USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 827 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 151 SER OG : rot 95:sc= 0.52 USER MOD Set 1.2: A 154 THR OG1 : rot 156:sc= -0.379 USER MOD Set 2.1: A 16 HIS : no HD1:sc= -6.28! C(o=-18!,f=-18!) USER MOD Set 2.2: A 19 HIS : no HD1:sc= -8.03! C(o=-18!,f=-29!) USER MOD Set 2.3: A 93 MET CE :methyl -154:sc= -0.0845 (180deg=-0.558) USER MOD Set 2.4: A 96 THR OG1 : rot -166:sc= -3.17! USER MOD Single : A 12 THR OG1 : rot 27:sc= 0.42 USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 GLN :FLIP amide:sc= -0.484 F(o=-2.1,f=-0.48) USER MOD Single : A 101 ASN : amide:sc= -2.73! C(o=-2.7!,f=-2.7!) USER MOD Single : A 102 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.003) USER MOD Single : A 104 LYS NZ :NH3+ -111:sc= 0.845 (180deg=0.16) USER MOD Single : A 107 ASN : amide:sc=-0.00126 K(o=-0.0013,f=-0.83) USER MOD Single : A 115 ASN : amide:sc= -4.64! C(o=-4.6!,f=-12!) USER MOD Single : A 116 LYS NZ :NH3+ -150:sc= 0.515 (180deg=-0.117) USER MOD Single : A 117 MET CE :methyl -114:sc= -2.12 (180deg=-6.24!) USER MOD Single : A 119 LYS NZ :NH3+ -140:sc= 1.21 (180deg=0.249) USER MOD Single : A 123 ASN :FLIP amide:sc= -1.01 F(o=-5.4!,f=-1) USER MOD Single : A 128 MET CE :methyl -118:sc= -3.87! (180deg=-9.62!) USER MOD Single : A 129 GLN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 132 MET CE :methyl -147:sc= -0.2 (180deg=-1.35!) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.0948 USER MOD Single : A 135 ASN : amide:sc= -0.154 K(o=-0.15,f=-1.3) USER MOD Single : A 145 THR OG1 : rot -10:sc= 0.238 USER MOD Single : A 148 CYS SG : rot 100:sc= -1.89 USER MOD Single : A 149 LYS NZ :NH3+ -178:sc= 1.25 (180deg=1.19) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ -166:sc= 1.25 (180deg=1.08) USER MOD Single : A 160 HIS : no HD1:sc=-0.00202 X(o=-0.002,f=-0.0023) USER MOD Single : A 164 MET CE :methyl 140:sc= -2.99! (180deg=-5.63!) USER MOD ----------------------------------------------------------------- ATOM 171 N THR A 12 -11.930 -3.462 -0.890 1.00 0.44 N ATOM 172 CA THR A 12 -11.633 -4.278 0.278 1.00 0.45 C ATOM 173 C THR A 12 -10.669 -3.547 1.210 1.00 0.41 C ATOM 174 O THR A 12 -9.748 -2.880 0.749 1.00 0.50 O ATOM 175 CB THR A 12 -10.999 -5.608 -0.155 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.656 -6.096 -1.330 1.00 0.61 O ATOM 177 CG2 THR A 12 -11.086 -6.646 0.956 1.00 0.64 C ATOM 0 HA THR A 12 -12.567 -4.471 0.805 1.00 0.45 H new ATOM 0 HB THR A 12 -9.946 -5.431 -0.372 1.00 0.54 H new ATOM 0 HG1 THR A 12 -12.027 -5.342 -1.834 1.00 0.61 H new ATOM 0 HG21 THR A 12 -10.629 -7.577 0.621 1.00 0.64 H new ATOM 0 HG22 THR A 12 -10.559 -6.280 1.838 1.00 0.64 H new ATOM 0 HG23 THR A 12 -12.132 -6.824 1.206 1.00 0.64 H new ATOM 185 N ILE A 13 -10.881 -3.660 2.514 1.00 0.40 N ATOM 186 CA ILE A 13 -9.991 -3.018 3.468 1.00 0.40 C ATOM 187 C ILE A 13 -9.215 -4.066 4.270 1.00 0.37 C ATOM 188 O ILE A 13 -9.761 -5.098 4.669 1.00 0.52 O ATOM 189 CB ILE A 13 -10.751 -2.070 4.425 1.00 0.52 C ATOM 190 CG1 ILE A 13 -9.765 -1.188 5.200 1.00 1.15 C ATOM 191 CG2 ILE A 13 -11.615 -2.866 5.390 1.00 1.26 C ATOM 192 CD1 ILE A 13 -10.433 -0.167 6.095 1.00 1.30 C ATOM 0 H ILE A 13 -11.651 -4.183 2.930 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.288 -2.413 2.895 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.399 -1.428 3.828 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -9.122 -1.825 5.808 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -9.121 -0.669 4.490 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -12.142 -2.182 6.055 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -12.339 -3.456 4.828 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -10.984 -3.531 5.979 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -9.672 0.419 6.610 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -11.054 0.495 5.491 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -11.055 -0.679 6.829 1.00 1.30 H new ATOM 204 N MET A 14 -7.936 -3.799 4.470 1.00 0.26 N ATOM 205 CA MET A 14 -7.043 -4.688 5.174 1.00 0.28 C ATOM 206 C MET A 14 -6.006 -3.867 5.925 1.00 0.24 C ATOM 207 O MET A 14 -5.941 -2.652 5.759 1.00 0.29 O ATOM 208 CB MET A 14 -6.332 -5.599 4.183 1.00 0.36 C ATOM 209 CG MET A 14 -7.200 -6.703 3.603 1.00 0.49 C ATOM 210 SD MET A 14 -6.283 -7.771 2.474 1.00 0.79 S ATOM 211 CE MET A 14 -7.565 -8.899 1.957 1.00 0.69 C ATOM 0 H MET A 14 -7.487 -2.944 4.141 1.00 0.26 H new ATOM 0 HA MET A 14 -7.619 -5.293 5.874 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.945 -4.992 3.365 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.473 -6.052 4.678 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.611 -7.303 4.415 1.00 0.49 H new ATOM 0 HG3 MET A 14 -8.044 -6.259 3.075 1.00 0.49 H new ATOM 0 HE1 MET A 14 -7.151 -9.623 1.254 1.00 0.69 H new ATOM 0 