9.753 1.00 0.00 H new ATOM 0 HA ARG A 96 14.200 17.407 -11.382 1.00 0.00 H new ATOM 0 HB2 ARG A 96 13.707 18.124 -8.487 1.00 0.00 H new ATOM 0 HB3 ARG A 96 15.331 17.756 -9.033 1.00 0.00 H new ATOM 0 HG2 ARG A 96 15.180 19.558 -10.729 1.00 0.00 H new ATOM 0 HG3 ARG A 96 13.545 19.919 -10.210 1.00 0.00 H new ATOM 0 HD2 ARG A 96 16.003 20.071 -8.418 1.00 0.00 H new ATOM 0 HD3 ARG A 96 15.268 21.446 -9.217 1.00 0.00 H new ATOM 0 HE ARG A 96 13.278 20.048 -7.674 1.00 0.00 H new ATOM 0 HH11 ARG A 96 16.097 22.150 -7.367 1.00 0.00 H new ATOM 0 HH12 ARG A 96 15.555 22.848 -5.838 1.00 0.00 H new ATOM 0 HH21 ARG A 96 12.588 20.948 -5.709 1.00 0.00 H new ATOM 0 HH22 ARG A 96 13.576 22.170 -4.902 1.00 0.00 H new ATOM 1492 N GLY A 97 13.402 15.086 -9.203 1.00 0.00 N ATOM 1493 CA GLY A 97 13.691 13.720 -8.807 1.00 0.00 C ATOM 1494 C GLY A 97 14.162 13.621 -7.370 1.00 0.00 C ATOM 1495 O GLY A 97 14.897 12.701 -7.013 1.00 0.00 O ATOM 0 H GLY A 97 12.568 15.489 -8.775 1.00 0.00 H new ATOM 0 HA2 GLY A 97 12.797 13.111 -8.936 1.00 0.00 H new ATOM 0 HA3 GLY A 97 14.455 13.308 -9.466 1.00 0.00 H new ATOM 1499 N ASN A 98 13.738 14.571 -6.543 1.00 0.00 N ATOM 1500 CA ASN A 98 14.123 14.587 -5.136 1.00 0.00 C ATOM 1501 C ASN A 98 12.895 14.501 -4.235 1.00 0.00 C ATOM 1502 O ASN A 98 11.823 14.997 -4.580 1.00 0.00 O ATOM 1503 CB ASN A 98 14.915 15.857 -4.817 1.00 0.00 C ATOM 1504 CG ASN A 98 14.107 17.118 -5.058 1.00 0.00 C ATOM 1505 OD1 ASN A 98 12.907 17.161 -4.787 1.00 0.00 O ATOM 1506 ND2 ASN A 98 14.764 18.152 -5.570 1.00 0.00 N ATOM 0 H ASN A 98 13.128 15.339 -6.822 1.00 0.00 H new ATOM 0 HA ASN A 98 14.752 13.717 -4.947 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.238 15.829 -3.776 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.816 15.883 -5.430 1.00 0.00 H new ATOM 0 HD21 ASN A 98 14.274 19.027 -5.754 1.00 0.00 H new ATOM 0 HD22 ASN A 98 15.759 18.071 -5.779 1.00 0.00 H new ATOM 1513 N ASN A 99 13.060 13.867 -3.078 1.00 0.00 N ATOM 1514 CA ASN A 99 11.965 13.716 -2.127 1.00 0.00 C ATOM 1515 C ASN A 99 11.661 15.040 -1.432 1.00 0.00 C ATOM 1516 O ASN A 99 12.456 15.529 -0.630 1.00 0.00 O ATOM 1517 CB ASN A 99 12.309 12.648 -1.086 1.00 0.00 C ATOM 1518 CG ASN A 99 13.576 12.977 -0.319 1.00 0.00 C ATOM 1519 OD1 ASN A 99 14.580 13.384 -0.902 1.00 0.00 O ATOM 1520 ND2 ASN A 99 13.532 12.800 0.997 1.00 0.00 N ATOM 0 H ASN A 99 13.941 13.450 -2.777 1.00 0.00 H new ATOM 0 HA ASN A 99 11.078 13.404 -2.679 1.00 0.00 H new ATOM 0 HB2 ASN A 99 11.480 12.546 -0.386 1.00 0.00 H new ATOM 0 HB3 ASN A 99 12.427 11.685 -1.583 1.00 0.00 H new ATOM 0 HD21 ASN A 99 14.353 13.004 1.567 1.00 0.00 H new ATOM 0 HD22 ASN A 99 12.677 12.460 1.438 1.00 0.00 H new ATOM 1527 