USER MOD reduce.3.24.130724 H: found=0, std=0, add=865, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 867 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 49 LYS NZ :NH3+ -150:sc= -5.65! (180deg=-0.373) USER MOD Set 1.2: A 93 LYS NZ :NH3+ 180:sc= -3.86! (180deg=0) USER MOD Set 1.3: A 106 GLN : amide:sc= 0.0153 K(o=-9.5,f=-10) USER MOD Set 2.1: A 23 ASN :FLIP amide:sc= 1.28 F(o=-2.2,f=2.6) USER MOD Set 2.2: A 24 SER OG : rot -34:sc= 0.41 USER MOD Set 2.3: A 26 THR OG1 : rot 12:sc= 0.925 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl -120:sc= -2.46! (180deg=-4.56!) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ 145:sc= -1.36 (180deg=-3.77!) USER MOD Single : A 37 LYS NZ :NH3+ -176:sc= -3.7! (180deg=-3.76!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 44 MET CE :methyl 156:sc= -1.07 (180deg=-1.99!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 MET CE :methyl -147:sc= -2.14! (180deg=-3.75!) USER MOD Single : A 59 LYS NZ :NH3+ -137:sc= -0.82 (180deg=-3.48!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 180:sc= -3.3! USER MOD Single : A 65 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 180:sc= -0.176 USER MOD Single : A 89 SER OG : rot 73:sc= 0.163 USER MOD Single : A 90 TYR OH : rot 180:sc= -0.166 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 TYR OH : rot 180:sc= 0 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN :FLIP amide:sc= -4.93! C(o=-8.4!,f=-4.9!) USER MOD Single : A 108 CYS SG : rot -161:sc= -3.73! USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= -0.253 X(o=-0.25,f=-0.018) USER MOD Single : A 121 MET CE :methyl -136:sc= -4.23! (180deg=-5.07!) USER MOD Single : A 123 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.0899) USER MOD Single : A 127 GLN : amide:sc= -6.39! C(o=-6.4!,f=-7!) USER MOD Single : A 129 ASN :FLIP amide:sc= -1.65 F(o=-9.1!,f=-1.7) USER MOD Single : A 132 GLN : amide:sc= 0.261 X(o=0.26,f=-0.062) USER MOD Single : A 135 TYR OH : rot 180:sc= 0 USER MOD Single : A 141 MET CE :methyl 171:sc= -0.841 (180deg=-0.979) USER MOD Single : A 142 MET CE :methyl 158:sc= -0.189 (180deg=-0.75) USER MOD ----------------------------------------------------------------- ATOM 160 N LEU A 12 1.779 -12.380 5.224 1.00 0.00 N ATOM 161 CA LEU A 12 1.441 -10.993 5.513 1.00 0.00 C ATOM 162 C LEU A 12 2.459 -10.046 4.893 1.00 0.00 C ATOM 163 O LEU A 12 2.090 -9.010 4.340 1.00 0.00 O ATOM 164 CB LEU A 12 1.365 -10.768 7.026 1.00 0.00 C ATOM 165 CG LEU A 12 0.222 -11.497 7.738 1.00 0.00 C ATOM 166 CD1 LEU A 12 0.336 -11.321 9.243 1.00 0.00 C ATOM 167 CD2 LEU A 12 -1.124 -10.989 7.245 1.00 0.00 C ATOM 0 HA LEU A 12 0.465 -10.783 5.075 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.309 -11.083 7.472 1.00 0.00 H new ATOM 0 HB3 LEU A 12 1.265 -9.699 7.213 1.00 0.00 H new ATOM 0 HG LEU A 12 0.295 -12.560 7.507 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.484 -11.845 9.734 1.00 0.00 H new ATOM 0 HD12 LEU A 12 1.286 -11.731 9.586 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.288 -10.260 9.490 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -1.924 -11.518 7.762 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.206 -9.921 7.447 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -1.208 -11.163 6.172 1.00 0.00 H new ATOM 179 N LYS A 13 3.739 -10.409 4.973 1.00 0.00 N ATOM 180 CA LYS A 13 4.788 -9.580 4.393 1.00 0.00 C ATOM 181 C LYS A 13 4.498 -9.351 2.919 1.00 0.00 C ATOM 182 O LYS A 13 4.776 -8.283 2.373 1.00 0.00 O ATOM 183 CB LYS A 13 6.161 -10.226 4.583 1.00 0.00 C ATOM 184 CG LYS A 13 7.292 -9.464 3.911 1.00 0.00 C ATOM 185 CD LYS A 13 8.642 -10.118 4.160 1.00 0.00 C ATOM 186 CE LYS A 13 9.021 -10.084 5.634 1.00 0.00 C ATOM 187 NZ LYS A 13 10.340 -10.728 5.884 1.00 0.00 N ATOM 0 H LYS A 13 4.069 -11.260 5.428 1.00 0.00 H new ATOM 0 HA LYS A 13 4.803 -8.618 4.905 1.00 0.00 H new ATOM 0 HB2 LYS A 13 6.371 -10.305 5.650 1.00 0.00 H new ATOM 0 HB3 LYS A 13 6.133 -11.241 4.187 1.00 0.00 H new ATOM 0 HG2 LYS A 13 7.107 -9.411 2.838 1.00 0.00 H new ATOM 0 HG3 LYS A 13 7.311 -8.439 4.283 1.00 0.00 H new ATOM 0 HD2 LYS A 13 8.615 -11.152 3.815 1.00 0.00 H new ATOM 0 HD3 LYS A 13 9.407 -9.607 3.576 1.00 0.00 H new ATOM 0 HE2 LYS A 13 9.051 -9.050 5.977 1.00 0.00 H new ATOM 0 HE3 LYS A 13 8.253 -10.591 6.218 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 10.561 -10.684 6.899 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 10.304 -11.722 5.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 11.078 -10.229 5.347 1.00 0.00 H new ATOM 201 N GLU A 14 3.895 -10.355 2.290 1.00 0.00 N ATOM 202 CA GLU A 14 3.516 -10.262 0.889 1.00 0.00 C ATOM 203 C GLU A 14 2.198 -9.512 0.787 1.00 0.00 C ATOM 204 O GLU A 14 1.994 -8.707 -0.120 1.00 0.00 O ATOM 205 CB GLU A 14 3.383 -11.659 0.274 1.00 0.00 C ATOM 206 CG GLU A 14 3.010 -11.645 -1.200 1.00 0.00 C ATOM 207 CD GLU A 14 2.863 -13.039 -1.780 1.00 0.00 C ATOM 208 OE1 GLU A 14 3.056 -14.019 -1.030 1.00 0.00 O ATOM 209 OE2 GLU A 14 2.558 -13.151 -2.986 1.00 0.00 O ATOM 0 H GLU A 14 3.659 -11.243 2.732 1.00 0.00 H new ATOM 0 HA GLU A 14 4.288 -9.725 0.338 1.00 0.00 H new ATOM 0 HB2 GLU A 14 4.326 -12.191 0.396 1.00 0.00 H new ATOM 0 HB3 GLU A 14 2.628 -12.219 0.826 1.00 0.00 H new ATOM 0 HG2 GLU A 14 2.074 -11.102 -1.328 1.00 0.00 H new ATOM 0 HG3 GLU A 14 3.773 -11.102 -1.758 1.00 0.00 H new ATOM 216 N LEU A 15 1.315 -9.772 1.748 1.00 0.00 N ATOM 217 CA LEU A 15 0.017 -9.113 1.795 1.00 0.00 C ATOM 218 C LEU A 15 0.198 -7.606 1.898 1.00 0.00 C ATOM 219 O LEU A 15 -0.663 -6.833 1.479 1.00 0.00 O ATOM 220 CB LEU A 15 -0.796 -9.624 2.982 1.00 0.00 C ATOM 221 CG LEU A 15 -2.203 -9.035 3.105 1.00 0.00 C ATOM 222 CD1 LEU A 15 -3.017 -9.322 1.853 1.00 0.00 C ATOM 223 CD2 LEU A 15 -2.902 -9.582 4.339 1.00 0.00 C ATOM 0 H LEU A 15 1.477 -10.436 2.505 1.00 0.00 H new ATOM 0 HA LEU A 15 -0.523 -9.343 0.876 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -0.878 -10.708 2.907 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.247 -9.408 3.899 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.115 -7.954 3.211 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.014 -8.895 1.961 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -2.524 -8.878 0.988 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -3.098 -10.400 1.711 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -3.901 -9.153 4.411 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.977 -10.667 4.264 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.329 -9.319 5.228 1.00 0.00 H new ATOM 235 N PHE A 16 1.335 -7.196 2.449 1.00 0.00 N ATOM 236 CA PHE A 16 1.645 -5.784 2.594 1.00 0.00 C ATOM 237 C PHE A 16 1.939 -5.164 1.239 1.00 0.00 C ATOM 238 O PHE A 16 1.523 -4.040 0.953 1.00 0.00 O ATOM 239 CB PHE A 16 2.858 -5.576 3.499 1.00 0.00 C ATOM 240 CG PHE A 16 3.442 -4.201 3.343 1.00 0.00 C ATOM 241 CD1 PHE A 16 2.711 -3.080 3.704 1.00 0.00 C ATOM 242 CD2 PHE A 16 4.699 -4.026 2.786 1.00 0.00 C ATOM 243 CE1 PHE A 16 3.223 -1.814 3.513 1.00 0.00 C ATOM 244 CE2 PHE A 16 5.220 -2.759 2.602 1.00 0.00 C ATOM 245 CZ PHE A 16 4.477 -1.653 2.963 1.00 0.00 C ATOM 0 H PHE A 16 2.056 -7.825 2.802 1.00 0.00 H new ATOM 0 HA PHE A 16 0.775 -5.304 3.043 1.00 0.00 H new ATOM 0 HB2 PHE A 16 2.567 -5.731 4.538 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.618 -6.322 3.266 1.00 0.00 H new ATOM 0 HD1 PHE A 16 1.730 -3.199 4.140 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.278 -4.889 2.492 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.642 -0.948 3.794 1.00 0.00 H new ATOM 0 HE2 PHE A 16 6.205 -2.635 2.177 1.00 0.00 H new ATOM 0 HZ PHE A 16 4.878 -0.661 2.815 1.00 0.00 H new ATOM 255 N LYS A 17 2.652 -5.907 0.406 1.00 0.00 N ATOM 256 CA LYS A 17 2.991 -5.431 -0.921 1.00 0.00 C ATOM 257 C LYS A 17 1.857 -5.773 -1.857 1.00 0.00 C ATOM 258 O LYS A 17 1.768 -5.269 -2.976 1.00 0.00 O ATOM 259 CB LYS A 17 4.320 -6.017 -1.399 1.00 0.00 C ATOM 260 CG LYS A 17 4.382 -7.535 -1.354 1.00 0.00 C ATOM 261 CD LYS A 17 5.706 -8.062 -1.888 1.00 0.00 C ATOM 262 CE LYS A 17 5.901 -7.708 -3.356 1.00 0.00 C ATOM 263 NZ LYS A 17 7.199 -8.215 -3.882 1.00 0.00 N ATOM 0 H LYS A 17 3.005 -6.838 0.627 1.00 0.00 H new ATOM 0 HA LYS A 17 3.125 -4.349 -0.901 1.00 0.00 H new ATOM 0 HB2 LYS A 17 4.503 -5.687 -2.422 1.00 0.00 H new ATOM 0 HB3 LYS A 17 5.125 -5.613 -0.785 1.00 0.00 H new ATOM 0 HG2 LYS A 17 4.243 -7.874 -0.328 1.00 0.00 H new ATOM 0 HG3 LYS A 17 3.562 -7.950 -1.941 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.526 -7.648 -1.302 1.00 0.00 H new ATOM 0 HD3 LYS A 17 5.743 -9.145 -1.767 1.00 0.00 H new ATOM 0 HE2 LYS A 17 5.083 -8.127 -3.942 1.00 0.00 H new ATOM 0 HE3 LYS A 17 5.858 -6.626 -3.477 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 7.293 -7.953 -4.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 7.981 -7.796 -3.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 7.230 -9.250 -3.790 1.00 0.00 H new ATOM 277 N MET A 18 0.967 -6.616 -1.350 1.00 0.00 N ATOM 278 CA MET A 18 -0.208 -7.022 -2.083 1.00 0.00 C ATOM 279 C MET A 18 -1.000 -5.769 -2.394 1.00 0.00 C ATOM 280 O MET A 18 -1.611 -5.633 -3.454 1.00 0.00 O ATOM 281 CB MET A 18 -1.031 -7.984 -1.232 1.00 0.00 C ATOM 282 CG MET A 18 -1.740 -9.077 -2.005 1.00 0.00 C ATOM 283 SD MET A 18 -0.654 -9.997 -3.119 1.00 0.00 S ATOM 284 CE MET A 18 -0.730 -9.001 -4.607 1.00 0.00 C ATOM 0 H MET A 18 1.046 -7.032 -0.422 1.00 0.00 H new ATOM 0 HA MET A 18 0.059 -7.535 -3.007 1.00 0.00 H new ATOM 0 HB2 MET A 18 -0.374 -8.448 -0.496 1.00 0.00 H new ATOM 0 HB3 MET A 18 -1.774 -7.411 -0.678 1.00 0.00 H new ATOM 0 HG2 MET A 18 -2.196 -9.772 -1.300 1.00 0.00 H new ATOM 0 HG3 MET A 18 -2.550 -8.634 -2.585 1.00 0.00 H new ATOM 0 HE1 MET A 18 -1.121 -9.602 -5.428 1.00 0.00 H new ATOM 0 HE2 MET A 18 -1.385 -8.146 -4.439 1.00 0.00 H new ATOM 0 HE3 MET A 18 0.270 -8.648 -4.860 1.00 0.00 H new ATOM 294 N ILE A 19 -0.938 -4.838 -1.447 1.00 0.00 N ATOM 295 CA ILE A 19 -1.595 -3.552 -1.576 1.00 0.00 C ATOM 296 C ILE A 19 -0.724 -2.637 -2.423 1.00 0.00 C ATOM 297 O ILE A 19 -1.112 -2.212 -3.512 1.00 0.00 O ATOM 298 CB ILE A 19 -1.821 -2.896 -0.201 1.00 0.00 C ATOM 299 CG1 ILE A 19 -2.570 -3.848 0.745 1.00 0.00 C ATOM 300 CG2 ILE A 19 -2.561 -1.579 -0.365 1.00 0.00 C ATOM 301 CD1 ILE A 19 -3.334 -3.150 1.857 1.00 0.00 C ATOM 0 H ILE A 19 -0.430 -4.959 -0.571 1.00 0.00 H new ATOM 0 HA ILE A 19 -2.566 -3.707 -2.045 1.00 0.00 H new ATOM 0 HB ILE A 19 -0.851 -2.687 0.250 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -3.268 -4.447 0.161 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -1.853 -4.538 1.190 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -2.715 -1.124 0.613 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -1.973 -0.906 -0.989 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -3.527 -1.761 -0.837 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.833 -3.894 2.478 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -2.640 -2.573 2.469 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.078 -2.481 1.423 1.00 0.00 H new ATOM 313 N ASP A 20 0.477 -2.367 -1.915 1.00 0.00 N ATOM 314 CA ASP A 20 1.446 -1.539 -2.611 1.00 0.00 C ATOM 315 C ASP A 20 2.218 -2.390 -3.611 1.00 0.00 C ATOM 316 O ASP A 20 3.415 -2.643 -3.474 1.00 0.00 O ATOM 317 CB ASP A 20 2.370 -0.869 -1.596 1.00 0.00 C ATOM 318 CG ASP A 20 3.744 -0.552 -2.145 1.00 0.00 C ATOM 319 OD1 ASP A 20 3.835 0.284 -3.066 1.00 0.00 O ATOM 320 OD2 ASP A 20 4.724 -1.156 -1.663 1.00 0.00 O ATOM 0 H ASP A 20 0.800 -2.717 -1.013 1.00 0.00 H new ATOM 0 HA ASP A 20 0.938 -0.751 -3.167 1.00 0.00 H new ATOM 0 HB2 ASP A 20 1.905 0.053 -1.248 1.00 0.00 H new ATOM 0 HB3 ASP A 20 2.476 -1.520 -0.728 1.00 0.00 H new ATOM 325 N THR A 21 1.497 -2.843 -4.612 1.00 0.00 N ATOM 326 CA THR A 21 2.065 -3.678 -5.655 1.00 0.00 C ATOM 327 C THR A 21 2.612 -2.834 -6.794 1.00 0.00 C ATOM 328 O THR A 21 3.421 -3.306 -7.592 1.00 0.00 O ATOM 329 CB THR A 21 1.011 -4.652 -6.186 1.00 0.00 C ATOM 330 OG1 THR A 21 1.544 -5.454 -7.225 1.00 0.00 O ATOM 331 CG2 THR A 21 -0.225 -3.962 -6.722 1.00 0.00 C ATOM 0 H THR A 21 0.503 -2.646 -4.729 1.00 0.00 H new ATOM 0 HA THR A 21 2.890 -4.244 -5.222 1.00 0.00 H new ATOM 0 HB THR A 21 0.723 -5.261 -5.329 1.00 0.00 H new ATOM 0 HG1 THR A 21 0.854 -6.070 -7.549 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.932 -4.710 -7.082 1.00 0.00 H new ATOM 0 HG22 THR A 21 -0.689 -3.378 -5.927 1.00 0.00 H new ATOM 0 HG23 THR A 21 0.054 -3.301 -7.543 1.00 0.00 H new ATOM 339 N ASP A 22 2.133 -1.596 -6.897 1.00 0.00 N ATOM 340 CA ASP A 22 2.553 -0.727 -7.985 1.00 0.00 C ATOM 341 C ASP A 22 2.812 0.723 -7.571 1.00 0.00 C ATOM 342 O ASP A 22 3.014 1.567 -8.444 1.00 0.00 O ATOM 343 CB ASP A 22 1.482 -0.744 -9.070 1.00 0.00 C ATOM 344 CG ASP A 22 0.125 -0.324 -8.536 1.00 0.00 C ATOM 345 OD1 ASP A 22 0.021 -0.044 -7.324 1.00 0.00 O ATOM 346 OD2 ASP A 22 -0.837 -0.280 -9.332 1.00 0.00 O ATOM 0 H ASP A 22 1.464 -1.180 -6.249 1.00 0.00 H new ATOM 0 HA ASP A 22 3.505 -1.120 -8.341 1.00 0.00 H new ATOM 0 HB2 ASP A 22 1.776 -0.076 -9.880 1.00 0.00 H new ATOM 0 HB3 ASP A 22 1.411 -1.746 -9.493 1.00 0.00 H new ATOM 351 N ASN A 23 2.820 1.047 -6.278 1.00 0.00 N ATOM 352 CA ASN A 23 3.070 2.429 -5.888 1.00 0.00 C ATOM 353 C ASN A 23 4.560 2.723 -5.852 1.00 0.00 C ATOM 354 O ASN A 23 5.111 3.273 -6.807 1.00 0.00 O ATOM 355 CB ASN A 23 2.432 2.778 -4.541 1.00 0.00 C ATOM 356 CG ASN A 23 2.811 4.166 -4.065 1.00 0.00 C ATOM 357 OD1 ASN A 23 3.463 4.237 -2.912 1.00 0.00 O flip ATOM 358 ND2 ASN A 23 