HE2 MET A 14 -7.961 -9.423 2.827 1.00 0.69 H new ATOM 0 HE3 MET A 14 -8.367 -8.341 1.473 1.00 0.69 H new ATOM 221 N GLY A 15 -5.197 -4.529 6.737 1.00 0.27 N ATOM 222 CA GLY A 15 -4.138 -3.848 7.436 1.00 0.27 C ATOM 223 C GLY A 15 -3.821 -4.498 8.756 1.00 0.24 C ATOM 224 O GLY A 15 -4.381 -5.545 9.085 1.00 0.31 O ATOM 0 H GLY A 15 -5.259 -5.530 6.922 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.243 -3.836 6.814 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.424 -2.810 7.603 1.00 0.27 H new ATOM 228 N HIS A 16 -2.917 -3.895 9.508 1.00 0.20 N ATOM 229 CA HIS A 16 -2.527 -4.447 10.799 1.00 0.17 C ATOM 230 C HIS A 16 -3.454 -3.974 11.914 1.00 0.19 C ATOM 231 O HIS A 16 -4.190 -2.994 11.780 1.00 0.22 O ATOM 232 CB HIS A 16 -1.081 -4.074 11.139 1.00 0.17 C ATOM 233 CG HIS A 16 -0.526 -4.811 12.324 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.584 -6.186 12.412 1.00 0.16 N ATOM 235 CD2 HIS A 16 0.065 -4.326 13.437 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.033 -6.494 13.578 1.00 0.19 C ATOM 237 NE2 HIS A 16 0.372 -5.401 14.227 1.00 0.22 N ATOM 0 H HIS A 16 -2.441 -3.030 9.252 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.607 -5.531 10.721 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.451 -4.273 10.272 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.028 -3.003 11.332 1.00 0.17 H new ATOM 0 HD2 HIS A 16 0.259 -3.287 13.661 1.00 0.19 H new ATOM 0 HE1 HIS A 16 0.074 -7.501 13.954 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.825 -5.372 15.140 1.00 0.22 H new ATOM 245 N VAL A 17 -3.398 -4.702 13.010 1.00 0.20 N ATOM 246 CA VAL A 17 -4.136 -4.383 14.211 1.00 0.25 C ATOM 247 C VAL A 17 -3.438 -3.269 14.975 1.00 0.26 C ATOM 248 O VAL A 17 -2.224 -3.119 14.879 1.00 0.25 O ATOM 249 CB VAL A 17 -4.246 -5.641 15.084 1.00 0.29 C ATOM 250 CG1 VAL A 17 -2.869 -6.245 15.305 1.00 0.30 C ATOM 251 CG2 VAL A 17 -4.884 -5.366 16.422 1.00 0.36 C ATOM 0 H VAL A 17 -2.829 -5.545 13.091 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.136 -4.041 13.944 1.00 0.25 H new ATOM 0 HB VAL A 17 -4.887 -6.340 14.547 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -2.958 -7.137 15.925 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.431 -6.514 14.344 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.229 -5.518 15.805 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -4.936 -6.290 16.997 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -4.288 -4.633 16.966 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -5.890 -4.975 16.272 1.00 0.36 H new ATOM 261 N ASP A 18 -4.224 -2.479 15.704 1.00 0.31 N ATOM 262 CA ASP A 18 -3.731 -1.308 16.432 1.00 0.36 C ATOM 263 C ASP A 18 -3.436 -0.176 15.455 1.00 0.34 C ATOM 264 O ASP A 18 -3.302 0.986 15.839 1.00 0.41 O ATOM 265 CB ASP A 18 -2.501 -1.662 17.278 1.00 0.42 C ATOM 266 CG ASP A 18 -2.025 -0.511 18.146 1.00 0.55 C ATOM 267 OD1 ASP A 18 -2.547 -0.358 19.270 1.00 0.69 O ATOM 268 OD2 ASP A 18 -1.122 0.237 17.714 1.00 0.59 O ATOM 0 H ASP A 18 -5.227 -2.633 15.808 1.00 0.31 H new ATOM 0 HA ASP A 18 -4.505 -0.970 17.121 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -2.738 -2.515 17.914 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -1.690 -1.971 16.618 1.00 0.42 H new ATOM 273 N HIS A 19 -3.367 -0.522 14.174 1.00 0.29 N ATOM 274 CA HIS A 19 -3.340 0.472 13.115 1.00 0.32 C ATOM 275 C HIS A 19 -4.780 0.804 12.746 1.00 0.43 C ATOM 276 O HIS A 19 -5.060 1.470 11.755 1.00 0.63 O ATOM 277 CB HIS A 19 -2.577 -0.025 11.880 1.00 0.29 C ATOM 278 CG HIS A 19 -1.195 -0.527 12.160 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.348 -0.885 11.142 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.567 -0.714 13.344 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.769 -1.278 11.724 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.681 -1.193 13.054 1.00 0.24 N ATOM 0 H HIS A 19 -3.329 -1.487 13.846 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.816 1.359 13.472 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.152 -0.824 11.412 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.514 0.788 11.157 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -0.972 -0.522 14.327 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.643 -1.624 11.193 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.407 -1.439 13.727 1.00 0.24 H new ATOM 290 N GLY A 20 -5.697 0.290 13.560 1.00 0.42 N ATOM 291 CA GLY A 20 -7.094 0.634 13.440 1.00 0.54 C ATOM 292 C GLY A 20 -7.794 -0.043 12.285 1.00 0.57 C ATOM 293 O GLY A 20 -8.442 0.626 11.486 1.00 0.79 O ATOM 0 H GLY A 20 -5.488 -0.368 14.310 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.604 0.370 14.366 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.183 1.714 13.324 1.00 0.54 H new ATOM 297 N LYS A 21 -7.730 -1.364 12.206 1.00 0.61 N ATOM 298 CA LYS A 21 -8.362 -2.055 11.090 1.00 