N VAL A 100 10.503 15.614 -1.745 1.00 0.00 N ATOM 1528 CA VAL A 100 10.092 16.880 -1.150 1.00 0.00 C ATOM 1529 C VAL A 100 9.431 16.661 0.206 1.00 0.00 C ATOM 1530 O VAL A 100 9.467 17.534 1.073 1.00 0.00 O ATOM 1531 CB VAL A 100 9.117 17.641 -2.067 1.00 0.00 C ATOM 1532 CG1 VAL A 100 9.825 18.108 -3.330 1.00 0.00 C ATOM 1533 CG2 VAL A 100 7.919 16.769 -2.410 1.00 0.00 C ATOM 0 H VAL A 100 9.833 15.222 -2.407 1.00 0.00 H new ATOM 0 HA VAL A 100 10.995 17.476 -1.019 1.00 0.00 H new ATOM 0 HB VAL A 100 8.757 18.521 -1.534 1.00 0.00 H new ATOM 0 HG11 VAL A 100 9.120 18.644 -3.965 1.00 0.00 H new ATOM 0 HG12 VAL A 100 10.648 18.771 -3.062 1.00 0.00 H new ATOM 0 HG13 VAL A 100 10.215 17.245 -3.869 1.00 0.00 H new ATOM 0 HG21 VAL A 100 7.240 17.322 -3.059 1.00 0.00 H new ATOM 0 HG22 VAL A 100 8.259 15.869 -2.923 1.00 0.00 H new ATOM 0 HG23 VAL A 100 7.398 16.489 -1.494 1.00 0.00 H new ATOM 1543 N GLU A 101 8.829 15.489 0.383 1.00 0.00 N ATOM 1544 CA GLU A 101 8.159 15.156 1.634 1.00 0.00 C ATOM 1545 C GLU A 101 8.600 13.785 2.139 1.00 0.00 C ATOM 1546 O GLU A 101 8.469 12.781 1.439 1.00 0.00 O ATOM 1547 CB GLU A 101 6.641 15.179 1.448 1.00 0.00 C ATOM 1548 CG GLU A 101 6.082 16.564 1.170 1.00 0.00 C ATOM 1549 CD GLU A 101 5.955 17.405 2.426 1.00 0.00 C ATOM 1550 OE1 GLU A 101 6.973 17.577 3.128 1.00 0.00 O ATOM 1551 OE2 GLU A 101 4.839 17.889 2.706 1.00 0.00 O ATOM 0 H GLU A 101 8.792 14.755 -0.324 1.00 0.00 H new ATOM 0 HA GLU A 101 8.438 15.904 2.376 1.00 0.00 H new ATOM 0 HB2 GLU A 101 6.374 14.517 0.624 1.00 0.00 H new ATOM 0 HB3 GLU A 101 6.168 14.779 2.345 1.00 0.00 H new ATOM 0 HG2 GLU A 101 6.729 17.077 0.458 1.00 0.00 H new ATOM 0 HG3 GLU A 101 5.103 16.469 0.700 1.00 0.00 H new ATOM 1558 N LYS A 102 9.124 13.751 3.360 1.00 0.00 N ATOM 1559 CA LYS A 102 9.585 12.505 3.961 1.00 0.00 C ATOM 1560 C LYS A 102 8.647 11.353 3.611 1.00 0.00 C ATOM 1561 O LYS A 102 7.449 11.539 3.400 1.00 0.00 O ATOM 1562 CB LYS A 102 9.683 12.654 5.481 1.00 0.00 C ATOM 1563 CG LYS A 102 8.348 12.519 6.192 1.00 0.00 C ATOM 1564 CD LYS A 102 7.500 13.769 6.029 1.00 0.00 C ATOM 1565 CE LYS A 102 7.757 14.767 7.147 1.00 0.00 C ATOM 1566 NZ LYS A 102 8.847 15.721 6.799 1.00 0.00 N ATOM 0 H LYS A 102 9.240 14.573 3.953 1.00 0.00 H new ATOM 0 HA LYS A 102 10.573 12.280 3.560 1.00 0.00 H new ATOM 0 HB2 LYS A 102 10.369 11.901 5.868 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.113 13.628 5.715 1.00 0.00 H new ATOM 0 HG2 LYS A 102 7.809 11.659 5.795 1.00 0.00 H new ATOM 0 HG3 LYS A 102 8.517 12.329 7.252 1.00 0.00 H new ATOM 0 HD2 LYS A 102 7.717 14.234 5.068 1.00 0.00 H new ATOM 0 HD3 LYS A 102 6.445 13.495 6.020 1.00 0.00 H new ATOM 0 HE2 LYS A 102 6.842 15.321 7.356 1.00 0.00 H new ATOM 0 HE3 LYS A 102 8.021 14.231 8.059 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 8.723 16.601 7.339 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 9.767 15.297 7.