2.522 5.163 -4.728 1.00 0.00 N flip ATOM 0 H ASN A 23 2.662 0.396 -5.509 1.00 0.00 H new ATOM 0 HA ASN A 23 2.602 3.057 -6.646 1.00 0.00 H new ATOM 0 HB2 ASN A 23 1.348 2.710 -4.627 1.00 0.00 H new ATOM 0 HB3 ASN A 23 2.739 2.045 -3.796 1.00 0.00 H new ATOM 0 HD21 ASN A 23 2.019 5.061 -5.610 1.00 0.00 H new ATOM 0 HD22 ASN A 23 2.785 6.091 -4.395 1.00 0.00 H new ATOM 365 N SER A 24 5.210 2.368 -4.748 1.00 0.00 N ATOM 366 CA SER A 24 6.645 2.619 -4.608 1.00 0.00 C ATOM 367 C SER A 24 7.201 2.049 -3.309 1.00 0.00 C ATOM 368 O SER A 24 8.298 2.415 -2.885 1.00 0.00 O ATOM 369 CB SER A 24 6.914 4.123 -4.658 1.00 0.00 C ATOM 370 OG SER A 24 6.168 4.801 -3.660 1.00 0.00 O ATOM 0 H SER A 24 4.776 1.912 -3.946 1.00 0.00 H new ATOM 0 HA SER A 24 7.147 2.118 -5.436 1.00 0.00 H new ATOM 0 HB2 SER A 24 7.978 4.312 -4.514 1.00 0.00 H new ATOM 0 HB3 SER A 24 6.651 4.512 -5.642 1.00 0.00 H new ATOM 0 HG SER A 24 5.305 4.354 -3.536 1.00 0.00 H new ATOM 376 N GLY A 25 6.442 1.171 -2.667 1.00 0.00 N ATOM 377 CA GLY A 25 6.883 0.596 -1.417 1.00 0.00 C ATOM 378 C GLY A 25 6.079 1.121 -0.247 1.00 0.00 C ATOM 379 O GLY A 25 6.508 1.027 0.904 1.00 0.00 O ATOM 0 H GLY A 25 5.530 0.849 -2.991 1.00 0.00 H new ATOM 0 HA2 GLY A 25 6.793 -0.489 -1.463 1.00 0.00 H new ATOM 0 HA3 GLY A 25 7.938 0.822 -1.264 1.00 0.00 H new ATOM 383 N THR A 26 4.906 1.683 -0.544 1.00 0.00 N ATOM 384 CA THR A 26 4.042 2.233 0.491 1.00 0.00 C ATOM 385 C THR A 26 2.569 2.114 0.119 1.00 0.00 C ATOM 386 O THR A 26 2.212 1.933 -1.053 1.00 0.00 O ATOM 387 CB THR A 26 4.383 3.697 0.756 1.00 0.00 C ATOM 388 OG1 THR A 26 4.360 4.446 -0.444 1.00 0.00 O ATOM 389 CG2 THR A 26 5.737 3.896 1.401 1.00 0.00 C ATOM 0 H THR A 26 4.537 1.767 -1.491 1.00 0.00 H new ATOM 0 HA THR A 26 4.215 1.650 1.396 1.00 0.00 H new ATOM 0 HB THR A 26 3.619 4.045 1.451 1.00 0.00 H new ATOM 0 HG1 THR A 26 3.948 3.912 -1.155 1.00 0.00 H new ATOM 0 HG21 THR A 26 5.912 4.960 1.559 1.00 0.00 H new ATOM 0 HG22 THR A 26 5.763 3.377 2.359 1.00 0.00 H new ATOM 0 HG23 THR A 26 6.513 3.494 0.750 1.00 0.00 H new ATOM 397 N ILE A 27 1.726 2.222 1.138 1.00 0.00 N ATOM 398 CA ILE A 27 0.287 2.129 0.963 1.00 0.00 C ATOM 399 C ILE A 27 -0.389 3.463 1.204 1.00 0.00 C ATOM 400 O ILE A 27 -0.581 3.871 2.338 1.00 0.00 O ATOM 401 CB ILE A 27 -0.302 1.117 1.945 1.00 0.00 C ATOM 402 CG1 ILE A 27 0.398 -0.231 1.778 1.00 0.00 C ATOM 403 CG2 ILE A 27 -1.803 0.995 1.739 1.00 0.00 C ATOM 404 CD1 ILE A 27 -0.380 -1.394 2.334 1.00 0.00 C ATOM 0 H ILE A 27 2.021 2.376 2.102 1.00 0.00 H new ATOM 0 HA ILE A 27 0.110 1.814 -0.065 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.136 1.462 2.966 1.00 0.00 H new ATOM 0 HG12 ILE A 27 0.584 -0.404 0.718 1.00 0.00 H new ATOM 0 HG13 ILE A 27 1.370 -0.188 2.269 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.209 0.271 2.445 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.273 1.965 1.903 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.005 0.662 0.721 1.00 0.00 H new ATOM 0 HD11 ILE A 27 0.181 -2.315 2.178 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.544 -1.245 3.401 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -1.342 -1.465 1.826 1.00 0.00 H new ATOM 416 N THR A 28 -0.786 4.129 0.143 1.00 0.00 N ATOM 417 CA THR A 28 -1.458 5.405 0.290 1.00 0.00 C ATOM 418 C THR A 28 -2.900 5.302 -0.152 1.00 0.00 C ATOM 419 O THR A 28 -3.254 4.392 -0.871 1.00 0.00 O ATOM 420 CB THR A 28 -0.737 6.479 -0.524 1.00 0.00 C ATOM 421 OG1 THR A 28 -0.762 6.162 -1.904 1.00 0.00 O ATOM 422 CG2 THR A 28 0.710 6.660 -0.121 1.00 0.00 C ATOM 0 H THR A 28 -0.659 3.816 -0.819 1.00 0.00 H new ATOM 0 HA THR A 28 -1.437 5.684 1.343 1.00 0.00 H new ATOM 0 HB THR A 28 -1.274 7.406 -0.322 1.00 0.00 H new ATOM 0 HG1 THR A 28 -0.297 6.862 -2.409 1.00 0.00 H new ATOM 0 HG21 THR A 28 1.165 7.436 -0.736 1.00 0.00 H new ATOM 0 HG22 THR A 28 0.762 6.952 0.928 1.00 0.00 H new ATOM 0 HG23 THR A 28 1.247 5.723 -0.264 1.00 0.00 H new ATOM 430 N PHE A 29 -3.731 6.216 0.325 1.00 0.00 N ATOM 431 CA PHE A 29 -5.169 6.241 0.013 1.00 0.00 C ATOM 432 C PHE A 29 -5.477 5.763 -1.420 1.00 0.00 C ATOM 433 O PHE A 29 -6.598 5.350 -1.720 1.00 0.00 O ATOM 434 CB PHE A 29 -5.661 7.677 0.170 1.00 0.00 C ATOM 435 CG PHE A 29 -7.138 7.806 0.370 1.00 0.00 C ATOM 436 CD1 PHE A 29 -8.001 7.816 -0.712 1.00 0.00 C ATOM 437 CD2 PHE A 29 -7.662 7.926 1.644 1.00 0.00 C ATOM 438 CE1 PHE A 29 -9.363 7.942 -0.525 1.00 0.00 C ATOM 439 CE2 PHE A 29 -9.020 8.056 1.838 1.00 0.00 C ATOM 440 CZ PHE A 29 -9.874 8.065 0.756 1.00 0.00 C ATOM 0 H PHE A 29 -3.434 6.970 0.944 1.00 0.00 H new ATOM 0 HA PHE A 29 -5.675 5.559 0.696 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -5.151 8.132 1.019 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -5.376 8.245 -0.716 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -7.605 7.724 -1.713 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.999 7.918 2.497 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -10.028 7.945 -1.376 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -9.416 8.151 2.838 1.00 0.00 H new ATOM 0 HZ PHE A 29 -10.938 8.168 0.907 1.00 0.00 H new ATOM 450 N ASP A 30 -4.468 5.797 -2.280 1.00 0.00 N ATOM 451 CA ASP A 30 -4.600 5.344 -3.666 1.00 0.00 C ATOM 452 C ASP A 30 -4.360 3.830 -3.778 1.00 0.00 C ATOM 453 O ASP A 30 -5.068 3.134 -4.503 1.00 0.00 O ATOM 454 CB ASP A 30 -3.619 6.094 -4.568 1.00 0.00 C ATOM 455 CG ASP A 30 -3.705 5.647 -6.013 1.00 0.00 C ATOM 456 OD1 ASP A 30 -4.798 5.762 -6.607 1.00 0.00 O ATOM 457 OD2 ASP A 30 -2.678 5.182 -6.553 1.00 0.00 O ATOM 0 H ASP A 30 -3.536 6.137 -2.042 1.00 0.00 H new ATOM 0 HA ASP A 30 -5.618 5.556 -3.992 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -3.820 7.164 -4.509 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -2.604 5.940 -4.203 1.00 0.00 H new ATOM 462 N GLU A 31 -3.387 3.326 -3.016 1.00 0.00 N ATOM 463 CA GLU A 31 -3.078 1.901 -2.975 1.00 0.00 C ATOM 464 C GLU A 31 -3.860 1.177 -1.883 1.00 0.00 C ATOM 465 O GLU A 31 -4.197 0.005 -2.031 1.00 0.00 O ATOM 466 CB GLU A 31 -1.592 1.686 -2.789 1.00 0.00 C ATOM 467 CG GLU A 31 -0.983 0.954 -3.966 1.00 0.00 C ATOM 468 CD GLU A 31 -1.088 1.727 -5.268 1.00 0.00 C ATOM 469 OE1 GLU A 31 -2.223 1.989 -5.719 1.00 0.00 O ATOM 470 OE2 GLU A 31 -0.033 2.063 -5.839 1.00 0.00 O ATOM 0 H GLU A 31 -2.794 3.895 -2.412 1.00 0.00 H new ATOM 0 HA GLU A 31 -3.382 1.476 -3.931 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.097 2.649 -2.663 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.418 1.117 -1.876 1.00 0.00 H new ATOM 0 HG2 GLU A 31 0.067 0.750 -3.755 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -1.478 -0.010 -4.082 1.00 0.00 H new ATOM 477 N LEU A 32 -4.133 1.886 -0.787 1.00 0.00 N ATOM 478 CA LEU A 32 -4.854 1.330 0.350 1.00 0.00 C ATOM 479 C LEU A 32 -5.994 0.451 -0.128 1.00 0.00 C ATOM 480 O LEU A 32 -6.135 -0.700 0.288 1.00 0.00 O ATOM 481 CB LEU A 32 -5.397 2.460 1.226 1.00 0.00 C ATOM 482 CG LEU A 32 -5.820 2.062 2.652 1.00 0.00 C ATOM 483 CD1 LEU A 32 -7.020 1.125 2.632 1.00 0.00 C ATOM 484 CD2 LEU A 32 -4.661 1.423 3.398 1.00 0.00 C ATOM 0 H LEU A 32 -3.859 2.861 -0.666 1.00 0.00 H new ATOM 0 HA LEU A 32 -4.166 0.722 0.938 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -4.635 3.236 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -6.257 2.902 0.723 1.00 0.00 H new ATOM 0 HG LEU A 32 -6.112 2.972 3.177 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.294 0.863 3.654 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -7.861 1.621 2.147 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -6.766 0.220 2.081 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -4.982 1.150 4.403 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.334 0.530 2.866 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -3.834 2.131 3.461 1.00 0.00 H new ATOM 496 N LYS A 33 -6.797 1.014 -1.011 1.00 0.00 N ATOM 497 CA LYS A 33 -7.936 0.301 -1.575 1.00 0.00 C ATOM 498 C LYS A 33 -7.485 -0.784 -2.538 1.00 0.00 C ATOM 499 O LYS A 33 -8.060 -1.871 -2.570 1.00 0.00 O ATOM 500 CB LYS A 33 -8.869 1.270 -2.297 1.00 0.00 C ATOM 501 CG LYS A 33 -8.145 2.265 -3.191 1.00 0.00 C ATOM 502 CD LYS A 33 -9.114 3.158 -3.951 1.00 0.00 C ATOM 503 CE LYS A 33 -10.228 3.672 -3.055 1.00 0.00 C ATOM 504 NZ LYS A 33 -11.063 4.697 -3.738 1.00 0.00 N ATOM 0 H LYS A 33 -6.684 1.967 -1.357 1.00 0.00 H new ATOM 0 HA LYS A 33 -8.472 -0.169 -0.750 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -9.575 0.699 -2.901 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -9.453 1.818 -1.557 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -7.483 2.882 -2.584 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -7.517 1.725 -3.900 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -8.572 4.002 -4.378 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -9.545 2.602 -4.784 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -10.858 2.838 -2.745 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -9.797 4.100 -2.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.052 4.601 -3.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -10.715 5.646 -3.495 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -11.007 4.560 -4.767 1.00 0.00 H new ATOM 518 N ASP A 34 -6.458 -0.478 -3.326 1.00 0.00 N ATOM 519 CA ASP A 34 -5.928 -1.421 -4.304 1.00 0.00 C ATOM 520 C ASP A 34 -5.801 -2.821 -3.709 1.00 0.00 C ATOM 521 O ASP A 34 -6.218 -3.800 -4.318 1.00 0.00 O ATOM 522 CB ASP A 34 -4.569 -0.940 -4.820 1.00 0.00 C ATOM 523 CG ASP A 34 -3.997 -1.846 -5.893 1.00 0.00 C ATOM 524 OD1 ASP A 34 -3.730 -3.027 -5.591 1.00 0.00 O ATOM 525 OD2 ASP A 34 -3.817 -1.375 -7.035 1.00 0.00 O ATOM 0 H ASP A 34 -5.975 0.420 -3.305 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.628 -1.471 -5.138 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -4.673 0.069 -5.219 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -3.868 -0.883 -3.987 1.00 0.00 H new ATOM 530 N GLY A 35 -5.218 -2.900 -2.521 1.00 0.00 N ATOM 531 CA GLY A 35 -5.028 -4.177 -1.853 1.00 0.00 C ATOM 532 C GLY A 35 -6.243 -5.093 -1.875 1.00 0.00 C ATOM 533 O GLY A 35 -6.111 -6.282 -2.163 1.00 0.00 O ATOM 0 H GLY A 35 -4.869 -2.095 -2.001 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -4.191 -4.695 -2.321 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -4.749 -3.991 -0.816 1.00 0.00 H new ATOM 537 N LEU A 36 -7.421 -4.563 -1.551 1.00 0.00 N ATOM 538 CA LEU A 36 -8.630 -5.388 -1.523 1.00 0.00 C ATOM 539 C LEU A 36 -9.411 -5.310 -2.829 1.00 0.00 C ATOM 540 O LEU A 36 -9.867 -6.327 -3.344 1.00 0.00 O ATOM 541 CB LEU A 36 -9.537 -5.004 -0.360 1.00 0.00 C ATOM 542 CG LEU A 36 -8.897 -5.052 1.031 1.00 0.00 C ATOM 543 CD1 LEU A 36 -8.158 -6.364 1.236 1.00 0.00 C ATOM 544 CD2 LEU A 36 -7.965 -3.867 1.243 1.00 0.00 C ATOM 0 H LEU A 36 -7.565 -3.583 -1.308 1.00 0.00 H new ATOM 0 HA LEU A 36 -8.295 -6.417 -1.389 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -9.909 -3.994 -0.533 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -10.402 -5.668 -0.364 1.00 0.00 H new ATOM 0 HG LEU A 36 -9.693 -4.989 1.773 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -7.711 -6.378 2.230 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -8.858 -7.194 1.141 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -7.375 -6.462 0.484 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -7.524 -3.925 2.238 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -7.174 -3.888 0.493 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -8.529 -2.939 1.150 1.00 0.00 H new ATOM 556 N LYS A 37 -9.575 -4.112 -3.374 1.00 0.00 N ATOM 557 CA LYS A 37 -10.307 -3.971 -4.622 1.00 0.00 C ATOM 558 C LYS A 37 -9.658 -4.854 -5.690 1.00 0.00 C ATOM 559 O LYS A 37 -10.276 -5.193 -6.699 1.00 0.00 O ATOM 560 CB LYS A 37 -10.357 -2.507 -5.065 1.00 0.00 C ATOM 561 CG LYS A 37 -9.010 -1.915 -5.448 1.00 0.00 C ATOM 562 CD LYS A 37 -9.169 -0.594 -6.193 1.00 0.00 C ATOM 563 CE LYS A 37 -10.155 0.338 -5.502 1.00 0.00 C ATOM 564 NZ LYS A 37 -10.382 1.582 -6.290 1.00 0.00 N ATOM 0 H LYS A 37 -9.219 -3.241 -2.980 1.00 0.00 H new ATOM 0 HA LYS A 37 -11.337 -4.296 -4.474 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.032 -2.422 -5.917 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -10.785 -1.911 -4.258 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.413 -1.757 -4.550 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -8.465 -2.623 -6.073 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.199 -0.103 -6.270 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -9.508 -0.790 -7.210 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -11.104 -0.179 -5.357 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -9.778 0.598 -4.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -11.005 2.222 -5.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -9.471 2.053 -6.