0.95 C ATOM 299 C LYS A 21 -9.873 -2.197 11.302 1.00 0.89 C ATOM 300 O LYS A 21 -10.561 -2.870 10.538 1.00 1.05 O ATOM 301 CB LYS A 21 -7.687 -3.406 10.844 1.00 1.36 C ATOM 302 CG LYS A 21 -7.598 -4.316 12.059 1.00 1.79 C ATOM 303 CD LYS A 21 -8.857 -5.148 12.236 1.00 2.30 C ATOM 304 CE LYS A 21 -8.616 -6.310 13.189 1.00 2.66 C ATOM 305 NZ LYS A 21 -9.823 -7.164 13.346 1.00 3.31 N ATOM 0 H LYS A 21 -7.260 -1.967 12.882 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.228 -1.450 10.193 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -8.232 -3.929 10.058 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -6.679 -3.228 10.469 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -6.737 -4.977 11.955 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -7.432 -3.714 12.952 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -9.661 -4.520 12.620 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -9.184 -5.529 11.268 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -7.789 -6.916 12.819 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -8.317 -5.923 14.163 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -9.614 -7.943 14.003 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -10.606 -6.593 13.724 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -10.094 -7.555 12.421 1.00 3.31 H new ATOM 319 N THR A 22 -10.378 -1.548 12.347 1.00 0.84 N ATOM 320 CA THR A 22 -11.805 -1.503 12.617 1.00 0.87 C ATOM 321 C THR A 22 -12.249 -0.057 12.847 1.00 0.79 C ATOM 322 O THR A 22 -13.192 0.431 12.218 1.00 0.79 O ATOM 323 CB THR A 22 -12.167 -2.356 13.850 1.00 1.02 C ATOM 324 OG1 THR A 22 -11.628 -3.676 13.702 1.00 1.21 O ATOM 325 CG2 THR A 22 -13.678 -2.444 14.033 1.00 1.18 C ATOM 0 H THR A 22 -9.809 -1.042 13.026 1.00 0.84 H new ATOM 0 HA THR A 22 -12.324 -1.913 11.750 1.00 0.87 H new ATOM 0 HB THR A 22 -11.739 -1.877 14.731 1.00 1.02 H new ATOM 0 HG1 THR A 22 -11.859 -4.214 14.488 1.00 1.21 H new ATOM 0 HG21 THR A 22 -13.904 -3.051 14.910 1.00 1.18 H new ATOM 0 HG22 THR A 22 -14.087 -1.443 14.170 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.125 -2.901 13.150 1.00 1.18 H new ATOM 333 N THR A 23 -11.538 0.640 13.731 1.00 0.75 N ATOM 334 CA THR A 23 -11.843 2.032 14.027 1.00 0.75 C ATOM 335 C THR A 23 -11.792 2.893 12.764 1.00 0.67 C ATOM 336 O THR A 23 -12.457 3.915 12.690 1.00 0.66 O ATOM 337 CB THR A 23 -10.885 2.596 15.087 1.00 0.82 C ATOM 338 OG1 THR A 23 -10.901 1.758 16.247 1.00 1.25 O ATOM 339 CG2 THR A 23 -11.258 4.018 15.487 1.00 1.17 C ATOM 0 H THR A 23 -10.748 0.261 14.253 1.00 0.75 H new ATOM 0 HA THR A 23 -12.858 2.063 14.424 1.00 0.75 H new ATOM 0 HB THR A 23 -9.886 2.618 14.652 1.00 0.82 H new ATOM 0 HG1 THR A 23 -10.288 2.120 16.920 1.00 1.25 H new ATOM 0 HG21 THR A 23 -10.556 4.381 16.238 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.218 4.665 14.611 1.00 1.17 H new ATOM 0 HG23 THR A 23 -12.267 4.027 15.899 1.00 1.17 H new ATOM 347 N LEU A 24 -11.038 2.464 11.757 1.00 0.65 N ATOM 348 CA LEU A 24 -10.940 3.230 10.516 1.00 0.63 C ATOM 349 C LEU A 24 -12.228 3.187 9.720 1.00 0.64 C ATOM 350 O LEU A 24 -12.588 4.174 9.097 1.00 0.65 O ATOM 351 CB LEU A 24 -9.795 2.742 9.668 1.00 0.67 C ATOM 352 CG LEU A 24 -8.572 3.663 9.644 1.00 0.84 C ATOM 353 CD1 LEU A 24 -7.907 3.715 11.009 1.00 1.49 C ATOM 354 CD2 LEU A 24 -7.588 3.208 8.582 1.00 1.30 C ATOM 0 H LEU A 24 -10.492 1.602 11.772 1.00 0.65 H new ATOM 0 HA LEU A 24 -10.754 4.266 10.799 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -9.486 1.761 10.030 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.150 2.607 8.646 1.00 0.67 H new ATOM 0 HG LEU A 24 -8.906 4.670 9.395 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -7.041 4.375 10.967 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -8.616 4.093 11.745 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -7.586 2.714 11.296 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -6.724 3.873 8.578 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -7.262 2.191 8.800 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -8.070 3.233 7.605 1.00 1.30 H new ATOM 366 N LEU A 25 -12.940 2.063 9.739 1.00 0.68 N ATOM 367 CA LEU A 25 -14.199 1.996 9.009 1.00 0.75 C ATOM 368 C LEU A 25 -15.272 2.776 9.754 1.00 0.74 C ATOM 369 O LEU A 25 -16.301 3.150 9.193 1.00 0.82 O ATOM 370 CB LEU A 25 -14.639 0.548 8.718 1.00 0.85 C ATOM 371 CG LEU A 25 -14.894 -0.420 9.888 1.00 0.92 C ATOM 372 CD1 LEU A 25 -16.104 -0.012 10.725 1.00 1.63 C ATOM 373 CD2 LEU A 25 -15.102 -1.824 9.331 1.00 1.69 C ATOM 0 H LEU A 25 -12.677 1.212 10.236 1.00 0.68 H new ATOM 0 HA LEU A 25 -14.045 2.459 8.034 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -15.556 0.598 8.130 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -13.877 0.097 8.082 1.00 0.85 H new ATOM 0 HG LEU A 25 -14.025 -0.392 10.545 