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 8.812 15.932 5.781 1.00 0.00 H new ATOM 1580 N PRO A 103 9.204 10.134 3.551 1.00 0.00 N ATOM 1581 CA PRO A 103 8.434 8.929 3.229 1.00 0.00 C ATOM 1582 C PRO A 103 7.471 8.541 4.346 1.00 0.00 C ATOM 1583 O PRO A 103 7.439 9.176 5.401 1.00 0.00 O ATOM 1584 CB PRO A 103 9.512 7.856 3.056 1.00 0.00 C ATOM 1585 CG PRO A 103 10.661 8.338 3.873 1.00 0.00 C ATOM 1586 CD PRO A 103 10.626 9.839 3.791 1.00 0.00 C ATOM 0 HA PRO A 103 7.807 9.069 2.349 1.00 0.00 H new ATOM 0 HB2 PRO A 103 9.161 6.883 3.401 1.00 0.00 H new ATOM 0 HB3 PRO A 103 9.792 7.741 2.009 1.00 0.00 H new ATOM 0 HG2 PRO A 103 10.574 8.001 4.906 1.00 0.00 H new ATOM 0 HG3 PRO A 103 11.604 7.948 3.489 1.00 0.00 H new ATOM 0 HD2 PRO A 103 10.982 10.300 4.712 1.00 0.00 H new ATOM 0 HD3 PRO A 103 11.256 10.212 2.983 1.00 0.00 H new ATOM 1594 N LEU A 104 6.687 7.495 4.108 1.00 0.00 N ATOM 1595 CA LEU A 104 5.723 7.022 5.095 1.00 0.00 C ATOM 1596 C LEU A 104 5.985 5.563 5.457 1.00 0.00 C ATOM 1597 O LEU A 104 6.885 4.930 4.906 1.00 0.00 O ATOM 1598 CB LEU A 104 4.298 7.178 4.560 1.00 0.00 C ATOM 1599 CG LEU A 104 4.047 6.640 3.151 1.00 0.00 C ATOM 1600 CD1 LEU A 104 3.659 5.170 3.203 1.00 0.00 C ATOM 1601 CD2 LEU A 104 2.967 7.454 2.454 1.00 0.00 C ATOM 0 H LEU A 104 6.700 6.959 3.240 1.00 0.00 H new ATOM 0 HA LEU A 104 5.836 7.626 5.995 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.617 6.675 5.246 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.040 8.237 4.574 1.00 0.00 H new ATOM 0 HG LEU A 104 4.970 6.732 2.578 1.00 0.00 H new ATOM 0 HD11 LEU A 104 3.484 4.804 2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 104 4.465 4.597 3.662 1.00 0.00 H new ATOM 0 HD13 LEU A 104 2.750 5.054 3.793 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.802 7.057 1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.041 7.395 3.026 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.284 8.495 2.384 1.00 0.00 H new ATOM 1613 N GLU A 105 5.191 5.037 6.384 1.00 0.00 N ATOM 1614 CA GLU A 105 5.338 3.652 6.818 1.00 0.00 C ATOM 1615 C GLU A 105 4.203 2.789 6.274 1.00 0.00 C ATOM 1616 O GLU A 105 3.035 2.995 6.610 1.00 0.00 O ATOM 1617 CB GLU A 105 5.366 3.573 8.346 1.00 0.00 C ATOM 1618 CG GLU A 105 5.950 2.275 8.877 1.00 0.00 C ATOM 1619 CD GLU A 105 5.907 2.193 10.391 1.00 0.00 C ATOM 1620 OE1 GLU A 105 6.288 3.184 11.049 1.00 0.00 O ATOM 1621 OE2 GLU A 105 5.494 1.138 10.917 1.00 0.00 O ATOM 0 H GLU A 105 4.440 5.548 6.849 1.00 0.00 H new