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.828 1.341 -7.198 1.00 0.00 H new ATOM 578 N ARG A 38 -8.405 -5.240 -5.431 1.00 0.00 N ATOM 579 CA ARG A 38 -7.649 -6.108 -6.329 1.00 0.00 C ATOM 580 C ARG A 38 -7.841 -7.577 -5.968 1.00 0.00 C ATOM 581 O ARG A 38 -7.672 -8.456 -6.814 1.00 0.00 O ATOM 582 CB ARG A 38 -6.155 -5.773 -6.262 1.00 0.00 C ATOM 583 CG ARG A 38 -5.260 -6.816 -6.918 1.00 0.00 C ATOM 584 CD ARG A 38 -3.791 -6.600 -6.573 1.00 0.00 C ATOM 585 NE ARG A 38 -3.318 -5.278 -6.977 1.00 0.00 N ATOM 586 CZ ARG A 38 -3.313 -4.842 -8.235 1.00 0.00 C ATOM 587 NH1 ARG A 38 -3.736 -5.627 -9.218 1.00 0.00 N ATOM 588 NH2 ARG A 38 -2.881 -3.618 -8.512 1.00 0.00 N ATOM 0 H ARG A 38 -7.891 -4.959 -4.596 1.00 0.00 H new ATOM 0 HA ARG A 38 -8.022 -5.939 -7.339 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -5.987 -4.809 -6.743 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -5.864 -5.663 -5.217 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -5.566 -7.811 -6.596 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -5.389 -6.777 -8.000 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -3.650 -6.722 -5.499 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -3.188 -7.365 -7.063 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.971 -4.651 -6.251 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -4.067 -6.569 -9.012 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -3.730 -5.288 -10.180 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -2.553 -3.011 -7.761 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -2.877 -3.284 -9.476 1.00 0.00 H new ATOM 602 N VAL A 39 -8.172 -7.849 -4.708 1.00 0.00 N ATOM 603 CA VAL A 39 -8.350 -9.217 -4.249 1.00 0.00 C ATOM 604 C VAL A 39 -9.725 -9.766 -4.627 1.00 0.00 C ATOM 605 O VAL A 39 -9.859 -10.941 -4.970 1.00 0.00 O ATOM 606 CB VAL A 39 -8.150 -9.300 -2.716 1.00 0.00 C ATOM 607 CG1 VAL A 39 -9.336 -8.727 -1.960 1.00 0.00 C ATOM 608 CG2 VAL A 39 -7.887 -10.719 -2.278 1.00 0.00 C ATOM 0 H VAL A 39 -8.321 -7.139 -3.991 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.597 -9.830 -4.745 1.00 0.00 H new ATOM 0 HB VAL A 39 -7.276 -8.694 -2.476 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -9.156 -8.804 -0.888 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -9.469 -7.680 -2.231 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -10.236 -9.285 -2.218 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.750 -10.747 -1.197 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -8.734 -11.348 -2.553 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -6.986 -11.090 -2.767 1.00 0.00 H new ATOM 618 N GLY A 40 -10.746 -8.914 -4.563 1.00 0.00 N ATOM 619 CA GLY A 40 -12.089 -9.344 -4.903 1.00 0.00 C ATOM 620 C GLY A 40 -13.154 -8.509 -4.221 1.00 0.00 C ATOM 621 O GLY A 40 -14.153 -8.138 -4.840 1.00 0.00 O ATOM 0 H GLY A 40 -10.666 -7.937 -4.282 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -12.223 -9.287 -5.983 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -12.215 -10.389 -4.621 1.00 0.00 H new ATOM 625 N SER A 41 -12.943 -8.210 -2.942 1.00 0.00 N ATOM 626 CA SER A 41 -13.883 -7.417 -2.175 1.00 0.00 C ATOM 627 C SER A 41 -14.015 -6.013 -2.757 1.00 0.00 C ATOM 628 O SER A 41 -13.330 -5.662 -3.719 1.00 0.00 O ATOM 629 CB SER A 41 -13.421 -7.340 -0.723 1.00 0.00 C ATOM 630 OG SER A 41 -13.350 -8.630 -0.138 1.00 0.00 O ATOM 0 H SER A 41 -12.122 -8.510 -2.417 1.00 0.00 H new ATOM 0 HA SER A 41 -14.861 -7.896 -2.221 1.00 0.00 H new ATOM 0 HB2 SER A 41 -12.443 -6.862 -0.675 1.00 0.00 H new ATOM 0 HB3 SER A 41 -14.109 -6.716 -0.152 1.00 0.00 H new ATOM 0 HG SER A 41 -13.050 -8.552 0.792 1.00 0.00 H new ATOM 636 N GLU A 42 -14.895 -5.215 -2.167 1.00 0.00 N ATOM 637 CA GLU A 42 -15.115 -3.849 -2.626 1.00 0.00 C ATOM 638 C GLU A 42 -15.302 -2.904 -1.446 1.00 0.00 C ATOM 639 O GLU A 42 -16.300 -2.978 -0.728 1.00 0.00 O ATOM 640 CB GLU A 42 -16.338 -3.788 -3.542 1.00 0.00 C ATOM 641 CG GLU A 42 -16.199 -4.619 -4.808 1.00 0.00 C ATOM 642 CD GLU A 42 -17.439 -4.567 -5.679 1.00 0.00 C ATOM 643 OE1 GLU A 42 -18.409 -3.880 -5.292 1.00 0.00 O ATOM 644 OE2 GLU A 42 -17.442 -5.211 -6.749 1.00 0.00 O ATOM 0 H GLU A 42 -15.468 -5.490 -1.369 1.00 0.00 H new ATOM 0 HA GLU A 42 -14.235 -3.533 -3.186 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -17.212 -4.130 -2.988 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -16.522 -2.750 -3.818 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -15.343 -4.262 -5.380 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -15.993 -5.655 -4.538 1.00 0.00 H new ATOM 651 N LEU A 43 -14.334 -2.015 -1.252 1.00 0.00 N ATOM 652 CA LEU A 43 -14.383 -1.049 -0.160 1.00 0.00 C ATOM 653 C LEU A 43 -14.659 0.350 -0.697 1.00 0.00 C ATOM 654 O LEU A 43 -14.529 0.597 -1.896 1.00 0.00 O ATOM 655 CB LEU A 43 -13.061 -1.058 0.611 1.00 0.00 C ATOM 656 CG LEU A 43 -12.584 -2.437 1.076 1.00 0.00 C ATOM 657 CD1 LEU A 43 -11.224 -2.331 1.748 1.00 0.00 C ATOM 658 CD2 LEU A 43 -13.594 -3.069 2.024 1.00 0.00 C ATOM 0 H LEU A 43 -13.503 -1.943 -1.839 1.00 0.00 H new ATOM 0 HA LEU A 43 -15.192 -1.331 0.514 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -12.288 -0.618 -0.020 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -13.164 -0.414 1.484 1.00 0.00 H new ATOM 0 HG LEU A 43 -12.491 -3.077 0.199 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -10.900 -3.320 2.072 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -10.500 -1.926 1.042 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -11.296 -1.671 2.613 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -13.233 -4.048 2.341 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -13.723 -2.430 2.897 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -14.550 -3.183 1.514 1.00 0.00 H new ATOM 670 N MET A 44 -15.023 1.268 0.192 1.00 0.00 N ATOM 671 CA MET A 44 -15.295 2.644 -0.200 1.00 0.00 C ATOM 672 C MET A 44 -14.230 3.567 0.378 1.00 0.00 C ATOM 673 O MET A 44 -13.506 3.187 1.297 1.00 0.00 O ATOM 674 CB MET A 44 -16.688 3.078 0.266 1.00 0.00 C ATOM 675 CG MET A 44 -16.874 3.032 1.773 1.00 0.00 C ATOM 676 SD MET A 44 -18.519 3.563 2.285 1.00 0.00 S ATOM 677 CE MET A 44 -18.402 3.362 4.061 1.00 0.00 C ATOM 0 H MET A 44 -15.136 1.083 1.189 1.00 0.00 H new ATOM 0 HA MET A 44 -15.268 2.707 -1.288 1.00 0.00 H new ATOM 0 HB2 MET A 44 -16.877 4.093 -0.083 1.00 0.00 H new ATOM 0 HB3 MET A 44 -17.434 2.436 -0.202 1.00 0.00 H new ATOM 0 HG2 MET A 44 -16.698 2.016 2.126 1.00 0.00 H new ATOM 0 HG3 MET A 44 -16.127 3.668 2.247 1.00 0.00 H new ATOM 0 HE1 MET A 44 -19.124 4.016 4.550 1.00 0.00 H new ATOM 0 HE2 MET A 44 -18.614 2.326 4.325 1.00 0.00 H new ATOM 0 HE3 MET A 44 -17.396 3.622 4.391 1.00 0.00 H new ATOM 687 N GLU A 45 -14.122 4.766 -0.174 1.00 0.00 N ATOM 688 CA GLU A 45 -13.123 5.728 0.276 1.00 0.00 C ATOM 689 C GLU A 45 -13.283 6.120 1.741 1.00 0.00 C ATOM 690 O GLU A 45 -12.363 6.691 2.328 1.00 0.00 O ATOM 691 CB GLU A 45 -13.134 6.960 -0.607 1.00 0.00 C ATOM 692 CG GLU A 45 -12.580 6.701 -1.995 1.00 0.00 C ATOM 693 CD GLU A 45 -12.437 7.970 -2.813 1.00 0.00 C ATOM 694 OE1 GLU A 45 -13.462 8.645 -3.046 1.00 0.00 O ATOM 695 OE2 GLU A 45 -11.300 8.290 -3.218 1.00 0.00 O ATOM 0 H GLU A 45 -14.714 5.098 -0.935 1.00 0.00 H new ATOM 0 HA GLU A 45 -12.157 5.231 0.192 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -14.156 7.329 -0.693 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -12.550 7.747 -0.130 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -11.607 6.217 -1.909 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -13.236 6.007 -2.520 1.00 0.00 H new ATOM 702 N SER A 46 -14.424 5.806 2.349 1.00 0.00 N ATOM 703 CA SER A 46 -14.641 6.126 3.756 1.00 0.00 C ATOM 704 C SER A 46 -14.116 4.994 4.634 1.00 0.00 C ATOM 705 O SER A 46 -13.887 5.169 5.831 1.00 0.00 O ATOM 706 CB SER A 46 -16.129 6.358 4.028 1.00 0.00 C ATOM 707 OG SER A 46 -16.356 6.668 5.392 1.00 0.00 O ATOM 0 H SER A 46 -15.206 5.335 1.894 1.00 0.00 H new ATOM 0 HA SER A 46 -14.099 7.041 3.995 1.00 0.00 H new ATOM 0 HB2 SER A 46 -16.494 7.172 3.401 1.00 0.00 H new ATOM 0 HB3 SER A 46 -16.695 5.467 3.755 1.00 0.00 H new ATOM 0 HG SER A 46 -17.314 6.813 5.539 1.00 0.00 H new ATOM 713 N GLU A 47 -13.912 3.838 4.009 1.00 0.00 N ATOM 714 CA GLU A 47 -13.392 2.656 4.693 1.00 0.00 C ATOM 715 C GLU A 47 -11.874 2.636 4.604 1.00 0.00 C ATOM 716 O GLU A 47 -11.183 2.428 5.600 1.00 0.00 O ATOM 717 CB GLU A 47 -13.975 1.379 4.087 1.00 0.00 C ATOM 718 CG GLU A 47 -15.474 1.239 4.293 1.00 0.00 C ATOM 719 CD GLU A 47 -16.043 -0.010 3.648 1.00 0.00 C ATOM 720 OE1 GLU A 47 -15.262 -0.773 3.042 1.00 0.00 O ATOM 721 OE2 GLU A 47 -17.269 -0.225 3.748 1.00 0.00 O ATOM 0 H GLU A 47 -14.101 3.693 3.017 1.00 0.00 H new ATOM 0 HA GLU A 47 -13.688 2.701 5.741 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -13.760 1.363 3.019 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -13.474 0.516 4.526 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -15.689 1.220 5.361 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -15.976 2.115 3.882 1.00 0.00 H new ATOM 728 N ILE A 48 -11.362 2.888 3.402 1.00 0.00 N ATOM 729 CA ILE A 48 -9.926 2.946 3.173 1.00 0.00 C ATOM 730 C ILE A 48 -9.300 3.870 4.192 1.00 0.00 C ATOM 731 O ILE A 48 -8.340 3.531 4.885 1.00 0.00 O ATOM 732 CB ILE A 48 -9.637 3.478 1.756 1.00 0.00 C ATOM 733 CG1 ILE A 48 -9.712 2.339 0.755 1.00 0.00 C ATOM 734 CG2 ILE A 48 -8.283 4.169 1.683 1.00 0.00 C ATOM 735 CD1 ILE A 48 -11.088 1.724 0.618 1.00 0.00 C ATOM 0 H ILE A 48 -11.926 3.056 2.569 1.00 0.00 H new ATOM 0 HA ILE A 48 -9.506 1.945 3.269 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.394 4.222 1.510 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -9.391 2.705 -0.220 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -9.007 1.562 1.051 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -8.114 4.531 0.669 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -8.266 5.010 2.376 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -7.498 3.461 1.951 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -11.055 0.919 -0.116 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.406 1.325 1.581 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.796 2.485 0.290 1.00 0.00 H new ATOM 747 N LYS A 49 -9.894 5.038 4.270 1.00 0.00 N ATOM 748 CA LYS A 49 -9.489 6.077 5.185 1.00 0.00 C ATOM 749 C LYS A 49 -9.689 5.624 6.623 1.00 0.00 C ATOM 750 O LYS A 49 -8.960 6.029 7.530 1.00 0.00 O ATOM 751 CB LYS A 49 -10.345 7.295 4.884 1.00 0.00 C ATOM 752 CG LYS A 49 -10.247 8.419 5.882 1.00 0.00 C ATOM 753 CD LYS A 49 -11.127 9.565 5.435 1.00 0.00 C ATOM 754 CE LYS A 49 -11.101 10.711 6.422 1.00 0.00 C ATOM 755 NZ LYS A 49 -9.710 11.100 6.779 1.00 0.00 N ATOM 0 H LYS A 49 -10.689 5.297 3.686 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.432 6.311 5.063 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.068 7.679 3.902 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.386 6.979 4.820 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -10.555 8.072 6.868 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -9.213 8.753 5.970 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -10.795 9.919 4.459 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -12.151 9.212 5.315 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -11.621 11.569 5.996 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -11.642 10.426 7.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.692 11.475 7.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -9.090 10.267 6.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.374 11.830 6.119 1.00 0.00 H new ATOM 769 N ASP A 50 -10.686 4.770 6.815 1.00 0.00 N ATOM 770 CA ASP A 50 -11.002 4.251 8.139 1.00 0.00 C ATOM 771 C ASP A 50 -9.853 3.410 8.676 1.00 0.00 C ATOM 772 O ASP A 50 -9.414 3.596 9.807 1.00 0.00 O ATOM 773 CB ASP A 50 -12.291 3.426 8.091 1.00 0.00 C ATOM 774 CG ASP A 50 -12.744 2.963 9.463 1.00 0.00 C ATOM 775 OD1 ASP A 50 -12.077 3.307 10.461 1.00 0.00 O ATOM 776 OD2 ASP A 50 -13.771 2.256 9.539 1.00 0.00 O ATOM 0 H ASP A 50 -11.290 4.422 6.070 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.151 5.095 8.813 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.081 4.022 7.634 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -12.137 2.557 7.452 1.00 0.00 H new ATOM 781 N LEU A 51 -9.362 2.491 7.855 1.00 0.00 N ATOM 782 CA LEU A 51 -8.265 1.631 8.240 1.00 0.00 C ATOM 783 C LEU A 51 -7.014 2.435 8.571 1.00 0.00 C ATOM 784 O LEU A 51 -6.077 1.911 9.173 1.00 0.00 O ATOM 785 CB LEU A 51 -7.970 0.652 7.108 1.00 0.00 C ATOM 786 CG LEU A 51 -8.891 -0.565 7.039 1.00 0.00 C ATOM 787 CD1 LEU A 51 -8.589 -1.393 5.798 1.00 0.00 C ATOM 788 CD2 LEU A 51 -8.738 -1.412 8.294 1.00 0.00 C ATOM 0 H LEU A 51 -9.714 2.326 6.912 1.00 0.00 H new ATOM 0 HA LEU A 51 -8.556 1.085 9.138 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -8.032 1.188 6.161 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -6.942 0.304 7.210 1.00 0.00 H new ATOM 0 HG LEU A 51 -9.922 -0.217 6.977 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -9.254 -2.256 5.765 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -8.742 -0.783 4.908 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.554 -1.734 5.831 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -9.400 -2.276 8.233 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -7.706 -1.751 8.381 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -8.999 -0.817 9.169 1.00 0.00 H new ATOM 800 N MET A 52 -6.988 3.702 8.165 1.00 0.00 N ATOM 801 CA MET A 52 -5.833 4.543 8.418 1.00 0.00 C ATOM 802 C MET A 52 -5.911 5.247 9.767 1.00 0.00 C ATOM 803 O MET A 52 -5.100 4.999 10.657 1.00 0.00 O ATOM 804 CB MET A 52 -5.672 5.559 7.295 1.00 0.00 C ATOM 805 CG MET A 52 -5.370 4.910 5.960 1.00 0.00 C ATOM 806 SD MET A 52 -4.682 6.053 4.752 1.00 0.00 S ATOM 807 CE MET A 52 -4.051 4.889 3.547 1.00 0.00 C ATOM 0 H MET A 52 -7.749 4.161 7.664 1.00 0.00 H new ATOM 0 HA MET A 52 -4.958 3.894 8.449 1.00 0.00 H new ATOM 0 HB2 MET A 52 -6.585 6.148 7.210 1.00 0.00 H new ATOM 0 HB3 MET A 52 -4.869 6.251 7.548 1.00 0.00 H new ATOM 0 HG2 MET A 52 -4.669 4.089 6.113 1.00 0.00 H new ATOM 0 HG3 