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -16.242 -0.726 11.537 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -15.941 0.983 11.140 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.994 -0.001 10.096 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -15.283 -2.518 10.152 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -15.960 -1.825 8.658 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -14.212 -2.134 8.784 1.00 1.69 H new ATOM 385 N ASP A 26 -15.003 3.030 11.022 1.00 0.71 N ATOM 386 CA ASP A 26 -15.875 3.861 11.837 1.00 0.75 C ATOM 387 C ASP A 26 -15.504 5.311 11.642 1.00 0.70 C ATOM 388 O ASP A 26 -16.352 6.188 11.484 1.00 0.76 O ATOM 389 CB ASP A 26 -15.735 3.501 13.301 1.00 0.81 C ATOM 390 CG ASP A 26 -16.613 4.351 14.203 1.00 1.01 C ATOM 391 OD1 ASP A 26 -17.832 4.096 14.265 1.00 1.13 O ATOM 392 OD2 ASP A 26 -16.088 5.280 14.851 1.00 1.23 O ATOM 0 H ASP A 26 -14.184 2.671 11.513 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.908 3.694 11.532 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.991 2.450 13.438 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.694 3.617 13.601 1.00 0.81 H new ATOM 397 N ALA A 27 -14.208 5.528 11.633 1.00 0.63 N ATOM 398 CA ALA A 27 -13.644 6.848 11.446 1.00 0.61 C ATOM 399 C ALA A 27 -13.977 7.381 10.059 1.00 0.58 C ATOM 400 O ALA A 27 -14.268 8.560 9.882 1.00 0.62 O ATOM 401 CB ALA A 27 -12.146 6.759 11.637 1.00 0.61 C ATOM 0 H ALA A 27 -13.512 4.792 11.755 1.00 0.63 H new ATOM 0 HA ALA A 27 -14.069 7.538 12.175 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.702 7.745 11.500 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.928 6.400 12.643 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.726 6.068 10.906 1.00 0.61 H new ATOM 407 N ILE A 28 -13.946 6.486 9.093 1.00 0.56 N ATOM 408 CA ILE A 28 -14.157 6.828 7.699 1.00 0.57 C ATOM 409 C ILE A 28 -15.631 7.141 7.424 1.00 0.64 C ATOM 410 O ILE A 28 -15.952 7.979 6.580 1.00 0.71 O ATOM 411 CB ILE A 28 -13.672 5.658 6.812 1.00 0.61 C ATOM 412 CG1 ILE A 28 -13.182 6.136 5.455 1.00 0.84 C ATOM 413 CG2 ILE A 28 -14.761 4.614 6.629 1.00 1.02 C ATOM 414 CD1 ILE A 28 -12.462 5.041 4.704 1.00 0.85 C ATOM 0 H ILE A 28 -13.773 5.494 9.253 1.00 0.56 H new ATOM 0 HA ILE A 28 -13.584 7.725 7.463 1.00 0.57 H new ATOM 0 HB ILE A 28 -12.831 5.202 7.334 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -14.029 6.486 4.865 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -12.513 6.986 5.588 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -14.388 3.805 6.001 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.049 4.215 7.601 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -15.628 5.072 6.153 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -12.127 5.421 3.739 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -11.600 4.709 5.283 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -13.139 4.201 4.548 1.00 0.85 H new ATOM 1221 N ILE A 81 -10.118 -3.809 -5.811 1.00 0.63 N ATOM 1222 CA ILE A 81 -8.998 -3.053 -5.254 1.00 0.42 C ATOM 1223 C ILE A 81 -8.929 -3.246 -3.739 1.00 0.38 C ATOM 1224 O ILE A 81 -9.964 -3.255 -3.072 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.123 -1.542 -5.564 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.393 -1.313 -7.055 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -7.856 -0.815 -5.145 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -9.625 0.140 -7.415 1.00 0.71 C ATOM 0 HA ILE A 81 -8.087 -3.431 -5.719 1.00 0.42 H new ATOM 0 HB ILE A 81 -9.965 -1.144 -4.997 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -8.548 -1.690 -7.631 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -10.266 -1.895 -7.351 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -7.955 0.247 -5.368 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -7.697 -0.948 -4.075 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.005 -1.222 -5.691 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -9.809 0.225 -8.486 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -10.489 0.517 -6.867 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -8.744 0.725 -7.151 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.722 -3.397 -3.190 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.578 -3.633 -1.757 1.00 0.28 C ATOM 1242 C VAL A 82 -6.801 -2.525 -1.071 1.00 0.23 C ATOM 1243 O VAL A 82 -5.700 -2.168 -1.481 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.905 -4.987 -1.448 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -6.458 -5.064 0.012 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -7.873 -6.110 -1.750 1.00 1.17 C ATOM 0 H VAL A 82 -6.844 -3.361 -3.708 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.594 -3.651 -1.363 1.00 0.28 H new ATOM 0 HB VAL A 82 -6.019 -5.083 -2.076 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.988 -6.030 0.198 