ATOM 0 HA GLU A 105 6.281 3.273 6.425 1.00 0.00 H new ATOM 0 HB2 GLU A 105 5.948 4.409 8.734 1.00 0.00 H new ATOM 0 HB3 GLU A 105 4.351 3.687 8.726 1.00 0.00 H new ATOM 0 HG2 GLU A 105 5.400 1.434 8.455 1.00 0.00 H new ATOM 0 HG3 GLU A 105 6.983 2.181 8.541 1.00 0.00 H new ATOM 1628 N LEU A 106 4.553 1.823 5.432 1.00 0.00 N ATOM 1629 CA LEU A 106 3.565 0.928 4.841 1.00 0.00 C ATOM 1630 C LEU A 106 3.762 -0.502 5.332 1.00 0.00 C ATOM 1631 O LEU A 106 4.746 -1.157 4.988 1.00 0.00 O ATOM 1632 CB LEU A 106 3.656 0.972 3.315 1.00 0.00 C ATOM 1633 CG LEU A 106 2.733 0.016 2.559 1.00 0.00 C ATOM 1634 CD1 LEU A 106 1.283 0.454 2.696 1.00 0.00 C ATOM 1635 CD2 LEU A 106 3.132 -0.063 1.092 1.00 0.00 C ATOM 0 H LEU A 106 5.514 1.640 5.143 1.00 0.00 H new ATOM 0 HA LEU A 106 2.576 1.265 5.150 1.00 0.00 H new ATOM 0 HB2 LEU A 106 3.440 1.989 2.987 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.685 0.756 3.026 1.00 0.00 H new ATOM 0 HG LEU A 106 2.834 -0.977 2.996 1.00 0.00 H new ATOM 0 HD11 LEU A 106 0.641 -0.238 2.151 1.00 0.00 H new ATOM 0 HD12 LEU A 106 1.002 0.458 3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 106 1.166 1.457 2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 106 2.464 -0.748 0.570 1.00 0.00 H new ATOM 0 HD22 LEU A 106 3.061 0.927 0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.157 -0.425 1.013 1.00 0.00 H new ATOM 1647 N ARG A 107 2.820 -0.981 6.137 1.00 0.00 N ATOM 1648 CA ARG A 107 2.890 -2.335 6.675 1.00 0.00 C ATOM 1649 C ARG A 107 1.827 -3.227 6.041 1.00 0.00 C ATOM 1650 O ARG A 107 0.630 -2.971 6.170 1.00 0.00 O ATOM 1651 CB ARG A 107 2.712 -2.312 8.195 1.00 0.00 C ATOM 1652 CG ARG A 107 3.368 -3.487 8.902 1.00 0.00 C ATOM 1653 CD ARG A 107 2.626 -3.854 10.177 1.00 0.00 C ATOM 1654 NE ARG A 107 2.495 -2.715 11.081 1.00 0.00 N ATOM 1655 CZ ARG A 107 3.474 -2.287 11.871 1.00 0.00 C ATOM 1656 NH1 ARG A 107 4.649 -2.901 11.867 1.00 0.00 N ATOM 1657 NH2 ARG A 107 3.278 -1.243 12.666 1.00 0.00 N ATOM 0 H ARG A 107 1.999 -0.452 6.431 1.00 0.00 H new ATOM 0 HA ARG A 107 3.872 -2.744 6.437 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.128 -1.384 8.587 1.00 0.00 H new ATOM 0 HB3 ARG A 107 1.647 -2.307 8.428 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.393 -4.348 8.234 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.402 -3.239 9.140 1.00 0.00 H new ATOM 0 HD2 ARG A 107 1.635 -4.232 9.924 1.00 0.00 H new ATOM 0 HD3 ARG A 107 3.155 -4.661 10.685 1.00 0.00 H new ATOM 0 HE ARG A 107 1.603 -2.221 11.108 1.00 0.00 H new ATOM 0 HH11 ARG A 107 4.803 -3.704 11.257 1.00 0.00 H new ATOM 0 HH12 ARG A 107 5.399 -2.571 12.474 1.00 0.00 H new ATOM 0 HH21 ARG A 107 2.375 -0.768 12.671 1.00 0.00 H new ATOM 0 