MET A 52 -6.286 4.477 5.559 1.00 0.00 H new ATOM 0 HE1 MET A 52 -3.151 5.295 3.086 1.00 0.00 H new ATOM 0 HE2 MET A 52 -3.812 3.947 4.041 1.00 0.00 H new ATOM 0 HE3 MET A 52 -4.805 4.715 2.780 1.00 0.00 H new ATOM 817 N ASP A 53 -6.878 6.132 9.919 1.00 0.00 N ATOM 818 CA ASP A 53 -7.029 6.871 11.160 1.00 0.00 C ATOM 819 C ASP A 53 -7.425 5.957 12.312 1.00 0.00 C ATOM 820 O ASP A 53 -7.165 6.265 13.476 1.00 0.00 O ATOM 821 CB ASP A 53 -8.070 7.971 10.980 1.00 0.00 C ATOM 822 CG ASP A 53 -9.404 7.433 10.499 1.00 0.00 C ATOM 823 OD1 ASP A 53 -10.017 6.622 11.226 1.00 0.00 O ATOM 824 OD2 ASP A 53 -9.838 7.822 9.395 1.00 0.00 O ATOM 0 H ASP A 53 -7.568 6.357 9.203 1.00 0.00 H new ATOM 0 HA ASP A 53 -6.066 7.316 11.408 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -8.212 8.492 11.927 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -7.699 8.705 10.265 1.00 0.00 H new ATOM 829 N ALA A 54 -8.064 4.842 11.988 1.00 0.00 N ATOM 830 CA ALA A 54 -8.502 3.903 13.010 1.00 0.00 C ATOM 831 C ALA A 54 -7.453 2.828 13.299 1.00 0.00 C ATOM 832 O ALA A 54 -7.407 2.291 14.406 1.00 0.00 O ATOM 833 CB ALA A 54 -9.819 3.257 12.613 1.00 0.00 C ATOM 0 H ALA A 54 -8.289 4.567 11.032 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.644 4.475 13.927 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -10.130 2.558 13.390 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -10.580 4.028 12.492 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -9.692 2.721 11.672 1.00 0.00 H new ATOM 839 N ALA A 55 -6.623 2.492 12.307 1.00 0.00 N ATOM 840 CA ALA A 55 -5.610 1.453 12.503 1.00 0.00 C ATOM 841 C ALA A 55 -4.194 1.917 12.174 1.00 0.00 C ATOM 842 O ALA A 55 -3.263 1.617 12.923 1.00 0.00 O ATOM 843 CB ALA A 55 -5.952 0.222 11.679 1.00 0.00 C ATOM 0 H ALA A 55 -6.631 2.915 11.379 1.00 0.00 H new ATOM 0 HA ALA A 55 -5.623 1.210 13.565 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -5.191 -0.543 11.834 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.923 -0.165 11.988 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.988 0.489 10.623 1.00 0.00 H new ATOM 849 N ASP A 56 -4.018 2.630 11.063 1.00 0.00 N ATOM 850 CA ASP A 56 -2.690 3.099 10.678 1.00 0.00 C ATOM 851 C ASP A 56 -2.025 3.822 11.848 1.00 0.00 C ATOM 852 O ASP A 56 -2.351 4.969 12.153 1.00 0.00 O ATOM 853 CB ASP A 56 -2.771 4.010 9.451 1.00 0.00 C ATOM 854 CG ASP A 56 -1.404 4.401 8.925 1.00 0.00 C ATOM 855 OD1 ASP A 56 -0.396 3.959 9.511 1.00 0.00 O ATOM 856 OD2 ASP A 56 -1.345 5.148 7.926 1.00 0.00 O ATOM 0 H ASP A 56 -4.767 2.892 10.422 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.080 2.235 10.415 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -3.328 3.504 8.663 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -3.329 4.911 9.708 1.00 0.00 H new ATOM 861 N ILE A 57 -1.112 3.115 12.511 1.00 0.00 N ATOM 862 CA ILE A 57 -0.393 3.636 13.675 1.00 0.00 C ATOM 863 C ILE A 57 0.108 5.064 13.467 1.00 0.00 C ATOM 864 O ILE A 57 0.293 5.808 14.430 1.00 0.00 O ATOM 865 CB ILE A 57 0.814 2.737 14.014 1.00 0.00 C ATOM 866 CG1 ILE A 57 0.379 1.273 14.132 1.00 0.00 C ATOM 867 CG2 ILE A 57 1.485 3.200 15.300 1.00 0.00 C ATOM 868 CD1 ILE A 57 -0.645 1.020 15.221 1.00 0.00 C ATOM 0 H ILE A 57 -0.848 2.163 12.257 1.00 0.00 H new ATOM 0 HA ILE A 57 -1.109 3.640 14.497 1.00 0.00 H new ATOM 0 HB ILE A 57 1.537 2.817 13.203 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.034 0.949 13.177 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.258 0.658 14.324 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.334 2.553 15.521 1.00 0.00 H new ATOM 0 HG22 ILE A 57 1.833 4.226 15.180 1.00 0.00 H new ATOM 0 HG23 ILE A 57 0.770 3.153 16.121 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.901 -0.039 15.240 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.229 1.311 16.186 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.542 1.607 15.021 1.00 0.00 H new ATOM 880 N ASP A 58 0.342 5.437 12.216 1.00 0.00 N ATOM 881 CA ASP A 58 0.844 6.778 11.908 1.00 0.00 C ATOM 882 C ASP A 58 0.063 7.414 10.765 1.00 0.00 C ATOM 883 O ASP A 58 0.656 7.953 9.832 1.00 0.00 O ATOM 884 CB ASP A 58 2.334 6.724 11.560 1.00 0.00 C ATOM 885 CG ASP A 58 2.946 8.105 11.415 1.00 0.00 C ATOM 886 OD1 ASP A 58 2.908 8.878 12.396 1.00 0.00 O ATOM 887 OD2 ASP A 58 3.465 8.412 10.321 1.00 0.00 O ATOM 0 H ASP A 58 0.195 4.840 11.402 1.00 0.00 H new ATOM 0 HA ASP A 58 0.708 7.395 12.796 1.00 0.00 H new ATOM 0 HB2 ASP A 58 2.866 6.174 12.336 1.00 0.00 H new ATOM 0 HB3 ASP A 58 2.467 6.171 10.630 1.00 0.00 H new ATOM 892 N LYS A 59 -1.265 7.293 10.819 1.00 0.00 N ATOM 893 CA LYS A 59 -2.144 7.797 9.773 1.00 0.00 C ATOM 894 C LYS A 59 -1.596 9.049 9.099 1.00 0.00 C ATOM 895 O LYS A 59 -1.849 10.179 9.519 1.00 0.00 O ATOM 896 CB LYS A 59 -3.535 8.078 10.343 1.00 0.00 C ATOM 897 CG LYS A 59 -4.635 8.214 9.291 1.00 0.00 C ATOM 898 CD LYS A 59 -4.475 9.451 8.421 1.00 0.00 C ATOM 899 CE LYS A 59 -5.567 9.534 7.365 1.00 0.00 C ATOM 900 NZ LYS A 59 -5.375 10.697 6.454 1.00 0.00 N ATOM 0 H LYS A 59 -1.757 6.842 11.591 1.00 0.00 H new ATOM 0 HA LYS A 59 -2.207 7.021 9.010 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.802 7.274 11.028 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -3.495 8.996 10.929 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -4.635 7.328 8.656 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -5.604 8.249 9.789 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.503 10.343 9.046 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.499 9.433 7.936 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -5.577 8.614 6.781 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -6.538 9.612 7.853 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -6.289 11.165 6.291 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -4.713 11.372 6.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -4.989 10.367 5.547 1.00 0.00 H new ATOM 914 N SER A 60 -0.865 8.807 8.024 1.00 0.00 N ATOM 915 CA SER A 60 -0.276 9.856 7.205 1.00 0.00 C ATOM 916 C SER A 60 -0.702 9.617 5.765 1.00 0.00 C ATOM 917 O SER A 60 -0.084 10.102 4.816 1.00 0.00 O ATOM 918 CB SER A 60 1.250 9.844 7.318 1.00 0.00 C ATOM 919 OG SER A 60 1.782 8.601 6.898 1.00 0.00 O ATOM 0 H SER A 60 -0.661 7.865 7.690 1.00 0.00 H new ATOM 0 HA SER A 60 -0.620 10.832 7.547 1.00 0.00 H new ATOM 0 HB2 SER A 60 1.669 10.646 6.711 1.00 0.00 H new ATOM 0 HB3 SER A 60 1.543 10.039 8.350 1.00 0.00 H new ATOM 0 HG SER A 60 2.759 8.619 6.978 1.00 0.00 H new ATOM 925 N GLY A 61 -1.767 8.830 5.633 1.00 0.00 N ATOM 926 CA GLY A 61 -2.291 8.478 4.330 1.00 0.00 C ATOM 927 C GLY A 61 -1.376 7.509 3.616 1.00 0.00 C ATOM 928 O GLY A 61 -1.479 7.324 2.402 1.00 0.00 O ATOM 0 H GLY A 61 -2.280 8.427 6.417 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -3.280 8.034 4.441 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -2.412 9.379 3.728 1.00 0.00 H new ATOM 932 N THR A 62 -0.474 6.896 4.387 1.00 0.00 N ATOM 933 CA THR A 62 0.489 5.940 3.858 1.00 0.00 C ATOM 934 C THR A 62 0.804 4.867 4.902 1.00 0.00 C ATOM 935 O THR A 62 1.141 5.186 6.041 1.00 0.00 O ATOM 936 CB THR A 62 1.777 6.663 3.459 1.00 0.00 C ATOM 937 OG1 THR A 62 1.505 7.702 2.537 1.00 0.00 O ATOM 938 CG2 THR A 62 2.805 5.750 2.833 1.00 0.00 C ATOM 0 H THR A 62 -0.395 7.051 5.392 1.00 0.00 H new ATOM 0 HA THR A 62 0.056 5.461 2.979 1.00 0.00 H new ATOM 0 HB THR A 62 2.185 7.059 4.389 1.00 0.00 H new ATOM 0 HG1 THR A 62 2.341 8.153 2.296 1.00 0.00 H new ATOM 0 HG21 THR A 62 3.693 6.326 2.574 1.00 0.00 H new ATOM 0 HG22 THR A 62 3.075 4.966 3.541 1.00 0.00 H new ATOM 0 HG23 THR A 62 2.390 5.298 1.932 1.00 0.00 H new ATOM 946 N ILE A 63 0.688 3.597 4.512 1.00 0.00 N ATOM 947 CA ILE A 63 0.956 2.496 5.416 1.00 0.00 C ATOM 948 C ILE A 63 2.188 1.719 4.974 1.00 0.00 C ATOM 949 O ILE A 63 2.315 1.334 3.812 1.00 0.00 O ATOM 950 CB ILE A 63 -0.251 1.537 5.506 1.00 0.00 C ATOM 951 CG1 ILE A 63 -1.415 2.217 6.232 1.00 0.00 C ATOM 952 CG2 ILE A 63 0.141 0.245 6.207 1.00 0.00 C ATOM 953 CD1 ILE A 63 -2.676 1.380 6.274 1.00 0.00 C ATOM 0 H ILE A 63 0.409 3.313 3.573 1.00 0.00 H new ATOM 0 HA ILE A 63 1.137 2.924 6.402 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.573 1.288 4.495 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.110 2.450 7.252 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -1.634 3.165 5.741 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -0.723 -0.417 6.260 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.939 -0.244 5.648 1.00 0.00 H new ATOM 0 HG23 ILE A 63 0.489 0.469 7.215 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.457 1.925 6.803 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -3.006 1.169 5.257 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -2.473 0.443 6.792 1.00 0.00 H new ATOM 965 N ASP A 64 3.088 1.495 5.918 1.00 0.00 N ATOM 966 CA ASP A 64 4.317 0.767 5.654 1.00 0.00 C ATOM 967 C ASP A 64 4.222 -0.636 6.220 1.00 0.00 C ATOM 968 O ASP A 64 3.303 -0.937 6.979 1.00 0.00 O ATOM 969 CB ASP A 64 5.522 1.503 6.244 1.00 0.00 C ATOM 970 CG ASP A 64 5.720 2.874 5.628 1.00 0.00 C ATOM 971 OD1 ASP A 64 4.800 3.711 5.737 1.00 0.00 O ATOM 972 OD2 ASP A 64 6.796 3.111 5.040 1.00 0.00 O ATOM 0 H ASP A 64 2.988 1.811 6.883 1.00 0.00 H new ATOM 0 HA ASP A 64 4.456 0.702 4.575 1.00 0.00 H new ATOM 0 HB2 ASP A 64 5.389 1.607 7.321 1.00 0.00 H new ATOM 0 HB3 ASP A 64 6.420 0.905 6.090 1.00 0.00 H new ATOM 977 N TYR A 65 5.164 -1.494 5.838 1.00 0.00 N ATOM 978 CA TYR A 65 5.176 -2.876 6.307 1.00 0.00 C ATOM 979 C TYR A 65 4.858 -2.945 7.796 1.00 0.00 C ATOM 980 O TYR A 65 4.345 -3.949 8.289 1.00 0.00 O ATOM 981 CB TYR A 65 6.532 -3.529 6.050 1.00 0.00 C ATOM 982 CG TYR A 65 6.606 -4.924 6.615 1.00 0.00 C ATOM 983 CD1 TYR A 65 5.830 -5.945 6.085 1.00 0.00 C ATOM 984 CD2 TYR A 65 7.431 -5.213 7.690 1.00 0.00 C ATOM 985 CE1 TYR A 65 5.876 -7.219 6.609 1.00 0.00 C ATOM 986 CE2 TYR A 65 7.483 -6.483 8.225 1.00 0.00 C ATOM 987 CZ TYR A 65 6.704 -7.486 7.680 1.00 0.00 C ATOM 988 OH TYR A 65 6.751 -8.754 8.211 1.00 0.00 O ATOM 0 H TYR A 65 5.928 -1.257 5.206 1.00 0.00 H new ATOM 0 HA TYR A 65 4.410 -3.417 5.751 1.00 0.00 H new ATOM 0 HB2 TYR A 65 6.720 -3.563 4.977 1.00 0.00 H new ATOM 0 HB3 TYR A 65 7.318 -2.917 6.492 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.179 -5.738 5.248 1.00 0.00 H new ATOM 0 HD2 TYR A 65 8.043 -4.431 8.116 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.268 -8.004 6.184 1.00 0.00 H new ATOM 0 HE2 TYR A 65 8.129 -6.693 9.065 1.00 0.00 H new ATOM 0 HH TYR A 65 7.384 -8.772 8.959 1.00 0.00 H new ATOM 998 N GLY A 66 5.149 -1.860 8.497 1.00 0.00 N ATOM 999 CA GLY A 66 4.874 -1.806 9.911 1.00 0.00 C ATOM 1000 C GLY A 66 3.422 -1.461 10.189 1.00 0.00 C ATOM 1001 O GLY A 66 2.700 -2.242 10.811 1.00 0.00 O ATOM 0 H GLY A 66 5.571 -1.017 8.108 1.00 0.00 H new ATOM 0 HA2 GLY A 66 5.113 -2.768 10.365 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.520 -1.064 10.379 1.00 0.00 H new ATOM 1005 N GLU A 67 2.989 -0.295 9.709 1.00 0.00 N ATOM 1006 CA GLU A 67 1.613 0.151 9.886 1.00 0.00 C ATOM 1007 C GLU A 67 0.631 -0.884 9.336 1.00 0.00 C ATOM 1008 O GLU A 67 -0.529 -0.930 9.748 1.00 0.00 O ATOM 1009 CB GLU A 67 1.418 1.490 9.172 1.00 0.00 C ATOM 1010 CG GLU A 67 2.379 2.570 9.642 1.00 0.00 C ATOM 1011 CD GLU A 67 2.357 3.800 8.755 1.00 0.00 C ATOM 1012 OE1 GLU A 67 2.710 3.679 7.565 1.00 0.00 O ATOM 1013 OE2 GLU A 67 1.987 4.883 9.251 1.00 0.00 O ATOM 0 H GLU A 67 3.577 0.359 9.192 1.00 0.00 H new ATOM 0 HA GLU A 67 1.417 0.272 10.951 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.544 1.343 8.099 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.395 1.831 9.329 1.00 0.00 H new ATOM 0 HG2 GLU A 67 2.124 2.858 10.662 1.00 0.00 H new ATOM 0 HG3 GLU A 67 3.390 2.164 9.668 1.00 0.00 H new ATOM 1020 N PHE A 68 1.104 -1.717 8.408 1.00 0.00 N ATOM 1021 CA PHE A 68 0.276 -2.750 7.809 1.00 0.00 C ATOM 1022 C PHE A 68 -0.056 -3.814 8.826 1.00 0.00 C ATOM 1023 O PHE A 68 -1.213 -4.004 9.207 1.00 0.00 O ATOM 1024 CB PHE A 68 1.028 -3.415 6.669 1.00 0.00 C ATOM 1025 CG PHE A 68 0.174 -4.342 5.864 1.00 0.00 C ATOM 1026 CD1 PHE A 68 -0.786 -3.833 5.012 1.00 0.00 C ATOM 1027 CD2 PHE A 68 0.324 -5.715 5.962 1.00 0.00 C ATOM 1028 CE1 PHE A 68 -1.586 -4.677 4.268 1.00 0.00 C ATOM 1029 CE2 PHE A 68 -0.475 -6.564 5.224 1.00 0.00 C ATOM 1030 CZ PHE A 68 -1.432 -6.043 4.376 1.00 0.00 C ATOM 0 H PHE A 68 2.062 -1.691 8.057 1.00 0.00 H new ATOM 0 HA PHE A 68 -0.639 -2.282 7.445 1.00 0.00 H new ATOM 0 HB2 PHE A 68 1.436 -2.646 6.014 1.00 0.00 H new ATOM 0 HB3 PHE A 68 1.874 -3.970 7.075 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -0.912 -2.764 4.927 1.00 0.00 H new ATOM 0 HD2 PHE A 68 1.074 -6.125 6.622 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -2.332 -4.268 3.602 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -0.352 -7.634 5.309 1.00 0.00 H new ATOM 0 HZ PHE A 68 -2.060 -6.705 3.798 1.00 0.00 H new ATOM 1040 N ILE A 69 0.989 -4.508 9.252 1.00 0.00 N ATOM 1041 CA ILE A 69 0.867 -5.570 10.222 1.00 0.00 C ATOM 1042 C ILE A 69 0.005 -5.114 11.392 1.00 0.00 C ATOM 1043 O ILE A 69 -1.028 -5.709 11.673 1.00 0.00 O ATOM 1044 CB ILE A 69 2.255 -6.008 10.716 1.00 0.00 C ATOM 1045 CG1 ILE A 69 3.153 -6.380 9.531 1.00 0.00 C ATOM 1046 CG2 ILE A 69 2.121 -7.178 11.653 1.00 0.00 C ATOM 1047 CD1 ILE A 69 2.618 -7.527 8.696 1.00 0.00 C ATOM 0 H ILE A 69 1.943 -4.346 8.931 1.00 0.00 H new ATOM 0 HA ILE A 69 0.387 -6.425 9.746 1.00 0.00 H new ATOM 0 HB ILE A 69 2.715 -5.176 11.250 1.00 