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.743 -4.267 0.216 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -7.324 -4.950 0.664 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -7.399 -7.067 -1.532 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -8.764 -5.998 -1.133 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -8.154 -6.075 -2.803 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.403 -1.984 -0.030 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.739 -1.033 0.835 1.00 0.19 C ATOM 1258 C ILE A 83 -5.938 -1.751 1.898 1.00 0.19 C ATOM 1259 O ILE A 83 -6.417 -2.690 2.525 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.737 -0.067 1.506 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.209 0.926 0.463 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.111 0.649 2.702 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -8.928 2.130 1.029 1.00 0.37 C ATOM 0 H ILE A 83 -8.365 -2.192 0.238 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.069 -0.445 0.207 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.584 -0.633 1.893 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.348 1.269 -0.111 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -8.874 0.415 -0.233 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -7.844 1.321 3.148 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.795 -0.087 3.442 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.247 1.224 2.370 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.231 2.789 0.215 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -9.810 1.802 1.578 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.261 2.669 1.702 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.722 -1.304 2.090 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.868 -1.876 3.093 1.00 0.23 C ATOM 1277 C LEU A 84 -3.464 -0.772 4.072 1.00 0.24 C ATOM 1278 O LEU A 84 -2.745 0.161 3.712 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.661 -2.552 2.413 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.573 -3.119 3.332 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.629 -2.014 3.748 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -2.175 -3.804 4.554 1.00 1.01 C ATOM 0 H LEU A 84 -4.302 -0.541 1.560 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.383 -2.651 3.661 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -3.034 -3.364 1.789 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -2.197 -1.825 1.746 1.00 0.39 H new ATOM 0 HG LEU A 84 -1.016 -3.875 2.778 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.143 -2.421 4.401 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -0.164 -1.581 2.863 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.185 -1.242 4.281 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.375 -4.194 5.183 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.765 -3.084 5.121 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.816 -4.624 4.232 1.00 1.01 H new ATOM 1294 N VAL A 85 -3.978 -0.855 5.286 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.714 0.137 6.310 1.00 0.27 C ATOM 1296 C VAL A 85 -2.469 -0.213 7.115 1.00 0.25 C ATOM 1297 O VAL A 85 -2.408 -1.257 7.765 1.00 0.29 O ATOM 1298 CB VAL A 85 -4.916 0.261 7.261 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -4.617 1.239 8.375 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.163 0.676 6.492 1.00 0.40 C ATOM 0 H VAL A 85 -4.590 -1.613 5.589 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.547 1.089 5.806 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.103 -0.714 7.711 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.480 1.312 9.036 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -3.754 0.891 8.942 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.401 2.219 7.950 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.004 0.759 7.180 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -5.991 1.639 6.012 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.388 -0.073 5.733 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.472 0.655 7.041 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.280 0.522 7.851 1.00 0.20 C ATOM 1312 C VAL A 86 0.001 1.798 8.631 1.00 0.17 C ATOM 1313 O VAL A 86 0.111 2.880 8.058 1.00 0.22 O ATOM 1314 CB VAL A 86 0.954 0.175 7.003 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.989 -1.310 6.703 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.975 0.981 5.709 1.00 0.64 C ATOM 0 H VAL A 86 -1.470 1.465 6.421 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.470 -0.296 8.546 1.00 0.20 H new ATOM 0 HB VAL A 86 1.843 0.437 7.577 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.869 -1.539 6.102 1.00 0.49 H new ATOM 0 HG12 VAL A 86 1.033 -1.869 7.638 1.00 0.49 H new ATOM 0 HG13 VAL A 86 0.091 -1.591 6.153 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.859 