HH22 ARG A 107 4.030 -0.915 13.272 1.00 0.00 H new ATOM 1671 N ILE A 108 2.273 -4.275 5.357 1.00 0.00 N ATOM 1672 CA ILE A 108 1.361 -5.205 4.703 1.00 0.00 C ATOM 1673 C ILE A 108 1.204 -6.485 5.518 1.00 0.00 C ATOM 1674 O ILE A 108 2.077 -7.354 5.504 1.00 0.00 O ATOM 1675 CB ILE A 108 1.844 -5.567 3.287 1.00 0.00 C ATOM 1676 CG1 ILE A 108 1.940 -4.310 2.420 1.00 0.00 C ATOM 1677 CG2 ILE A 108 0.909 -6.585 2.652 1.00 0.00 C ATOM 1678 CD1 ILE A 108 2.751 -4.507 1.158 1.00 0.00 C ATOM 0 H ILE A 108 3.261 -4.501 5.241 1.00 0.00 H new ATOM 0 HA ILE A 108 0.397 -4.702 4.630 1.00 0.00 H new ATOM 0 HB ILE A 108 2.837 -6.011 3.361 1.00 0.00 H new ATOM 0 HG12 ILE A 108 0.935 -3.987 2.149 1.00 0.00 H new ATOM 0 HG13 ILE A 108 2.385 -3.507 3.007 1.00 0.00 H new ATOM 0 HG21 ILE A 108 1.264 -6.831 1.651 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.887 -7.489 3.261 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.095 -6.166 2.588 1.00 0.00 H new ATOM 0 HD11 ILE A 108 2.776 -3.575 0.593 1.00 0.00 H new ATOM 0 HD12 ILE A 108 3.767 -4.800 1.421 1.00 0.00 H new ATOM 0 HD13 ILE A 108 2.294 -5.288 0.550 1.00 0.00 H new ATOM 1690 N LYS A 109 0.086 -6.596 6.226 1.00 0.00 N ATOM 1691 CA LYS A 109 -0.188 -7.771 7.045 1.00 0.00 C ATOM 1692 C LYS A 109 -0.744 -8.909 6.195 1.00 0.00 C ATOM 1693 O LYS A 109 -1.539 -8.684 5.282 1.00 0.00 O ATOM 1694 CB LYS A 109 -1.178 -7.422 8.159 1.00 0.00 C ATOM 1695 CG LYS A 109 -1.224 -8.450 9.276 1.00 0.00 C ATOM 1696 CD LYS A 109 -2.578 -8.464 9.965 1.00 0.00 C ATOM 1697 CE LYS A 109 -2.708 -9.647 10.913 1.00 0.00 C ATOM 1698 NZ LYS A 109 -2.867 -10.932 10.178 1.00 0.00 N ATOM 0 H LYS A 109 -0.646 -5.886 6.249 1.00 0.00 H new ATOM 0 HA LYS A 109 0.751 -8.099 7.491 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -0.912 -6.452 8.580 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -2.174 -7.320 7.729 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -1.011 -9.439 8.871 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -0.445 -8.230 10.006 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -2.715 -7.535 10.519 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -3.368 -8.508 9.216 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -1.825 -9.700 11.551 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -3.566 -9.495 11.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -3.671 -11.461 10.573 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -3.042 -10.737 9.