0.00 H new ATOM 0 HG12 ILE A 69 3.278 -5.505 8.893 1.00 0.00 H new ATOM 0 HG13 ILE A 69 4.142 -6.645 9.905 1.00 0.00 H new ATOM 0 HG21 ILE A 69 3.109 -7.482 11.999 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.510 -6.891 12.509 1.00 0.00 H new ATOM 0 HG23 ILE A 69 1.647 -8.009 11.131 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.307 -7.733 7.877 1.00 0.00 H new ATOM 0 HD12 ILE A 69 2.520 -8.416 9.319 1.00 0.00 H new ATOM 0 HD13 ILE A 69 1.642 -7.258 8.291 1.00 0.00 H new ATOM 1059 N ALA A 70 0.428 -4.041 12.050 1.00 0.00 N ATOM 1060 CA ALA A 70 -0.313 -3.476 13.170 1.00 0.00 C ATOM 1061 C ALA A 70 -1.805 -3.398 12.851 1.00 0.00 C ATOM 1062 O ALA A 70 -2.634 -3.875 13.615 1.00 0.00 O ATOM 1063 CB ALA A 70 0.226 -2.098 13.516 1.00 0.00 C ATOM 0 H ALA A 70 1.288 -3.542 11.824 1.00 0.00 H new ATOM 0 HA ALA A 70 -0.183 -4.131 14.031 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -0.337 -1.687 14.354 1.00 0.00 H new ATOM 0 HB2 ALA A 70 1.278 -2.177 13.789 1.00 0.00 H new ATOM 0 HB3 ALA A 70 0.123 -1.440 12.653 1.00 0.00 H new ATOM 1069 N ALA A 71 -2.130 -2.775 11.723 1.00 0.00 N ATOM 1070 CA ALA A 71 -3.520 -2.605 11.296 1.00 0.00 C ATOM 1071 C ALA A 71 -4.335 -3.902 11.377 1.00 0.00 C ATOM 1072 O ALA A 71 -5.516 -3.873 11.723 1.00 0.00 O ATOM 1073 CB ALA A 71 -3.560 -2.054 9.878 1.00 0.00 C ATOM 0 H ALA A 71 -1.445 -2.375 11.081 1.00 0.00 H new ATOM 0 HA ALA A 71 -3.981 -1.899 11.987 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -4.597 -1.929 9.565 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -3.054 -1.089 9.848 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -3.058 -2.748 9.204 1.00 0.00 H new ATOM 1303 N VAL A 85 -3.717 9.425 22.186 1.00 0.00 N ATOM 1304 CA VAL A 85 -3.134 9.567 20.857 1.00 0.00 C ATOM 1305 C VAL A 85 -4.139 9.209 19.766 1.00 0.00 C ATOM 1306 O VAL A 85 -3.972 9.600 18.610 1.00 0.00 O ATOM 1307 CB VAL A 85 -1.872 8.697 20.694 1.00 0.00 C ATOM 1308 CG1 VAL A 85 -0.848 9.040 21.764 1.00 0.00 C ATOM 1309 CG2 VAL A 85 -2.224 7.217 20.735 1.00 0.00 C ATOM 0 HA VAL A 85 -2.854 10.615 20.751 1.00 0.00 H new ATOM 0 HB VAL A 85 -1.433 8.910 19.719 1.00 0.00 H new ATOM 0 HG11 VAL A 85 0.037 8.417 21.634 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -0.568 10.090 21.677 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -1.277 8.860 22.750 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -1.317 6.624 20.618 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -2.691 6.981 21.691 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -2.916 6.985 19.926 1.00 0.00 H new ATOM 1319 N SER A 86 -5.184 8.469 20.141 1.00 0.00 N ATOM 1320 CA SER A 86 -6.221 8.066 19.195 1.00 0.00 C ATOM 1321 C SER A 86 -6.647 9.256 18.343 1.00 0.00 C ATOM 1322 O SER A 86 -6.559 9.219 17.114 1.00 0.00 O ATOM 1323 CB SER A 86 -7.430 7.493 19.938 1.00 0.00 C ATOM 1324 OG SER A 86 -7.994 8.454 20.815 1.00 0.00 O ATOM 0 H SER A 86 -5.333 8.137 21.094 1.00 0.00 H new ATOM 0 HA SER A 86 -5.814 7.293 18.544 1.00 0.00 H new ATOM 0 HB2 SER A 86 -8.182 7.167 19.219 1.00 0.00 H new ATOM 0 HB3 SER A 86 -7.128 6.612 20.505 1.00 0.00 H new ATOM 0 HG SER A 86 -8.766 8.063 21.276 1.00 0.00 H new ATOM 1330 N ALA A 87 -7.084 10.323 19.004 1.00 0.00 N ATOM 1331 CA ALA A 87 -7.490 11.531 18.304 1.00 0.00 C ATOM 1332 C ALA A 87 -6.271 12.190 17.678 1.00 0.00 C ATOM 1333 O ALA A 87 -6.291 12.577 16.512 1.00 0.00 O ATOM 1334 CB ALA A 87 -8.195 12.481 19.250 1.00 0.00 C ATOM 0 H ALA A 87 -7.165 10.374 20.020 1.00 0.00 H new ATOM 0 HA ALA A 87 -8.192 11.269 17.512 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -8.492 13.380 18.709 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -9.080 11.995 19.660 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -7.521 12.753 20.062 1.00 0.00 H new ATOM 1340 N PHE A 88 -5.195 12.281 18.464 1.00 0.00 N ATOM 1341 CA PHE A 88 -3.933 12.849 17.999 1.00 0.00 C ATOM 1342 C PHE A 88 -3.562 12.255 16.645 1.00 0.00 C ATOM 1343 O PHE A 88 -2.765 12.811 15.896 1.00 0.00 O ATOM 1344 CB PHE A 88 -2.838 12.550 19.020 1.00 0.00 C ATOM 1345 CG PHE A 88 -1.587 13.344 18.814 1.00 0.00 C ATOM 1346 CD1 PHE A 88 -1.632 14.728 18.768 1.00 0.00 C ATOM 1347 CD2 PHE A 88 -0.364 12.709 18.679 1.00 0.00 C ATOM 1348 CE1 PHE A 88 -0.484 15.460 18.589 1.00 0.00 C ATOM 1349 CE2 PHE A 88 0.791 13.439 18.499 1.00 0.00 C ATOM 1350 CZ PHE A 88 0.733 14.817 18.454 1.00 0.00 C ATOM 0 H PHE A 88 -5.176 11.965 19.434 1.00 0.00 H new ATOM 0 HA PHE A 88 -4.040 13.928 17.889 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -3.223 12.749 20.020 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -2.595 11.488 18.977 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -2.579 15.236 18.874 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -0.315 11.631 18.715 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -0.532 16.538 18.554 1.00 0.00 H new ATOM 0 HE2 PHE A 88 1.740 12.934 18.393 1.00 0.00 H new ATOM 0 HZ PHE A 88 1.636 15.392 18.314 1.00 0.00 H new ATOM 1360 N SER A 89 -4.163 11.120 16.340 1.00 0.00 N ATOM 1361 CA SER A 89 -3.939 10.445 15.078 1.00 0.00 C ATOM 1362 C SER A 89 -4.932 10.925 14.027 1.00 0.00 C ATOM 1363 O SER A 89 -4.544 11.441 12.979 1.00 0.00 O ATOM 1364 CB SER A 89 -4.074 8.946 15.262 1.00 0.00 C ATOM 1365 OG SER A 89 -2.960 8.407 15.952 1.00 0.00 O ATOM 0 H SER A 89 -4.818 10.642 16.959 1.00 0.00 H new ATOM 0 HA SER A 89 -2.930 10.679 14.737 1.00 0.00 H new ATOM 0 HB2 SER A 89 -4.987 8.727 15.815 1.00 0.00 H new ATOM 0 HB3 SER A 89 -4.168 8.465 14.288 1.00 0.00 H new ATOM 0 HG SER A 89 -3.007 8.660 16.898 1.00 0.00 H new ATOM 1371 N TYR A 90 -6.220 10.737 14.314 1.00 0.00 N ATOM 1372 CA TYR A 90 -7.275 11.135 13.396 1.00 0.00 C ATOM 1373 C TYR A 90 -7.444 12.651 13.403 1.00 0.00 C ATOM 1374 O TYR A 90 -7.200 13.307 12.389 1.00 0.00 O ATOM 1375 CB TYR A 90 -8.582 10.440 13.774 1.00 0.00 C ATOM 1376 CG TYR A 90 -9.612 10.398 12.662 1.00 0.00 C ATOM 1377 CD1 TYR A 90 -9.450 11.138 11.492 1.00 0.00 C ATOM 1378 CD2 TYR A 90 -10.743 9.603 12.779 1.00 0.00 C ATOM 1379 CE1 TYR A 90 -10.386 11.088 10.480 1.00 0.00 C ATOM 1380 CE2 TYR A 90 -11.683 9.544 11.770 1.00 0.00 C ATOM 1381 CZ TYR A 90 -11.502 10.289 10.622 1.00 0.00 C ATOM 1382 OH TYR A 90 -12.437 10.232 9.615 1.00 0.00 O ATOM 0 H TYR A 90 -6.554 10.310 15.178 1.00 0.00 H new ATOM 0 HA TYR A 90 -7.000 10.832 12.386 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -8.360 9.420 14.086 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -9.015 10.950 14.635 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -8.576 11.762 11.376 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -10.891 9.020 13.676 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -10.246 11.671 9.582 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -12.556 8.918 11.878 1.00 0.00 H new ATOM 0 HH TYR A 90 -13.160 9.623 9.874 1.00 0.00 H new ATOM 1392 N PHE A 91 -7.826 13.210 14.554 1.00 0.00 N ATOM 1393 CA PHE A 91 -7.973 14.658 14.675 1.00 0.00 C ATOM 1394 C PHE A 91 -6.693 15.303 14.179 1.00 0.00 C ATOM 1395 O PHE A 91 -6.700 16.014 13.174 1.00 0.00 O ATOM 1396 CB PHE A 91 -8.271 15.066 16.120 1.00 0.00 C ATOM 1397 CG PHE A 91 -9.665 14.721 16.566 1.00 0.00 C ATOM 1398 CD1 PHE A 91 -10.146 13.425 16.456 1.00 0.00 C ATOM 1399 CD2 PHE A 91 -10.495 15.696 17.096 1.00 0.00 C ATOM 1400 CE1 PHE A 91 -11.428 13.110 16.864 1.00 0.00 C ATOM 1401 CE2 PHE A 91 -11.778 15.387 17.505 1.00 0.00 C ATOM 1402 CZ PHE A 91 -12.245 14.092 17.390 1.00 0.00 C ATOM 0 H PHE A 91 -8.036 12.688 15.404 1.00 0.00 H new ATOM 0 HA PHE A 91 -8.817 14.995 14.074 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -7.555 14.578 16.782 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -8.120 16.141 16.224 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -9.511 12.653 16.047 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -10.135 16.710 17.190 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -11.791 12.097 16.772 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -12.415 16.157 17.914 1.00 0.00 H new ATOM 0 HZ PHE A 91 -13.247 13.848 17.711 1.00 0.00 H new ATOM 1412 N ASP A 92 -5.576 14.984 14.833 1.00 0.00 N ATOM 1413 CA ASP A 92 -4.292 15.475 14.369 1.00 0.00 C ATOM 1414 C ASP A 92 -3.847 14.535 13.273 1.00 0.00 C ATOM 1415 O ASP A 92 -2.934 13.729 13.450 1.00 0.00 O ATOM 1416 CB ASP A 92 -3.254 15.523 15.489 1.00 0.00 C ATOM 1417 CG ASP A 92 -1.919 16.062 15.010 1.00 0.00 C ATOM 1418 OD1 ASP A 92 -1.828 16.458 13.829 1.00 0.00 O ATOM 1419 OD2 ASP A 92 -0.968 16.097 15.816 1.00 0.00 O ATOM 0 H ASP A 92 -5.539 14.400 15.668 1.00 0.00 H new ATOM 0 HA ASP A 92 -4.390 16.499 14.008 1.00 0.00 H new ATOM 0 HB2 ASP A 92 -3.626 16.148 16.301 1.00 0.00 H new ATOM 0 HB3 ASP A 92 -3.115 14.522 15.896 1.00 0.00 H new ATOM 1424 N LYS A 93 -4.555 14.607 12.159 1.00 0.00 N ATOM 1425 CA LYS A 93 -4.311 13.739 11.040 1.00 0.00 C ATOM 1426 C LYS A 93 -2.855 13.756 10.590 1.00 0.00 C ATOM 1427 O LYS A 93 -2.413 12.845 9.888 1.00 0.00 O ATOM 1428 CB LYS A 93 -5.266 14.100 9.930 1.00 0.00 C ATOM 1429 CG LYS A 93 -5.042 13.351 8.632 1.00 0.00 C ATOM 1430 CD LYS A 93 -6.207 13.562 7.682 1.00 0.00 C ATOM 1431 CE LYS A 93 -7.510 13.051 8.282 1.00 0.00 C ATOM 1432 NZ LYS A 93 -8.692 13.472 7.480 1.00 0.00 N ATOM 0 H LYS A 93 -5.314 15.273 12.013 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.495 12.709 11.345 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.284 13.913 10.270 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -5.187 15.169 9.735 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -4.119 13.692 8.164 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -4.921 12.287 8.837 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -6.302 14.623 7.450 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -6.010 13.047 6.742 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -7.480 11.963 8.342 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -7.611 13.424 9.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -9.559 13.105 7.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.735 14.510 7.444 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.608 13.095 6.514 1.00 0.00 H new ATOM 1446 N ASP A 94 -2.091 14.757 11.022 1.00 0.00 N ATOM 1447 CA ASP A 94 -0.683 14.798 10.666 1.00 0.00 C ATOM 1448 C ASP A 94 0.150 14.224 11.808 1.00 0.00 C ATOM 1449 O ASP A 94 1.259 13.734 11.593 1.00 0.00 O ATOM 1450 CB ASP A 94 -0.243 16.230 10.356 1.00 0.00 C ATOM 1451 CG ASP A 94 -0.944 16.798 9.137 1.00 0.00 C ATOM 1452 OD1 ASP A 94 -0.810 16.206 8.046 1.00 0.00 O ATOM 1453 OD2 ASP A 94 -1.625 17.835 9.274 1.00 0.00 O ATOM 0 H ASP A 94 -2.416 15.530 11.604 1.00 0.00 H new ATOM 0 HA ASP A 94 -0.530 14.196 9.770 1.00 0.00 H new ATOM 0 HB2 ASP A 94 -0.447 16.865 11.218 1.00 0.00 H new ATOM 0 HB3 ASP A 94 0.835 16.249 10.194 1.00 0.00 H new ATOM 1458 N GLY A 95 -0.398 14.273 13.026 1.00 0.00 N ATOM 1459 CA GLY A 95 0.288 13.745 14.192 1.00 0.00 C ATOM 1460 C GLY A 95 1.527 14.532 14.583 1.00 0.00 C ATOM 1461 O GLY A 95 2.068 14.330 15.670 1.00 0.00 O ATOM 0 H GLY A 95 -1.315 14.674 13.222 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.404 13.732 15.034 1.00 0.00 H new ATOM 0 HA3 GLY A 95 0.572 12.711 13.997 1.00 0.00 H new ATOM 1465 N SER A 96 1.985 15.422 13.705 1.00 0.00 N ATOM 1466 CA SER A 96 3.170 16.227 13.978 1.00 0.00 C ATOM 1467 C SER A 96 3.047 16.921 15.327 1.00 0.00 C ATOM 1468 O SER A 96 4.046 17.286 15.945 1.00 0.00 O ATOM 1469 CB SER A 96 3.372 17.266 12.874 1.00 0.00 C ATOM 1470 OG SER A 96 2.251 18.128 12.775 1.00 0.00 O ATOM 0 H SER A 96 1.552 15.603 12.799 1.00 0.00 H new ATOM 0 HA SER A 96 4.035 15.564 14.004 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.268 17.851 13.080 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.533 16.762 11.921 1.00 0.00 H new ATOM 0 HG SER A 96 2.405 18.784 12.064 1.00 0.00 H new ATOM 1476 N GLY A 97 1.810 17.087 15.778 1.00 0.00 N ATOM 1477 CA GLY A 97 1.568 17.725 17.059 1.00 0.00 C ATOM 1478 C GLY A 97 0.612 18.894 16.967 1.00 0.00 C ATOM 1479 O GLY A 97 0.265 19.500 17.975 1.00 0.00 O ATOM 0 H GLY A 97 0.970 16.792 15.280 1.00 0.00 H new ATOM 0 HA2 GLY A 97 1.167 16.989 17.755 1.00 0.00 H new ATOM 0 HA3 GLY A 97 2.516 18.070 17.472 1.00 0.00 H new ATOM 1483 N TYR A 98 0.198 19.221 15.753 1.00 0.00 N ATOM 1484 CA TYR A 98 -0.711 20.340 15.530 1.00 0.00 C ATOM 1485 C TYR A 98 -1.949 19.918 14.745 1.00 0.00 C ATOM 1486 O TYR A 98 -1.872 19.095 13.832 1.00 0.00 O ATOM 1487 CB TYR A 98 -0.010 21.466 14.759 1.00 0.00 C ATOM 1488 CG TYR A 98 1.216 22.047 15.434 1.00 0.00 C ATOM 1489 CD1 TYR A 98 2.290 21.245 15.803 1.00 0.00 C ATOM 1490 CD2 TYR A 98 1.300 23.410 15.688 1.00 0.00 C ATOM 1491 CE1 TYR A 98 3.409 21.783 16.405 1.00 0.00 C ATOM 1492 CE2 TYR A 98 2.417 23.956 16.290 1.00 0.00 C ATOM 1493 CZ TYR A 98 3.470 23.139 16.647 1.00 0.00 C ATOM 1494 OH TYR A 98 4.586 23.678 17.246 1.00 0.00 O ATOM 0 H TYR A 98 0.476 18.728 14.904 1.00 0.00 H new ATOM 0 HA TYR A 98 -1.017 20.693 16.515 1.00 0.00 H new ATOM 0 HB2 TYR A 98 0.280 21.087 13.779 1.00 0.00 H new ATOM 0 HB3 TYR A 98 -0.727 22.270 14.590 1.00 0.00 H new ATOM 0 HD1 TYR A 98 2.248 20.182 15.615 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.478 24.054 15.410 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.234 21.145 16.685 1.00 0.00 H new ATOM 0 HE2 TYR A 98 2.466 25.018 16.480 1.00 0.00 H new ATOM 0 HH TYR A 98 4.469 24.646 17.344 1.00 0.00 H new ATOM 1504 N ILE A 99 -3.081 20.527 15.081 1.00 0.00 N ATOM 