0.715 5.129 1.00 0.64 H new ATOM 0 HG22 VAL A 86 0.080 0.760 5.128 1.00 0.64 H new ATOM 0 HG23 VAL A 86 1.002 2.045 5.944 1.00 0.64 H new ATOM 1326 N ALA A 87 0.088 1.666 9.942 1.00 0.17 N ATOM 1327 CA ALA A 87 0.480 2.771 10.800 1.00 0.18 C ATOM 1328 C ALA A 87 1.894 3.214 10.464 1.00 0.16 C ATOM 1329 O ALA A 87 2.791 2.387 10.370 1.00 0.24 O ATOM 1330 CB ALA A 87 0.402 2.347 12.256 1.00 0.28 C ATOM 0 H ALA A 87 -0.109 0.798 10.440 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.201 3.606 10.636 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.697 3.180 12.894 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -0.620 2.052 12.495 1.00 0.28 H new ATOM 0 HB3 ALA A 87 1.072 1.505 12.426 1.00 0.28 H new ATOM 1336 N ALA A 88 2.103 4.514 10.298 1.00 0.12 N ATOM 1337 CA ALA A 88 3.411 5.015 9.889 1.00 0.14 C ATOM 1338 C ALA A 88 4.415 4.893 11.010 1.00 0.16 C ATOM 1339 O ALA A 88 5.625 4.927 10.789 1.00 0.22 O ATOM 1340 CB ALA A 88 3.326 6.463 9.453 1.00 0.17 C ATOM 0 H ALA A 88 1.394 5.234 10.438 1.00 0.12 H new ATOM 0 HA ALA A 88 3.740 4.406 9.047 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.314 6.811 9.153 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.640 6.550 8.610 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.962 7.072 10.281 1.00 0.17 H new ATOM 1346 N ASP A 89 3.907 4.771 12.210 1.00 0.16 N ATOM 1347 CA ASP A 89 4.772 4.676 13.380 1.00 0.21 C ATOM 1348 C ASP A 89 5.112 3.220 13.695 1.00 0.22 C ATOM 1349 O ASP A 89 6.030 2.940 14.468 1.00 0.37 O ATOM 1350 CB ASP A 89 4.109 5.326 14.589 1.00 0.30 C ATOM 1351 CG ASP A 89 3.033 4.448 15.190 1.00 0.39 C ATOM 1352 OD1 ASP A 89 2.091 4.082 14.464 1.00 0.47 O ATOM 1353 OD2 ASP A 89 3.124 4.124 16.393 1.00 0.58 O ATOM 0 H ASP A 89 2.908 4.734 12.412 1.00 0.16 H new ATOM 0 HA ASP A 89 5.697 5.206 13.154 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.865 5.540 15.344 1.00 0.30 H new ATOM 0 HB3 ASP A 89 3.674 6.281 14.293 1.00 0.30 H new ATOM 1358 N ASP A 90 4.380 2.295 13.085 1.00 0.19 N ATOM 1359 CA ASP A 90 4.536 0.874 13.390 1.00 0.23 C ATOM 1360 C ASP A 90 4.979 0.104 12.146 1.00 0.25 C ATOM 1361 O ASP A 90 5.957 -0.647 12.180 1.00 0.42 O ATOM 1362 CB ASP A 90 3.220 0.327 13.935 1.00 0.26 C ATOM 1363 CG ASP A 90 3.404 -0.875 14.836 1.00 0.36 C ATOM 1364 OD1 ASP A 90 3.995 -0.717 15.931 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.938 -1.971 14.475 1.00 0.46 O ATOM 0 H ASP A 90 3.674 2.501 12.378 1.00 0.19 H new ATOM 0 HA ASP A 90 5.310 0.749 14.148 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.708 1.114 14.489 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.574 0.053 13.101 1.00 0.26 H new ATOM 1370 N GLY A 91 4.264 0.311 11.047 1.00 0.20 N ATOM 1371 CA GLY A 91 4.664 -0.238 9.762 1.00 0.21 C ATOM 1372 C GLY A 91 4.066 -1.602 9.476 1.00 0.22 C ATOM 1373 O GLY A 91 3.088 -1.996 10.103 1.00 0.37 O ATOM 0 H GLY A 91 3.403 0.857 11.022 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.368 0.453 8.972 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.751 -0.312 9.730 1.00 0.21 H new ATOM 1377 N VAL A 92 4.642 -2.316 8.516 1.00 0.26 N ATOM 1378 CA VAL A 92 4.146 -3.641 8.152 1.00 0.26 C ATOM 1379 C VAL A 92 4.490 -4.641 9.253 1.00 0.24 C ATOM 1380 O VAL A 92 5.595 -4.647 9.803 1.00 0.28 O ATOM 1381 CB VAL A 92 4.709 -4.121 6.791 1.00 0.32 C ATOM 1382 CG1 VAL A 92 6.171 -4.525 6.905 1.00 0.96 C ATOM 1383 CG2 VAL A 92 3.871 -5.261 6.237 1.00 1.03 C ATOM 0 H VAL A 92 5.449 -2.003 7.977 1.00 0.26 H new ATOM 0 HA VAL A 92 3.063 -3.573 8.045 1.00 0.26 H new ATOM 0 HB VAL A 92 4.654 -3.285 6.094 1.00 0.32 H new ATOM 0 HG11 VAL A 92 6.534 -4.856 5.932 1.00 0.96 H new ATOM 0 HG12 VAL A 92 6.759 -3.671 7.240 1.00 0.96 H new ATOM 0 HG13 VAL A 92 6.269 -5.338 7.625 1.00 0.96 H new ATOM 0 HG21 VAL A 92 4.283 -5.584 5.281 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.883 -6.096 6.938 1.00 1.03 H new ATOM 0 HG23 VAL A 92 2.845 -4.922 6.094 1.00 1.03 H new ATOM 1393 N MET A 93 3.519 -5.468 9.574 1.00 0.22 N ATOM 1394 CA MET A 93 3.593 -6.366 10.712 1.00 0.22 C ATOM 1395 C MET A 93 3.000 -7.724 10.320 1.00 0.22 C ATOM 1396 O MET A 93 2.524 -7.869 9.192 1.00 0.23 O ATOM 1397 CB MET A 93 2.829 -5.731 11.876 1.00 0.21 C ATOM 1398 CG MET A 93 3.416 -4.406 12.332 1.00 0.23 C ATOM 1399 SD MET A 93 4.887 -4.627 13.344 1.00 0.28 S ATOM 1400 CE MET A 93 4.117 -5.222 14.843 1.00 0.27 C ATOM 0 H MET A 93 2.647 -5.539 9.049 1.00 0.22 H new ATOM 0 HA MET A 93 4.626 -6.529 11.020 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.792 -5.577 11.579 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.820 -6.425 12.717 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.665 -3.801 11.460 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.666 -3.854 12.899 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.751 -4.984 15.697 