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -1.999 -11.497 10.275 1.00 0.00 H new ATOM 1712 N VAL A 110 -0.323 -10.131 6.502 1.00 0.00 N ATOM 1713 CA VAL A 110 -0.781 -11.305 5.768 1.00 0.00 C ATOM 1714 C VAL A 110 -1.807 -12.092 6.576 1.00 0.00 C ATOM 1715 O VAL A 110 -1.466 -12.753 7.558 1.00 0.00 O ATOM 1716 CB VAL A 110 0.393 -12.234 5.406 1.00 0.00 C ATOM 1717 CG1 VAL A 110 -0.083 -13.376 4.522 1.00 0.00 C ATOM 1718 CG2 VAL A 110 1.503 -11.448 4.724 1.00 0.00 C ATOM 0 H VAL A 110 0.335 -10.335 7.254 1.00 0.00 H new ATOM 0 HA VAL A 110 -1.245 -10.944 4.850 1.00 0.00 H new ATOM 0 HB VAL A 110 0.793 -12.661 6.326 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.760 -14.022 4.276 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.841 -13.954 5.051 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.510 -12.972 3.604 1.00 0.00 H new ATOM 0 HG21 VAL A 110 2.325 -12.120 4.475 1.00 0.00 H new ATOM 0 HG22 VAL A 110 1.118 -10.992 3.812 1.00 0.00 H new ATOM 0 HG23 VAL A 110 1.863 -10.669 5.396 1.00 0.00 H new ATOM 1728 N LEU A 111 -3.065 -12.018 6.156 1.00 0.00 N ATOM 1729 CA LEU A 111 -4.143 -12.725 6.839 1.00 0.00 C ATOM 1730 C LEU A 111 -4.053 -14.227 6.590 1.00 0.00 C ATOM 1731 O LEU A 111 -3.652 -14.665 5.511 1.00 0.00 O ATOM 1732 CB LEU A 111 -5.501 -12.200 6.371 1.00 0.00 C ATOM 1733 CG LEU A 111 -5.730 -10.696 6.531 1.00 0.00 C ATOM 1734 CD1 LEU A 111 -6.884 -10.236 5.654 1.00 0.00 C ATOM 1735 CD2 LEU A 111 -5.995 -10.349 7.989 1.00 0.00 C ATOM 0 H LEU A 111 -3.364 -11.475 5.346 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.040 -12.546 7.909 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -5.624 -12.456 5.319 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.281 -12.727 6.921 1.00 0.00 H new ATOM 0 HG LEU A 111 -4.828 -10.174 6.212 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -7.032 -9.164 5.781 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -6.655 -10.450 4.610 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -7.793 -10.765 5.942 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -6.156 -9.275 8.084 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -6.882 -10.880 8.334 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -5.138 -10.643 8.595 1.00 0.00 H new ATOM 1747 N ASP A 112 -4.429 -15.012 7.594 1.00 0.00 N ATOM 1748 CA ASP A 112 -4.394 -16.465 7.483 1.00 0.00 C ATOM 1749 C ASP A 112 -5.360 -16.952 6.407 1.00 0.00 C ATOM 1750 O ASP A 112 -6.209 -16.195 5.934 1.00 0.00 O ATOM 1751 CB ASP A 112 -4.741 -17.109 8.826 1.00 0.00 C ATOM 1752 CG ASP A 112 -5.779 -16.317 9.597 1.00 0.00 C ATOM 1753 OD1 ASP A 112 -5.391 -15.376 10.319 1.00 0.00 O ATOM 1754 OD2 ASP A 112 -6.980 -16.640 9.478 1.00 0.00 O ATOM 0 H ASP A 112 -4.762 -14.666 8.494 1.00 0.00 H new ATOM 0 HA ASP A 112 -3.384 -16.758 7.198 1.00 0.00 H new ATOM 0 HB2 ASP A 112 -5.112 -18.120 8.656 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -3.836 -17.199 9.427 1.00 