1505 CA ILE A 99 -4.338 20.266 14.390 1.00 0.00 C ATOM 1506 C ILE A 99 -5.002 21.585 14.022 1.00 0.00 C ATOM 1507 O ILE A 99 -5.607 22.222 14.869 1.00 0.00 O ATOM 1508 CB ILE A 99 -5.321 19.469 15.270 1.00 0.00 C ATOM 1509 CG1 ILE A 99 -4.641 18.263 15.888 1.00 0.00 C ATOM 1510 CG2 ILE A 99 -6.522 19.024 14.456 1.00 0.00 C ATOM 1511 CD1 ILE A 99 -5.549 17.488 16.821 1.00 0.00 C ATOM 0 H ILE A 99 -3.153 21.211 15.835 1.00 0.00 H new ATOM 0 HA ILE A 99 -4.103 19.681 13.501 1.00 0.00 H new ATOM 0 HB ILE A 99 -5.659 20.125 16.072 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -4.294 17.601 15.094 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -3.759 18.592 16.438 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -7.206 18.463 15.093 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -7.035 19.899 14.056 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -6.190 18.390 13.634 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -5.007 16.637 17.232 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -5.876 18.137 17.633 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -6.419 17.132 16.269 1.00 0.00 H new ATOM 1523 N THR A 100 -4.917 21.993 12.770 1.00 0.00 N ATOM 1524 CA THR A 100 -5.539 23.246 12.363 1.00 0.00 C ATOM 1525 C THR A 100 -7.023 23.037 12.107 1.00 0.00 C ATOM 1526 O THR A 100 -7.449 21.912 11.865 1.00 0.00 O ATOM 1527 CB THR A 100 -4.848 23.793 11.115 1.00 0.00 C ATOM 1528 OG1 THR A 100 -5.011 22.908 10.021 1.00 0.00 O ATOM 1529 CG2 THR A 100 -3.363 24.010 11.313 1.00 0.00 C ATOM 0 H THR A 100 -4.434 21.489 12.027 1.00 0.00 H new ATOM 0 HA THR A 100 -5.429 23.974 13.167 1.00 0.00 H new ATOM 0 HB THR A 100 -5.322 24.754 10.914 1.00 0.00 H new ATOM 0 HG1 THR A 100 -4.563 23.278 9.232 1.00 0.00 H new ATOM 0 HG21 THR A 100 -2.926 24.399 10.393 1.00 0.00 H new ATOM 0 HG22 THR A 100 -3.204 24.724 12.121 1.00 0.00 H new ATOM 0 HG23 THR A 100 -2.888 23.063 11.568 1.00 0.00 H new ATOM 1537 N LEU A 101 -7.812 24.114 12.193 1.00 0.00 N ATOM 1538 CA LEU A 101 -9.258 24.028 11.994 1.00 0.00 C ATOM 1539 C LEU A 101 -9.609 22.990 10.937 1.00 0.00 C ATOM 1540 O LEU A 101 -10.565 22.233 11.094 1.00 0.00 O ATOM 1541 CB LEU A 101 -9.802 25.394 11.577 1.00 0.00 C ATOM 1542 CG LEU A 101 -9.267 25.940 10.250 1.00 0.00 C ATOM 1543 CD1 LEU A 101 -10.167 25.530 9.093 1.00 0.00 C ATOM 1544 CD2 LEU A 101 -9.128 27.453 10.313 1.00 0.00 C ATOM 0 H LEU A 101 -7.471 25.053 12.399 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.714 23.721 12.935 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -10.888 25.328 11.511 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -9.573 26.112 12.364 1.00 0.00 H new ATOM 0 HG LEU A 101 -8.280 25.511 10.078 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.767 25.929 8.161 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -10.210 24.442 9.033 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.170 25.924 9.255 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -8.747 27.823 9.361 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -10.102 27.900 10.512 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -8.436 27.722 11.111 1.00 0.00 H new ATOM 1556 N ASP A 102 -8.817 22.941 9.878 1.00 0.00 N ATOM 1557 CA ASP A 102 -9.035 21.969 8.819 1.00 0.00 C ATOM 1558 C ASP A 102 -8.993 20.560 9.404 1.00 0.00 C ATOM 1559 O ASP A 102 -9.954 19.808 9.299 1.00 0.00 O ATOM 1560 CB ASP A 102 -7.974 22.119 7.724 1.00 0.00 C ATOM 1561 CG ASP A 102 -8.201 21.177 6.557 1.00 0.00 C ATOM 1562 OD1 ASP A 102 -8.169 19.946 6.769 1.00 0.00 O ATOM 1563 OD2 ASP A 102 -8.410 21.671 5.429 1.00 0.00 O ATOM 0 H ASP A 102 -8.020 23.560 9.729 1.00 0.00 H new ATOM 0 HA ASP A 102 -10.014 22.145 8.372 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -7.975 23.147 7.361 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -6.988 21.932 8.150 1.00 0.00 H new ATOM 1568 N GLU A 103 -7.874 20.220 10.040 1.00 0.00 N ATOM 1569 CA GLU A 103 -7.702 18.909 10.660 1.00 0.00 C ATOM 1570 C GLU A 103 -8.772 18.644 11.722 1.00 0.00 C ATOM 1571 O GLU A 103 -9.393 17.581 11.727 1.00 0.00 O ATOM 1572 CB GLU A 103 -6.307 18.799 11.273 1.00 0.00 C ATOM 1573 CG GLU A 103 -5.182 18.933 10.259 1.00 0.00 C ATOM 1574 CD GLU A 103 -3.809 18.815 10.893 1.00 0.00 C ATOM 1575 OE1 GLU A 103 -3.525 17.760 11.501 1.00 0.00 O ATOM 1576 OE2 GLU A 103 -3.018 19.774 10.782 1.00 0.00 O ATOM 0 H GLU A 103 -7.069 20.838 10.139 1.00 0.00 H new ATOM 0 HA GLU A 103 -7.814 18.153 9.883 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -6.192 19.571 12.034 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -6.216 17.837 11.778 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -5.293 18.164 9.495 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -5.264 19.896 9.756 1.00 0.00 H new ATOM 1583 N ILE A 104 -8.991 19.611 12.616 1.00 0.00 N ATOM 1584 CA ILE A 104 -9.997 19.462 13.669 1.00 0.00 C ATOM 1585 C ILE A 104 -11.364 19.148 13.067 1.00 0.00 C ATOM 1586 O ILE A 104 -11.918 18.069 13.274 1.00 0.00 O ATOM 1587 CB ILE A 104 -10.127 20.740 14.531 1.00 0.00 C ATOM 1588 CG1 ILE A 104 -8.810 21.071 15.233 1.00 0.00 C ATOM 1589 CG2 ILE A 104 -11.231 20.564 15.558 1.00 0.00 C ATOM 1590 CD1 ILE A 104 -8.810 22.425 15.914 1.00 0.00 C ATOM 0 H ILE A 104 -8.489 20.499 12.632 1.00 0.00 H new ATOM 0 HA ILE A 104 -9.664 18.640 14.303 1.00 0.00 H new ATOM 0 HB ILE A 104 -10.377 21.570 13.869 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.599 20.300 15.975 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.001 21.041 14.503 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -11.315 21.469 16.160 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -12.176 20.378 15.048 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -10.995 19.719 16.204 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.844 22.592 16.391 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -8.989 23.205 15.174 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -9.597 22.453 16.668 1.00 0.00 H new ATOM 1602 N GLN A 105 -11.895 20.110 12.324 1.00 0.00 N ATOM 1603 CA GLN A 105 -13.189 19.975 11.679 1.00 0.00 C ATOM 1604 C GLN A 105 -13.223 18.750 10.763 1.00 0.00 C ATOM 1605 O GLN A 105 -13.969 17.805 11.018 1.00 0.00 O ATOM 1606 CB GLN A 105 -13.502 21.251 10.880 1.00 0.00 C ATOM 1607 CG GLN A 105 -13.564 22.517 11.730 1.00 0.00 C ATOM 1608 CD GLN A 105 -13.715 23.778 10.889 1.00 0.00 C ATOM 1609 OE1 GLN A 105 -14.582 24.699 11.315 1.00 0.00 O flip ATOM 1610 NE2 GLN A 105 -13.031 23.939 9.878 1.00 0.00 N flip ATOM 0 H GLN A 105 -11.438 21.006 12.153 1.00 0.00 H new ATOM 0 HA GLN A 105 -13.948 19.836 12.448 1.00 0.00 H new ATOM 0 HB2 GLN A 105 -12.742 21.380 10.109 1.00 0.00 H new ATOM 0 HB3 GLN A 105 -14.456 21.122 10.369 1.00 0.00 H new ATOM 0 HG2 GLN A 105 -14.402 22.444 12.424 1.00 0.00 H new ATOM 0 HG3 GLN A 105 -12.658 22.592 12.331 1.00 0.00 H new ATOM 0 HE21 GLN A 105 -12.379 23.213 9.583 1.00 0.00 H new ATOM 0 HE22 GLN A 105 -13.117 24.799 9.336 1.00 0.00 H new ATOM 1619 N GLN A 106 -12.414 18.771 9.701 1.00 0.00 N ATOM 1620 CA GLN A 106 -12.365 17.664 8.739 1.00 0.00 C ATOM 1621 C GLN A 106 -12.385 16.313 9.441 1.00 0.00 C ATOM 1622 O GLN A 106 -12.947 15.347 8.918 1.00 0.00 O ATOM 1623 CB GLN A 106 -11.118 17.764 7.858 1.00 0.00 C ATOM 1624 CG GLN A 106 -11.017 16.665 6.811 1.00 0.00 C ATOM 1625 CD GLN A 106 -9.737 16.750 6.003 1.00 0.00 C ATOM 1626 OE1 GLN A 106 -8.638 16.659 6.549 1.00 0.00 O ATOM 1627 NE2 GLN A 106 -9.874 16.924 4.693 1.00 0.00 N ATOM 0 H GLN A 106 -11.783 19.542 9.484 1.00 0.00 H new ATOM 0 HA GLN A 106 -13.254 17.742 8.113 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -11.115 18.732 7.357 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -10.232 17.731 8.493 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -11.069 15.693 7.302 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -11.872 16.728 6.138 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -10.805 16.994 4.282 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -9.048 16.987 4.098 1.00 0.00 H new ATOM 1636 N ALA A 107 -11.789 16.245 10.627 1.00 0.00 N ATOM 1637 CA ALA A 107 -11.773 15.000 11.384 1.00 0.00 C ATOM 1638 C ALA A 107 -13.194 14.480 11.534 1.00 0.00 C ATOM 1639 O ALA A 107 -13.543 13.430 10.994 1.00 0.00 O ATOM 1640 CB ALA A 107 -11.127 15.204 12.746 1.00 0.00 C ATOM 0 H ALA A 107 -11.316 17.027 11.080 1.00 0.00 H new ATOM 0 HA ALA A 107 -11.179 14.263 10.843 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.126 14.261 13.293 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -10.101 15.548 12.614 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -11.690 15.949 13.308 1.00 0.00 H new ATOM 1646 N CYS A 108 -14.014 15.231 12.262 1.00 0.00 N ATOM 1647 CA CYS A 108 -15.406 14.868 12.481 1.00 0.00 C ATOM 1648 C CYS A 108 -16.172 14.822 11.158 1.00 0.00 C ATOM 1649 O CYS A 108 -16.025 15.708 10.317 1.00 0.00 O ATOM 1650 CB CYS A 108 -16.044 15.879 13.434 1.00 0.00 C ATOM 1651 SG CYS A 108 -17.785 15.555 13.796 1.00 0.00 S ATOM 0 H CYS A 108 -13.733 16.102 12.713 1.00 0.00 H new ATOM 0 HA CYS A 108 -15.449 13.873 12.924 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -15.484 15.884 14.369 1.00 0.00 H new ATOM 0 HB3 CYS A 108 -15.953 16.876 13.003 1.00 0.00 H new ATOM 0 HG CYS A 108 -18.340 16.635 14.261 1.00 0.00 H new ATOM 1657 N LYS A 109 -16.972 13.773 10.974 1.00 0.00 N ATOM 1658 CA LYS A 109 -17.748 13.598 9.744 1.00 0.00 C ATOM 1659 C LYS A 109 -19.126 14.267 9.823 1.00 0.00 C ATOM 1660 O LYS A 109 -19.539 14.966 8.899 1.00 0.00 O ATOM 1661 CB LYS A 109 -17.916 12.108 9.443 1.00 0.00 C ATOM 1662 CG LYS A 109 -18.680 11.829 8.159 1.00 0.00 C ATOM 1663 CD LYS A 109 -18.882 10.338 7.948 1.00 0.00 C ATOM 1664 CE LYS A 109 -19.623 10.058 6.651 1.00 0.00 C ATOM 1665 NZ LYS A 109 -19.857 8.601 6.447 1.00 0.00 N ATOM 0 H LYS A 109 -17.101 13.030 11.661 1.00 0.00 H new ATOM 0 HA LYS A 109 -17.194 14.083 8.940 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -16.931 11.646 9.378 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -18.436 11.634 10.276 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -19.649 12.328 8.194 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -18.137 12.248 7.312 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -17.914 9.837 7.932 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -19.442 9.923 8.786 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -20.579 10.581 6.659 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -19.050 10.454 5.813 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -20.365 8.453 5.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -18.944 8.104 6.413 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -20.426 8.227 7.233 1.00 0.00 H new ATOM 1679 N ASP A 110 -19.839 14.025 10.919 1.00 0.00 N ATOM 1680 CA ASP A 110 -21.180 14.582 11.114 1.00 0.00 C ATOM 1681 C ASP A 110 -21.124 16.043 11.555 1.00 0.00 C ATOM 1682 O ASP A 110 -22.157 16.690 11.729 1.00 0.00 O ATOM 1683 CB ASP A 110 -21.953 13.759 12.148 1.00 0.00 C ATOM 1684 CG ASP A 110 -22.108 12.309 11.735 1.00 0.00 C ATOM 1685 OD1 ASP A 110 -22.705 12.056 10.668 1.00 0.00 O ATOM 1686 OD2 ASP A 110 -21.632 11.426 12.478 1.00 0.00 O ATOM 0 H ASP A 110 -19.511 13.444 11.691 1.00 0.00 H new ATOM 0 HA ASP A 110 -21.696 14.537 10.155 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -21.436 13.807 13.107 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -22.939 14.199 12.295 1.00 0.00 H new ATOM 1691 N PHE A 111 -19.912 16.541 11.754 1.00 0.00 N ATOM 1692 CA PHE A 111 -19.691 17.915 12.204 1.00 0.00 C ATOM 1693 C PHE A 111 -20.510 18.947 11.429 1.00 0.00 C ATOM 1694 O PHE A 111 -20.827 20.006 11.966 1.00 0.00 O ATOM 1695 CB PHE A 111 -18.204 18.284 12.079 1.00 0.00 C ATOM 1696 CG PHE A 111 -17.642 18.211 10.674 1.00 0.00 C ATOM 1697 CD1 PHE A 111 -18.276 17.489 9.671 1.00 0.00 C ATOM 1698 CD2 PHE A 111 -16.460 18.860 10.364 1.00 0.00 C ATOM 1699 CE1 PHE A 111 -17.747 17.420 8.397 1.00 0.00 C ATOM 1700 CE2 PHE A 111 -15.925 18.792 9.089 1.00 0.00 C ATOM 1701 CZ PHE A 111 -16.569 18.072 8.106 1.00 0.00 C ATOM 0 H PHE A 111 -19.054 16.009 11.610 1.00 0.00 H new ATOM 0 HA PHE A 111 -20.016 17.943 13.244 1.00 0.00 H new ATOM 0 HB2 PHE A 111 -18.063 19.296 12.458 1.00 0.00 H new ATOM 0 HB3 PHE A 111 -17.625 17.620 12.721 1.00 0.00 H new ATOM 0 HD1 PHE A 111 -19.199 16.973 9.891 1.00 0.00 H new ATOM 0 HD2 PHE A 111 -15.948 19.427 11.127 1.00 0.00 H new ATOM 0 HE1 PHE A 111 -18.256 16.856 7.630 1.00 0.00 H new ATOM 0 HE2 PHE A 111 -15.001 19.304 8.864 1.00 0.00 H new ATOM 0 HZ PHE A 111 -16.152 18.019 7.111 1.00 0.00 H new ATOM 1711 N GLY A 112 -20.855 18.650 10.180 1.00 0.00 N ATOM 1712 CA GLY A 112 -21.627 19.607 9.412 1.00 0.00 C ATOM 1713 C GLY A 112 -20.861 20.910 9.268 1.00 0.00 C ATOM 1714 O GLY A 112 -21.444 21.990 9.363 1.00 0.00 O ATOM 0 H GLY A 112 -20.620 17.784 9.695 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -21.849 19.198 8.427 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -22.582 19.792 9.903 1.00 0.00 H new ATOM 1718 N LEU A 113 -19.540 20.791 9.099 1.00 0.00 N ATOM 1719 CA LEU A 113 -18.637 21.945 9.011 1.00 0.00 C ATOM 1720 C LEU A 113 -19.305 23.153 8.375 1.00 0.00 C ATOM 1721 O LEU A 113 -19.854 23.076 7.276 1.00 0.00 O ATOM 1722 CB LEU A 113 -17.389 21.565 8.202 1.00 0.00 C ATOM 1723 CG LEU A 113 -16.199 22.533 8.292 1.00 0.00 C ATOM 1724 CD1 LEU A 113 -14.941 21.870 7.754 1.00 0.00 C ATOM 1725 CD2 LEU A 113 -16.473 23.819 7.524 1.00 0.00 