1.00 0.27 H new ATOM 0 HE2 MET A 93 3.146 -4.743 14.968 1.00 0.27 H new ATOM 0 HE3 MET A 93 3.983 -6.302 14.780 1.00 0.27 H new ATOM 1410 N PRO A 94 3.027 -8.733 11.220 1.00 0.25 N ATOM 1411 CA PRO A 94 2.538 -10.088 10.930 1.00 0.30 C ATOM 1412 C PRO A 94 1.248 -10.134 10.103 1.00 0.28 C ATOM 1413 O PRO A 94 1.260 -10.596 8.957 1.00 0.31 O ATOM 1414 CB PRO A 94 2.302 -10.666 12.320 1.00 0.37 C ATOM 1415 CG PRO A 94 3.332 -10.017 13.176 1.00 0.58 C ATOM 1416 CD PRO A 94 3.578 -8.647 12.592 1.00 0.30 C ATOM 0 HA PRO A 94 3.251 -10.639 10.317 1.00 0.30 H new ATOM 0 HB2 PRO A 94 1.295 -10.446 12.675 1.00 0.37 H new ATOM 0 HB3 PRO A 94 2.411 -11.751 12.322 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.987 -9.942 14.207 1.00 0.58 H new ATOM 0 HG3 PRO A 94 4.251 -10.603 13.189 1.00 0.58 H new ATOM 0 HD2 PRO A 94 3.080 -7.871 13.173 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.641 -8.404 12.580 1.00 0.30 H new ATOM 1424 N GLN A 95 0.140 -9.647 10.662 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.149 -9.771 9.997 1.00 0.32 C ATOM 1426 C GLN A 95 -1.278 -8.772 8.850 1.00 0.31 C ATOM 1427 O GLN A 95 -2.121 -8.932 7.969 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.310 -9.627 10.990 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.861 -8.216 11.151 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.237 -8.211 11.802 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -4.289 -8.091 13.120 1.00 0.75 O flip ATOM 1432 NE2 GLN A 95 -5.256 -8.309 11.119 1.00 0.34 N flip ATOM 0 H GLN A 95 0.112 -9.169 11.563 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.202 -10.774 9.573 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.121 -10.281 10.672 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -1.978 -9.983 11.965 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.172 -7.625 11.755 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.921 -7.737 10.174 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -5.184 -8.400 10.106 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -6.173 -8.299 11.566 1.00 0.34 H new ATOM 1441 N THR A 96 -0.417 -7.764 8.846 1.00 0.26 N ATOM 1442 CA THR A 96 -0.397 -6.787 7.772 1.00 0.25 C ATOM 1443 C THR A 96 0.083 -7.453 6.500 1.00 0.25 C ATOM 1444 O THR A 96 -0.471 -7.252 5.422 1.00 0.31 O ATOM 1445 CB THR A 96 0.529 -5.617 8.090 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.787 -5.583 9.491 1.00 0.24 O ATOM 1447 CG2 THR A 96 -0.099 -4.308 7.653 1.00 0.28 C ATOM 0 H THR A 96 0.277 -7.603 9.576 1.00 0.26 H new ATOM 0 HA THR A 96 -1.410 -6.402 7.652 1.00 0.25 H new ATOM 0 HB THR A 96 1.465 -5.751 7.548 1.00 0.25 H new ATOM 0 HG1 THR A 96 1.190 -4.722 9.729 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.576 -3.485 7.888 1.00 0.28 H new ATOM 0 HG22 THR A 96 -0.281 -4.333 6.579 1.00 0.28 H new ATOM 0 HG23 THR A 96 -1.043 -4.164 8.178 1.00 0.28 H new ATOM 1455 N VAL A 97 1.118 -8.267 6.649 1.00 0.25 N ATOM 1456 CA VAL A 97 1.661 -8.996 5.533 1.00 0.31 C ATOM 1457 C VAL A 97 0.675 -10.019 5.013 1.00 0.23 C ATOM 1458 O VAL A 97 0.546 -10.199 3.813 1.00 0.24 O ATOM 1459 CB VAL A 97 2.943 -9.743 5.887 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.520 -10.329 4.630 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.936 -8.834 6.559 1.00 1.38 C ATOM 0 H VAL A 97 1.593 -8.433 7.536 1.00 0.25 H new ATOM 0 HA VAL A 97 1.876 -8.243 4.775 1.00 0.31 H new ATOM 0 HB VAL A 97 2.712 -10.541 6.593 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.438 -10.867 4.867 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.801 -11.017 4.186 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.741 -9.529 3.923 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.839 -9.395 6.799 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.187 -8.011 5.890 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.502 -8.436 7.476 1.00 1.38 H new ATOM 1471 N GLU A 98 -0.002 -10.703 5.923 1.00 0.24 N ATOM 1472 CA GLU A 98 -0.993 -11.709 5.541 1.00 0.29 C ATOM 1473 C GLU A 98 -2.037 -11.102 4.610 1.00 0.31 C ATOM 1474 O GLU A 98 -2.600 -11.787 3.758 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.678 -12.283 6.783 1.00 0.39 C ATOM 1476 CG GLU A 98 -0.711 -12.895 7.779 1.00 0.92 C ATOM 1477 CD GLU A 98 0.112 -14.012 7.176 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -0.459 -15.080 6.881 1.00 1.97 O ATOM 1479 OE2 GLU A 98 1.336 -13.825 6.992 1.00 2.35 O ATOM 0 H GLU A 98 0.113 -10.584 6.929 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.478 -12.514 5.017 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -2.242 -11.491 7.276 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -2.397 -13.041 6.474 1.00 0.39 H new ATOM 0 HG2 GLU A 98 -0.044 -12.120 8.156 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -1.269 -13.279 8.633 