0.00 H new ATOM 1759 N ILE A 113 -5.224 -18.217 6.025 1.00 0.00 N ATOM 1760 CA ILE A 113 -6.085 -18.803 5.005 1.00 0.00 C ATOM 1761 C ILE A 113 -7.526 -18.903 5.493 1.00 0.00 C ATOM 1762 O ILE A 113 -8.467 -18.785 4.710 1.00 0.00 O ATOM 1763 CB ILE A 113 -5.596 -20.204 4.593 1.00 0.00 C ATOM 1764 CG1 ILE A 113 -6.462 -20.758 3.460 1.00 0.00 C ATOM 1765 CG2 ILE A 113 -5.614 -21.144 5.789 1.00 0.00 C ATOM 1766 CD1 ILE A 113 -6.429 -19.913 2.206 1.00 0.00 C ATOM 0 H ILE A 113 -4.526 -18.856 6.406 1.00 0.00 H new ATOM 0 HA ILE A 113 -6.042 -18.143 4.139 1.00 0.00 H new ATOM 0 HB ILE A 113 -4.570 -20.123 4.234 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -6.127 -21.767 3.218 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -7.492 -20.839 3.807 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -5.266 -22.130 5.482 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -4.959 -20.754 6.568 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -6.630 -21.222 6.175 1.00 0.00 H new ATOM 0 HD11 ILE A 113 -7.065 -20.366 1.445 1.00 0.00 H new ATOM 0 HD12 ILE A 113 -6.792 -18.911 2.433 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -5.406 -19.853 1.835 1.00 0.00 H new ATOM 1778 N ASN A 114 -7.691 -19.121 6.794 1.00 0.00 N ATOM 1779 CA ASN A 114 -9.018 -19.236 7.388 1.00 0.00 C ATOM 1780 C ASN A 114 -9.490 -17.889 7.928 1.00 0.00 C ATOM 1781 O ASN A 114 -10.260 -17.829 8.887 1.00 0.00 O ATOM 1782 CB ASN A 114 -9.008 -20.274 8.511 1.00 0.00 C ATOM 1783 CG ASN A 114 -9.001 -21.696 7.985 1.00 0.00 C ATOM 1784 OD1 ASN A 114 -10.042 -22.237 7.612 1.00 0.00 O ATOM 1785 ND2 ASN A 114 -7.823 -22.309 7.952 1.00 0.00 N ATOM 0 H ASN A 114 -6.922 -19.222 7.457 1.00 0.00 H new ATOM 0 HA ASN A 114 -9.711 -19.559 6.611 1.00 0.00 H new ATOM 0 HB2 ASN A 114 -8.131 -20.118 9.139 1.00 0.00 H new ATOM 0 HB3 ASN A 114 -9.883 -20.128 9.144 1.00 0.00 H new ATOM 0 HD21 ASN A 114 -7.756 -23.267 7.607 1.00 0.00 H new ATOM 0 HD22 ASN A 114 -6.986 -21.822 8.271 1.00 0.00 H new ATOM 1792 N ASP A 115 -9.024 -16.812 7.306 1.00 0.00 N ATOM 1793 CA ASP A 115 -9.400 -15.466 7.723 1.00 0.00 C ATOM 1794 C ASP A 115 -10.658 -15.003 6.996 1.00 0.00 C ATOM 1795 O ASP A 115 -10.584 -14.258 6.020 1.00 0.00 O ATOM 1796 CB ASP A 115 -8.254 -14.488 7.458 1.00 0.00 C ATOM 1797 CG ASP A 115 -8.545 -13.098 7.987 1.00 0.00 C ATOM 1798 OD1 ASP A 115 -8.783 -12.965 9.206 1.00 0.00 O ATOM 1799 OD2 ASP A 115 -8.535 -12.142 7.183 1.00 0.00 O ATOM 0 H ASP A 115 -8.385 -16.844 6.511 1.00 0.00 H new ATOM 0 HA ASP A 115 -9.608 -15.489 8.793 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -7.343 -14.866 7.921 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -8.067 -14.434 6.385 1.00 0.00 H new