C ATOM 0 H LEU A 113 -19.066 19.892 9.019 1.00 0.00 H new ATOM 0 HA LEU A 113 -18.359 22.220 10.029 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -17.055 20.581 8.530 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -17.676 21.471 7.155 1.00 0.00 H new ATOM 0 HG LEU A 113 -16.054 22.787 9.342 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -14.105 22.566 7.823 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -14.720 20.978 8.341 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -15.095 21.590 6.712 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -15.612 24.483 7.607 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -16.651 23.585 6.474 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -17.352 24.311 7.940 1.00 0.00 H new ATOM 1737 N ASP A 114 -19.234 24.277 9.086 1.00 0.00 N ATOM 1738 CA ASP A 114 -19.815 25.522 8.605 1.00 0.00 C ATOM 1739 C ASP A 114 -19.202 26.724 9.322 1.00 0.00 C ATOM 1740 O ASP A 114 -18.359 26.569 10.205 1.00 0.00 O ATOM 1741 CB ASP A 114 -21.337 25.507 8.784 1.00 0.00 C ATOM 1742 CG ASP A 114 -22.023 26.618 8.013 1.00 0.00 C ATOM 1743 OD1 ASP A 114 -21.881 26.654 6.772 1.00 0.00 O ATOM 1744 OD2 ASP A 114 -22.701 27.451 8.646 1.00 0.00 O ATOM 0 H ASP A 114 -18.779 24.348 9.996 1.00 0.00 H new ATOM 0 HA ASP A 114 -19.591 25.613 7.542 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -21.729 24.545 8.454 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -21.576 25.603 9.843 1.00 0.00 H new ATOM 1749 N ASP A 115 -19.617 27.922 8.918 1.00 0.00 N ATOM 1750 CA ASP A 115 -19.097 29.156 9.499 1.00 0.00 C ATOM 1751 C ASP A 115 -19.899 29.616 10.717 1.00 0.00 C ATOM 1752 O ASP A 115 -19.508 30.569 11.391 1.00 0.00 O ATOM 1753 CB ASP A 115 -19.080 30.266 8.447 1.00 0.00 C ATOM 1754 CG ASP A 115 -20.453 30.530 7.858 1.00 0.00 C ATOM 1755 OD1 ASP A 115 -21.372 30.888 8.625 1.00 0.00 O ATOM 1756 OD2 ASP A 115 -20.609 30.379 6.628 1.00 0.00 O ATOM 0 H ASP A 115 -20.315 28.064 8.188 1.00 0.00 H new ATOM 0 HA ASP A 115 -18.082 28.945 9.837 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -18.699 31.183 8.897 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -18.391 29.993 7.647 1.00 0.00 H new ATOM 1761 N ILE A 116 -21.027 28.967 10.989 1.00 0.00 N ATOM 1762 CA ILE A 116 -21.860 29.365 12.119 1.00 0.00 C ATOM 1763 C ILE A 116 -21.457 28.662 13.423 1.00 0.00 C ATOM 1764 O ILE A 116 -21.026 29.316 14.373 1.00 0.00 O ATOM 1765 CB ILE A 116 -23.363 29.126 11.829 1.00 0.00 C ATOM 1766 CG1 ILE A 116 -24.217 29.541 13.030 1.00 0.00 C ATOM 1767 CG2 ILE A 116 -23.628 27.674 11.456 1.00 0.00 C ATOM 1768 CD1 ILE A 116 -24.128 31.019 13.353 1.00 0.00 C ATOM 0 H ILE A 116 -21.381 28.175 10.452 1.00 0.00 H new ATOM 0 HA ILE A 116 -21.695 30.434 12.255 1.00 0.00 H new ATOM 0 HB ILE A 116 -23.642 29.746 10.977 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -25.257 29.282 12.833 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -23.906 28.967 13.903 1.00 0.00 H new ATOM 0 HG21 ILE A 116 -24.691 27.537 11.258 1.00 0.00 H new ATOM 0 HG22 ILE A 116 -23.057 27.418 10.564 1.00 0.00 H new ATOM 0 HG23 ILE A 116 -23.326 27.026 12.279 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -24.758 31.242 14.214 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -23.095 31.280 13.582 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -24.467 31.600 12.495 1.00 0.00 H new ATOM 1780 N HIS A 117 -21.608 27.340 13.476 1.00 0.00 N ATOM 1781 CA HIS A 117 -21.269 26.578 14.678 1.00 0.00 C ATOM 1782 C HIS A 117 -19.835 26.054 14.637 1.00 0.00 C ATOM 1783 O HIS A 117 -18.989 26.458 15.434 1.00 0.00 O ATOM 1784 CB HIS A 117 -22.247 25.413 14.854 1.00 0.00 C ATOM 1785 CG HIS A 117 -22.134 24.714 16.176 1.00 0.00 C ATOM 1786 ND1 HIS A 117 -22.920 23.635 16.522 1.00 0.00 N ATOM 1787 CD2 HIS A 117 -21.328 24.944 17.241 1.00 0.00 C ATOM 1788 CE1 HIS A 117 -22.602 23.233 17.740 1.00 0.00 C ATOM 1789 NE2 HIS A 117 -21.639 24.010 18.198 1.00 0.00 N ATOM 0 H HIS A 117 -21.962 26.775 12.704 1.00 0.00 H new ATOM 0 HA HIS A 117 -21.348 27.254 15.529 1.00 0.00 H new ATOM 0 HB2 HIS A 117 -23.265 25.786 14.738 1.00 0.00 H new ATOM 0 HB3 HIS A 117 -22.080 24.689 14.057 1.00 0.00 H new ATOM 0 HD2 HIS A 117 -20.580 25.719 17.322 1.00 0.00 H new ATOM 0 HE1 HIS A 117 -23.054 22.408 18.271 1.00 0.00 H new ATOM 0 HE2 HIS A 117 -21.197 23.930 19.114 1.00 0.00 H new ATOM 1798 N ILE A 118 -19.587 25.128 13.716 1.00 0.00 N ATOM 1799 CA ILE A 118 -18.276 24.504 13.563 1.00 0.00 C ATOM 1800 C ILE A 118 -17.160 25.546 13.483 1.00 0.00 C ATOM 1801 O ILE A 118 -15.997 25.245 13.755 1.00 0.00 O ATOM 1802 CB ILE A 118 -18.227 23.586 12.318 1.00 0.00 C ATOM 1803 CG1 ILE A 118 -19.314 22.507 12.392 1.00 0.00 C ATOM 1804 CG2 ILE A 118 -16.862 22.931 12.188 1.00 0.00 C ATOM 1805 CD1 ILE A 118 -20.692 22.976 11.976 1.00 0.00 C ATOM 0 H ILE A 118 -20.287 24.789 13.056 1.00 0.00 H new ATOM 0 HA ILE A 118 -18.115 23.894 14.452 1.00 0.00 H new ATOM 0 HB ILE A 118 -18.408 24.206 11.440 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -19.022 21.670 11.757 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -19.365 22.130 13.413 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -16.849 22.290 11.307 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -16.097 23.701 12.088 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -16.660 22.332 13.076 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -21.398 22.150 12.059 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -21.010 23.792 12.625 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -20.661 23.325 10.944 1.00 0.00 H new ATOM 1817 N ASP A 119 -17.518 26.774 13.133 1.00 0.00 N ATOM 1818 CA ASP A 119 -16.542 27.854 13.050 1.00 0.00 C ATOM 1819 C ASP A 119 -16.186 28.325 14.451 1.00 0.00 C ATOM 1820 O ASP A 119 -15.012 28.371 14.822 1.00 0.00 O ATOM 1821 CB ASP A 119 -17.085 29.019 12.224 1.00 0.00 C ATOM 1822 CG ASP A 119 -16.081 30.147 12.077 1.00 0.00 C ATOM 1823 OD1 ASP A 119 -15.685 30.732 13.107 1.00 0.00 O ATOM 1824 OD2 ASP A 119 -15.689 30.445 10.929 1.00 0.00 O ATOM 0 H ASP A 119 -18.473 27.047 12.903 1.00 0.00 H new ATOM 0 HA ASP A 119 -15.647 27.479 12.554 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -17.368 28.658 11.235 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -17.990 29.402 12.694 1.00 0.00 H new ATOM 1829 N ASP A 120 -17.212 28.645 15.238 1.00 0.00 N ATOM 1830 CA ASP A 120 -17.005 29.077 16.612 1.00 0.00 C ATOM 1831 C ASP A 120 -16.275 27.977 17.368 1.00 0.00 C ATOM 1832 O ASP A 120 -15.656 28.216 18.400 1.00 0.00 O ATOM 1833 CB ASP A 120 -18.342 29.388 17.287 1.00 0.00 C ATOM 1834 CG ASP A 120 -18.170 29.874 18.712 1.00 0.00 C ATOM 1835 OD1 ASP A 120 -17.529 30.928 18.907 1.00 0.00 O ATOM 1836 OD2 ASP A 120 -18.675 29.200 19.635 1.00 0.00 O ATOM 0 H ASP A 120 -18.189 28.612 14.946 1.00 0.00 H new ATOM 0 HA ASP A 120 -16.407 29.988 16.619 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -18.870 30.146 16.709 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -18.964 28.493 17.284 1.00 0.00 H new ATOM 1841 N MET A 121 -16.350 26.773 16.806 1.00 0.00 N ATOM 1842 CA MET A 121 -15.706 25.596 17.348 1.00 0.00 C ATOM 1843 C MET A 121 -14.193 25.716 17.219 1.00 0.00 C ATOM 1844 O MET A 121 -13.464 25.471 18.168 1.00 0.00 O ATOM 1845 CB MET A 121 -16.213 24.368 16.609 1.00 0.00 C ATOM 1846 CG MET A 121 -15.203 23.248 16.548 1.00 0.00 C ATOM 1847 SD MET A 121 -15.866 21.750 15.803 1.00 0.00 S ATOM 1848 CE MET A 121 -14.389 21.104 15.028 1.00 0.00 C ATOM 0 H MET A 121 -16.870 26.593 15.947 1.00 0.00 H new ATOM 0 HA MET A 121 -15.947 25.501 18.407 1.00 0.00 H new ATOM 0 HB2 MET A 121 -17.117 24.006 17.098 1.00 0.00 H new ATOM 0 HB3 MET A 121 -16.491 24.652 15.594 1.00 0.00 H new ATOM 0 HG2 MET A 121 -14.335 23.578 15.977 1.00 0.00 H new ATOM 0 HG3 MET A 121 -14.855 23.023 17.556 1.00 0.00 H new ATOM 0 HE1 MET A 121 -14.627 20.759 14.022 1.00 0.00 H new ATOM 0 HE2 MET A 121 -13.634 21.888 14.973 1.00 0.00 H new ATOM 0 HE3 MET A 121 -14.004 20.271 15.616 1.00 0.00 H new ATOM 1858 N ILE A 122 -13.740 26.141 16.048 1.00 0.00 N ATOM 1859 CA ILE A 122 -12.320 26.363 15.800 1.00 0.00 C ATOM 1860 C ILE A 122 -11.794 27.238 16.898 1.00 0.00 C ATOM 1861 O ILE A 122 -10.707 27.030 17.431 1.00 0.00 O ATOM 1862 CB ILE A 122 -12.156 27.105 14.470 1.00 0.00 C ATOM 1863 CG1 ILE A 122 -12.889 26.365 13.361 1.00 0.00 C ATOM 1864 CG2 ILE A 122 -10.696 27.301 14.127 1.00 0.00 C ATOM 1865 CD1 ILE A 122 -12.844 27.070 12.021 1.00 0.00 C ATOM 0 H ILE A 122 -14.340 26.341 15.248 1.00 0.00 H new ATOM 0 HA ILE A 122 -11.785 25.414 15.765 1.00 0.00 H new ATOM 0 HB ILE A 122 -12.599 28.095 14.573 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -12.456 25.371 13.252 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -13.930 26.229 13.654 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -10.613 27.830 13.178 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -10.213 27.884 14.911 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -10.208 26.330 14.045 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -13.388 26.482 11.282 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -13.304 28.054 12.112 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -11.807 27.182 11.704 1.00 0.00 H new ATOM 1877 N LYS A 123 -12.614 28.209 17.233 1.00 0.00 N ATOM 1878 CA LYS A 123 -12.304 29.146 18.285 1.00 0.00 C ATOM 1879 C LYS A 123 -12.746 28.590 19.635 1.00 0.00 C ATOM 1880 O LYS A 123 -12.354 29.089 20.690 1.00 0.00 O ATOM 1881 CB LYS A 123 -12.966 30.488 17.995 1.00 0.00 C ATOM 1882 CG LYS A 123 -12.311 31.233 16.844 1.00 0.00 C ATOM 1883 CD LYS A 123 -12.621 30.586 15.503 1.00 0.00 C ATOM 1884 CE LYS A 123 -11.432 30.667 14.558 1.00 0.00 C ATOM 1885 NZ LYS A 123 -10.945 32.062 14.386 1.00 0.00 N ATOM 0 H LYS A 123 -13.515 28.370 16.782 1.00 0.00 H new ATOM 0 HA LYS A 123 -11.226 29.299 18.325 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -14.019 30.326 17.764 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -12.928 31.108 18.891 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -12.656 32.267 16.837 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -11.232 31.258 16.995 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -12.895 29.542 15.656 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -13.481 31.079 15.050 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -10.622 30.046 14.941 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -11.714 30.260 13.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -10.277 32.101 13.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -11.751 32.690 14.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -10.466 32.372 15.255 1.00 0.00 H new ATOM 1899 N GLU A 124 -13.562 27.539 19.580 1.00 0.00 N ATOM 1900 CA GLU A 124 -14.068 26.881 20.779 1.00 0.00 C ATOM 1901 C GLU A 124 -13.055 25.866 21.299 1.00 0.00 C ATOM 1902 O GLU A 124 -13.071 25.496 22.474 1.00 0.00 O ATOM 1903 CB GLU A 124 -15.398 26.180 20.499 1.00 0.00 C ATOM 1904 CG GLU A 124 -15.985 25.465 21.707 1.00 0.00 C ATOM 1905 CD GLU A 124 -16.365 26.411 22.832 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -16.189 27.637 22.668 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -16.842 25.924 23.879 1.00 0.00 O ATOM 0 H GLU A 124 -13.888 27.123 18.708 1.00 0.00 H new ATOM 0 HA GLU A 124 -14.229 27.648 21.537 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -16.117 26.916 20.140 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -15.254 25.457 19.696 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -16.868 24.905 21.397 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -15.262 24.739 22.079 1.00 0.00 H new ATOM 1914 N ILE A 125 -12.166 25.432 20.411 1.00 0.00 N ATOM 1915 CA ILE A 125 -11.132 24.475 20.757 1.00 0.00 C ATOM 1916 C ILE A 125 -9.808 25.209 20.847 1.00 0.00 C ATOM 1917 O ILE A 125 -8.957 24.889 21.674 1.00 0.00 O ATOM 1918 CB ILE A 125 -11.039 23.348 19.711 1.00 0.00 C ATOM 1919 CG1 ILE A 125 -12.423 23.056 19.121 1.00 0.00 C ATOM 1920 CG2 ILE A 125 -10.452 22.098 20.343 1.00 0.00 C ATOM 1921 CD1 ILE A 125 -12.518 21.738 18.380 1.00 0.00 C ATOM 0 H ILE A 125 -12.145 25.735 19.437 1.00 0.00 H new ATOM 0 HA ILE A 125 -11.378 24.015 21.714 1.00 0.00 H new ATOM 0 HB ILE A 125 -10.382 23.669 18.902 1.00 0.00 H new ATOM 0 HG12 ILE A 125 -13.157 23.060 19.927 1.00 0.00 H new ATOM 0 HG13 ILE A 125 -12.693 23.863 18.440 1.00 0.00 H new ATOM 0 HG21 ILE A 125 -10.390 21.307 19.596 1.00 0.00 H new ATOM 0 HG22 ILE A 125 -9.454 22.317 20.723 1.00 0.00 H new ATOM 0 HG23 ILE A 125 -11.090 21.772 21.165 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -13.529 21.609 17.995 1.00 0.00 H new ATOM 0 HD12 ILE A 125 -11.811 21.735 17.551 1.00 0.00 H new ATOM 0 HD13 ILE A 125 -12.282 20.920 19.061 1.00 0.00 H new ATOM 1933 N ASP A 126 -9.669 26.224 19.997 1.00 0.00 N ATOM 1934 CA ASP A 126 -8.473 27.050 19.969 1.00 0.00 C ATOM 1935 C ASP A 126 -8.185 27.625 21.339 1.00 0.00 C ATOM 1936 O ASP A 126 -8.737 28.653 21.728 1.00 0.00 O ATOM 1937 CB ASP A 126 -8.640 28.190 18.979 1.00 0.00 C ATOM 1938 CG ASP A 126 -7.473 29.152 19.013 1.00 0.00 C ATOM 1939 OD1 ASP A 126 -6.328 28.692 18.838 1.00 0.00 O ATOM 1940 OD2 ASP A 126 -7.704 30.363 19.214 1.00 0.00 O ATOM 0 H ASP A 126 -10.378 26.492 19.315 1.00 0.00 H new ATOM 0 HA ASP A 126 -7.639 26.418 19.663 1.00 0.00 H new ATOM 0 HB2 ASP A 126 -8.744 27.783 17.973 1.00 0.00 H new ATOM 0 HB3 ASP A 126 -9.560 28.730 19.201 1.00 0.00 H new ATOM 1945 N GLN A 127 -7.324 26.947 22.065 1.00 0.00 N ATOM 1946 CA GLN A 127 -6.960 27.370 23.398 1.00 0.00 C ATOM 1947 C GLN A 127 -5.798 28.351 23.392 1.00 0.00 C ATOM 1948 O GLN A 127 -5.463 28.902 24.437 1.00 0.00 O ATOM 1949 CB GLN A 127 -6.580 26.156 24.235 1.00 0.00 C ATOM 1950 CG GLN A 127 -7.735 25.219 24.526 1.00 0.00 C ATOM 1951 CD GLN A 127 -7.265 23.869 25.026 1.00 0.00 C ATOM 1952 OE1 GLN A 127 -7.998 23.159 25.709 1.00 0.00 O ATOM 1953 NE2 GLN A 127 -6.045 23.492 24.655 1.00 0.00 N ATOM 0 H GLN A 127 -6.860 26.094 21.751 1.00 0.00 H new ATOM 0 HA GLN A 127 -7.826 27.876 23.826 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -5.798 25.601 23.717 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -6.156 26.497 25.179 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -8.390 25.672 25.270 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -8.327 25.083 23.621 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -5.470 24.114 24.087 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -5.685 22.581 24.938 1.00 0.00 H new ATOM 1962 N ASP A 128 -5.139 28.546 22.247 1.00 0.00 N ATOM 1963 CA ASP A 128 -3.984 29.436 22.243 1.00 0.00 C ATOM 1964 C ASP A 128 -4.010 30.560 21.198 1.00 0.00 C ATOM 1965 O ASP A 128 -3.501 31.645 21.487 1.00 0.00 O ATOM 1966 CB ASP A 128 -2.730 28.587 22.029 1.00 0.00 C ATOM 1967 CG ASP A 128 -1.454 29.403 22.010 1.00 0.00 C ATOM 1968 OD1 ASP A 128 -1.286 30.232 21.093 1.00 0.00 O ATOM 1969 OD2 ASP A 128 -0.619 29.210 22.917 1.00 0.00 O ATOM 0 H ASP A 128 -5.373 28.120 21.350 1.00 0.00 H new ATOM 0 HA ASP A 128 -3.997 29.946 23.206 1.00 0.00 H new ATOM 0 HB2 ASP A 128 -2.665 27.841 22.821 1.00 0.00 H new ATOM 0 HB3 ASP A 128 -2.822 28.046 21.087 1.00 0.00 H new ATOM 1974 N ASN A 129 -4.602 30.356 20.010 1.00 0.00 N ATOM 1975 CA ASN A 129 -4.633 31.460 19.029 1.00 0.00 C ATOM 1976 C ASN A 129 -5.287 31.171 17.664 1.00 0.00 C ATOM 1977 O ASN A 129 -6.277 31.795 17.278 1.00 0.00 O ATOM 1978 CB ASN A 129 -3.214 32.000 18.787 1.00 0.00 C ATOM 1979 CG ASN A 129 -2.174 30.924 18.493 1.00 0.00 C ATOM 1980 OD1 ASN A 129 -2.565 29.653 18.553 1.00 0.00 O flip ATOM 1981 ND2 ASN A 129 -1.016 31.238 18.217 1.00 0.00 N flip ATOM 0 H ASN A 129 -5.045 29.487 19.712 1.00 0.00 H new ATOM 0 HA ASN A 129 -5.285 32.193 19.505 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -3.242 32.700 17.952 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -2.898 32.564 19.665 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -0.750 32.222 18.179 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -0.323 30.514 18.026 1.00 0.00 H new ATOM 1988 N ASP A 130 -4.605 30.323 16.899 1.00 0.00 N ATOM 1989 CA ASP A 130 -4.932 30.012 15.502 1.00 0.00 C ATOM 1990 C ASP A 130 -6.272 29.326 15.218 1.00 0.00 C ATOM 1991 O ASP A 130 -6.747 29.392 14.083 1.00 0.00 O ATOM 1992 CB ASP A 130 -3.806 29.115 14.971 1.00 0.00 C ATOM 1993 CG ASP A 130 -4.006 28.681 13.535 1.00 0.00 C ATOM 1994 OD1 ASP A 130 -4.918 27.868 13.277 1.00 0.00 O ATOM 1995 OD2 ASP A 130 -3.247 29.154 12.662 1.00 0.00 O ATOM 0 H ASP A 130 -3.787 29.817 17.239 1.00 0.00 H new ATOM 0 HA ASP A 130 -5.028 30.978 15.007 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -2.859 29.648 15.053 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -3.729 28.230 15.602 1.00 0.00 H new ATOM 2000 N GLY A 131 -6.857 28.618 16.163 1.00 0.00 N ATOM 2001 CA GLY A 131 -8.067 27.908 15.840 1.00 0.00 C ATOM 2002 C GLY A 131 -7.675 26.507 15.479 1.00 0.00 C ATOM 2003 O GLY A 131 -8.195 25.888 14.546 1.00 0.00 O ATOM 0 H GLY A 131 -6.527 28.523 17.123 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -8.752 27.910 16.688 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -8.585 28.389 15.010 1.00 0.00 H new ATOM 2007 N GLN A 132 -6.675 26.050 16.210 1.00 0.00 N ATOM 2008 CA GLN A 132 -6.081 24.779 16.023 1.00 0.00 C ATOM 2009 C GLN A 132 -5.827 24.158 17.366 1.00 0.00 C ATOM 2010 O GLN A 132 -5.917 24.826 18.396 1.00 0.00 O ATOM 2011 CB GLN A 132 -4.757 24.935 15.337 1.00 0.00 C ATOM 2012 CG GLN A 132 -3.727 25.589 16.235 1.00 0.00 C ATOM 2013 CD GLN A 132 -2.307 25.184 15.905 1.00 0.00 C ATOM 2014 OE1 GLN A 132 -1.791 25.486 14.828 1.00 0.00 O ATOM 2015 NE2 GLN A 132 -1.671 24.484 16.837 1.00 0.00 N ATOM 0 H GLN A 132 -6.255 26.586 16.969 1.00 0.00 H new ATOM 0 HA GLN A 132 -6.747 24.159 15.423 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -4.394 23.957 15.022 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -4.884 25.534 14.435 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -3.818 26.672 16.153 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -3.941 25.329 17.272 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -2.140 24.258 17.714 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -0.713 24.172 16.676 1.00 0.00 H new ATOM 2024 N ILE A 133 -5.509 22.892 17.355 1.00 0.00 N ATOM 2025 CA ILE A 133 -5.246 22.191 18.554 1.00 0.00 C ATOM 2026 C ILE A 133 -3.957 21.415 18.454 1.00 0.00 C ATOM 2027 O ILE A 133 -3.711 20.692 17.495 1.00 0.00 O ATOM 2028 CB ILE A 133 -6.428 21.295 18.850 1.00 0.00 C ATOM 2029 CG1 ILE A 133 -7.585 22.198 19.253 1.00 0.00 C ATOM 2030 CG2 ILE A 133 -6.092 20.287 19.930 1.00 0.00 C ATOM 2031 CD1 ILE A 133 -7.358 22.874 20.583 1.00 0.00 C ATOM 0 H ILE A 133 -5.428 22.329 16.508 1.00 0.00 H new ATOM 0 HA ILE A 133 -5.117 22.892 19.379 1.00 0.00 H new ATOM 0 HB ILE A 133 -6.701 20.710 17.972 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -7.733 22.957 18.485 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -8.501 21.609 19.301 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -6.960 19.656 20.122 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -5.258 19.666 19.602 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -5.816 20.812 20.844 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -8.214 23.506 20.821 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -7.238 22.118 21.359 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -6.458 23.487 20.531 1.00 0.00 H new ATOM 2043 N ASP A 134 -3.142 21.582 19.464 1.00 0.00 N ATOM 2044 CA ASP A 134 -1.854 20.916 19.527 1.00 0.00 C ATOM 2045 C ASP A 134 -1.931 19.745 20.486 1.00 0.00 C ATOM 2046 O ASP A 134 -2.849 19.658 21.295 1.00 0.00 O ATOM 2047 CB ASP A 134 -0.786 21.901 20.006 1.00 0.00 C ATOM 2048 CG ASP A 134 0.623 21.338 19.957 1.00 0.00 C ATOM 2049 OD1 ASP A 134 0.934 20.433 20.758 1.00 0.00 O ATOM 2050 OD2 ASP A 134 1.417 21.803 19.112 1.00 0.00 O ATOM 0 H ASP A 134 -3.346 22.179 20.265 1.00 0.00 H new ATOM 0 HA ASP A 134 -1.590 20.553 18.534 1.00 0.00 H new ATOM 0 HB2 ASP A 134 -0.831 22.800 19.392 1.00 0.00 H new ATOM 0 HB3 ASP A 134 -1.013 22.202 21.029 1.00 0.00 H new ATOM 2055 N TYR A 135 -0.965 18.854 20.386 1.00 0.00 N ATOM 2056 CA TYR A 135 -0.911 17.683 21.244 1.00 0.00 C ATOM 2057 C TYR A 135 -1.218 18.042 22.686 1.00 0.00 C ATOM 2058 O TYR A 135 -1.888 17.287 23.391 1.00 0.00 O ATOM 2059 CB TYR A 135 0.456 17.036 21.125 1.00 0.00 C ATOM 2060 CG TYR A 135 0.808 16.097 22.258 1.00 0.00 C ATOM 2061 CD1 TYR A 135 0.128 14.894 22.429 1.00 0.00 C ATOM 2062 CD2 TYR A 135 1.822 16.409 23.154 1.00 0.00 C ATOM 2063 CE1 TYR A 135 0.450 14.035 23.461 1.00 0.00 C ATOM 2064 CE2 TYR A 135 2.149 15.553 24.189 1.00 0.00 C ATOM 2065 CZ TYR A 135 1.459 14.368 24.338 1.00 0.00 C ATOM 2066 OH TYR A 135 1.781 13.515 25.367 1.00 0.00 O ATOM 0 H TYR A 135 -0.200 18.918 19.714 1.00 0.00 H new ATOM 0 HA TYR A 135 -1.673 16.974 20.920 1.00 0.00 H new ATOM 0 HB2 TYR A 135 0.502 16.485 20.186 1.00 0.00 H new ATOM 0 HB3 TYR A 135 1.211 17.820 21.072 1.00 0.00 H new ATOM 0 HD1 TYR A 135 -0.664 14.629 21.744 1.00 0.00 H new ATOM 0 HD2 TYR A 135 2.364 17.336 23.040 1.00 0.00 H new ATOM 0 HE1 TYR A 135 -0.087 13.106 23.580 1.00 0.00 H new ATOM 0 HE2 TYR A 135 2.940 15.811 24.877 1.00 0.00 H new ATOM 0 HH TYR A 135 2.514 13.898 25.892 1.00 0.00 H new ATOM 2076 N GLY A 136 -0.753 19.206 23.118 1.00 0.00 N ATOM 2077 CA GLY A 136 -1.027 19.634 24.466 1.00 0.00 C ATOM 2078 C GLY A 136 -2.395 20.261 24.562 1.00 0.00 C ATOM 2079 O GLY A 136 -3.100 20.088 25.558 1.00 0.00 O ATOM 0 H GLY A 136 -0.196 19.854 22.561 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -0.965 18.782 25.143 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -0.270 20.351 24.786 1.00 0.00 H new ATOM 2083 N GLU A 137 -2.781 20.979 23.511 1.00 0.00 N ATOM 2084 CA GLU A 137 -4.085 21.617 23.470 1.00 0.00 C ATOM 2085 C GLU A 137 -5.184 20.571 23.558 1.00 0.00 C ATOM 2086 O GLU A 137 -6.017 20.625 24.461 1.00 0.00 O ATOM 2087 CB GLU A 137 -4.256 22.455 22.203 1.00 0.00 C ATOM 2088 CG GLU A 137 -3.451 23.745 22.207 1.00 0.00 C ATOM 2089 CD GLU A 137 -3.644 24.563 20.944 1.00 0.00 C ATOM 2090 OE1 GLU A 137 -4.786 24.999 20.689 1.00 0.00 O ATOM 2091 OE2 GLU A 137 -2.655 24.768 20.209 1.00 0.00 O ATOM 0 H GLU A 137 -2.208 21.131 22.681 1.00 0.00 H new ATOM 0 HA GLU A 137 -4.158 22.286 24.328 1.00 0.00 H new ATOM 0 HB2 GLU A 137 -3.962 21.857 21.341 1.00 0.00 H new ATOM 0 HB3 GLU A 137 -5.312 22.697 22.078 1.00 0.00 H new ATOM 0 HG2 GLU A 137 -3.739 24.345 23.070 1.00 0.00 H new ATOM 0 HG3 GLU A 137 -2.393 23.507 22.322 1.00 0.00 H new ATOM 2098 N PHE A 138 -5.194 19.612 22.625 1.00 0.00 N ATOM 2099 CA PHE A 138 -6.217 18.575 22.653 1.00 0.00 C ATOM 2100 C PHE A 138 -6.209 17.876 24.003 1.00 0.00 C ATOM 2101 O PHE A 138 -7.256 17.520 24.544 1.00 0.00 O ATOM 2102 CB PHE A 138 -6.023 17.508 21.563 1.00 0.00 C ATOM 2103 CG PHE A 138 -7.338 16.935 21.140 1.00 0.00 C ATOM 2104 CD1 PHE A 138 -8.331 17.752 20.609 1.00 0.00 C ATOM 2105 CD2 PHE A 138 -7.593 15.590 21.295 1.00 0.00 C ATOM 2106 CE1 PHE A 138 -9.550 17.222 20.238 1.00 0.00 C ATOM 2107 CE2 PHE A 138 -8.809 15.057 20.928 1.00 0.00 C ATOM 2108 CZ PHE A 138 -9.790 15.872 20.397 1.00 0.00 C ATOM 0 H PHE A 138 -4.521 19.537 21.862 1.00 0.00 H new ATOM 0 HA PHE A 138 -7.166 19.078 22.471 1.00 0.00 H new ATOM 0 HB2 PHE A 138 -5.519 17.948 20.702 1.00 0.00 H new ATOM 0 HB3 PHE A 138 -5.378 16.713 21.937 1.00 0.00 H new ATOM 0 HD1 PHE A 138 -8.146 18.809 20.486 1.00 0.00 H new ATOM 0 HD2 PHE A 138 -6.831 14.946 21.709 1.00 0.00 H new ATOM 0 HE1 PHE A 138 -10.315 17.862 19.824 1.00 0.00 H new ATOM 0 HE2 PHE A 138 -8.996 14.001 21.055 1.00 0.00 H new ATOM 0 HZ PHE A 138 -10.743 15.454 20.107 1.00 0.00 H new ATOM 2118 N ALA A 139 -5.009 17.663 24.522 1.00 0.00 N ATOM 2119 CA ALA A 139 -4.831 16.981 25.793 1.00 0.00 C ATOM 2120 C ALA A 139 -5.407 17.789 26.956 1.00 0.00 C ATOM 2121 O ALA A 139 -5.761 17.231 27.995 1.00 0.00 O ATOM 2122 CB ALA A 139 -3.354 16.690 26.014 1.00 0.00 C ATOM 0 H ALA A 139 -4.139 17.956 24.078 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.381 16.041 25.756 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -3.223 16.179 26.968 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -2.983 16.056 25.208 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -2.796 17.626 26.025 1.00 0.00 H new ATOM 2128 N ALA A 140 -5.489 19.104 26.780 1.00 0.00 N ATOM 2129 CA ALA A 140 -6.012 19.988 27.817 1.00 0.00 C ATOM 2130 C ALA A 140 -7.525 20.174 27.710 1.00 0.00 C ATOM 2131 O ALA A 140 -8.233 20.141 28.717 1.00 0.00 O ATOM 2132 CB ALA A 140 -5.311 21.337 27.754 1.00 0.00 C ATOM 0 H ALA A 140 -5.199 19.582 25.927 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.812 19.517 28.779 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.708 21.990 28.531 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.241 21.198 27.908 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -5.482 21.790 26.778 1.00 0.00 H new ATOM 2138 N MET A 141 -8.017 20.394 26.492 1.00 0.00 N ATOM 2139 CA MET A 141 -9.441 20.612 26.269 1.00 0.00 C ATOM 2140 C MET A 141 -10.269 19.417 26.740 1.00 0.00 C ATOM 2141 O MET A 141 -11.407 19.579 27.183 1.00 0.00 O ATOM 2142 CB MET A 141 -9.700 20.916 24.786 1.00 0.00 C ATOM 2143 CG MET A 141 -9.924 19.697 23.904 1.00 0.00 C ATOM 2144 SD MET A 141 -11.612 19.068 24.001 1.00 0.00 S ATOM 2145 CE MET A 141 -11.628 17.927 22.622 1.00 0.00 C ATOM 0 H MET A 141 -7.449 20.426 25.646 1.00 0.00 H new ATOM 0 HA MET A 141 -9.753 21.472 26.861 1.00 0.00 H new ATOM 0 HB2 MET A 141 -10.574 21.564 24.712 1.00 0.00 H new ATOM 0 HB3 MET A 141 -8.852 21.478 24.393 1.00 0.00 H new ATOM 0 HG2 MET A 141 -9.696 19.955 22.870 1.00 0.00 H new ATOM 0 HG3 MET A 141 -9.230 18.909 24.197 1.00 0.00 H new ATOM 0 HE1 MET A 141 -12.547 17.341 22.645 1.00 0.00 H new ATOM 0 HE2 MET A 141 -11.577 18.485 21.687 1.00 0.00 H new ATOM 0 HE3 MET A 141 -10.770 17.259 22.693 1.00 0.00 H new ATOM 2155 N MET A 142 -9.691 18.222 26.655 1.00 0.00 N ATOM 2156 CA MET A 142 -10.384 17.012 27.089 1.00 0.00 C ATOM 2157 C MET A 142 -10.165 16.787 28.581 1.00 0.00 C ATOM 2158 O MET A 142 -11.001 16.194 29.263 1.00 0.00 O ATOM 2159 CB MET A 142 -9.896 15.797 26.297 1.00 0.00 C ATOM 2160 CG MET A 142 -10.651 14.518 26.624 1.00 0.00 C ATOM 2161 SD MET A 142 -10.022 13.088 25.725 1.00 0.00 S ATOM 2162 CE MET A 142 -8.345 13.006 26.350 1.00 0.00 C ATOM 0 H MET A 142 -8.751 18.065 26.292 1.00 0.00 H new ATOM 0 HA MET A 142 -11.450 17.141 26.903 1.00 0.00 H new ATOM 0 HB2 MET A 142 -9.993 16.005 25.231 1.00 0.00 H new ATOM 0 HB3 MET A 142 -8.835 15.645 26.497 1.00 0.00 H new ATOM 0 HG2 MET A 142 -10.585 14.326 27.695 1.00 0.00 H new ATOM 0 HG3 MET A 142 -11.707 14.654 26.389 1.00 0.00 H new ATOM 0 HE1 MET A 142 -7.955 11.997 26.214 1.00 0.00 H new ATOM 0 HE2 MET A 142 -7.719 13.714 25.806 1.00 0.00 H new ATOM 0 HE3 MET A 142 -8.339 13.257 27.411 1.00 0.00 H new