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.280 -9.807 4.773 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.184 -9.086 3.899 1.00 0.35 C ATOM 1488 C ALA A 99 -2.547 -8.869 2.531 1.00 0.34 C ATOM 1489 O ALA A 99 -3.208 -8.996 1.499 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.577 -7.761 4.529 1.00 0.39 C ATOM 0 H ALA A 99 -1.859 -9.237 5.507 1.00 0.31 H new ATOM 0 HA ALA A 99 -4.086 -9.682 3.760 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.256 -7.229 3.863 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.073 -7.944 5.482 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.684 -7.158 4.695 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.246 -8.595 2.523 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.528 -8.347 1.293 1.00 0.29 C ATOM 1498 C ILE A 100 -0.344 -9.657 0.555 1.00 0.29 C ATOM 1499 O ILE A 100 -0.557 -9.757 -0.649 1.00 0.34 O ATOM 1500 CB ILE A 100 0.852 -7.745 1.587 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.711 -6.385 2.275 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.644 -7.630 0.301 1.00 0.36 C ATOM 1503 CD1 ILE A 100 2.019 -5.842 2.811 1.00 0.41 C ATOM 0 H ILE A 100 -0.671 -8.541 3.364 1.00 0.28 H new ATOM 0 HA ILE A 100 -1.100 -7.644 0.687 1.00 0.29 H new ATOM 0 HB ILE A 100 1.392 -8.404 2.268 1.00 0.32 H new ATOM 0 HG12 ILE A 100 0.293 -5.670 1.567 1.00 0.35 H new ATOM 0 HG13 ILE A 100 -0.000 -6.474 3.096 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.624 -7.202 0.514 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.768 -8.619 -0.139 1.00 0.36 H new ATOM 0 HG23 ILE A 100 1.111 -6.986 -0.398 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.845 -4.876 3.285 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.429 -6.537 3.543 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.726 -5.721 1.990 1.00 0.41 H new ATOM 1515 N ASN A 101 0.036 -10.662 1.318 1.00 0.29 N ATOM 1516 CA ASN A 101 0.260 -12.004 0.816 1.00 0.34 C ATOM 1517 C ASN A 101 -1.000 -12.566 0.179 1.00 0.36 C ATOM 1518 O ASN A 101 -0.933 -13.352 -0.763 1.00 0.43 O ATOM 1519 CB ASN A 101 0.732 -12.900 1.970 1.00 0.44 C ATOM 1520 CG ASN A 101 2.230 -12.889 2.143 1.00 0.53 C ATOM 1521 OD1 ASN A 101 2.979 -12.752 1.179 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.680 -13.017 3.376 1.00 0.64 N ATOM 0 H ASN A 101 0.201 -10.568 2.320 1.00 0.29 H new ATOM 0 HA ASN A 101 1.029 -11.972 0.044 1.00 0.34 H new ATOM 0 HB2 ASN A 101 0.261 -12.570 2.896 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.399 -13.922 1.790 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.684 -13.004 3.556 1.00 0.64 H new ATOM 0 HD22 ASN A 101 2.024 -13.129 4.149 1.00 0.64 H new ATOM 1529 N HIS A 102 -2.149 -12.146 0.681 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.413 -12.565 0.114 1.00 0.43 C ATOM 1531 C HIS A 102 -3.735 -11.729 -1.119 1.00 0.37 C ATOM 1532 O HIS A 102 -4.312 -12.222 -2.092 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.522 -12.433 1.157 1.00 0.61 C ATOM 1534 CG HIS A 102 -5.726 -13.242 0.818 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -6.171 -14.296 1.585 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.564 -13.156 -0.230 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -7.237 -14.828 1.017 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -7.498 -14.152 -0.090 1.00 1.91 N ATOM 0 H HIS A 102 -2.229 -11.516 1.479 1.00 0.35 H new ATOM 0 HA HIS A 102 -3.341 -13.610 -0.186 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -4.141 -12.746 2.129 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.807 -11.385 1.248 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.512 -12.436 -1.033 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -7.800 -15.670 1.392 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -8.267 -14.340 -0.733 1.00 1.91 H new ATOM 1547 N ALA A 103 -3.345 -10.465 -1.078 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.605 -9.554 -2.177 1.00 0.41 C ATOM 1549 C ALA A 103 -2.730 -9.874 -3.388 1.00 0.40 C ATOM 1550 O ALA A 103 -3.222 -9.942 -4.511 1.00 0.44 O ATOM 1551 CB ALA A 103 -3.389 -8.114 -1.733 1.00 0.47 C ATOM 0 H ALA A 103 -2.846 -10.047 -0.292 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.646 -9.681 -2.476 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -3.588 -7.442 -2.568 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -4.066 -7.881 -0.911 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -2.358 -7.986 -1.402 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.434 -10.094 -3.168 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.524 -10.360 -4.274 1.00 0.49 C ATOM 1559 C LYS A 104 -0.794 -11.740 -4.832 1.00 0.54 C ATOM 1560 O LYS A 104 -0.570 -12.006 -6.011 1.00 0.66 O ATOM 1561 CB LYS A 104 0.927 -10.261 -3.820 1.00 0.61 C ATOM 1562 CG LYS A 104 1.210 -9.037 -2.972 1.00 0.70 C ATOM 1563 CD LYS A 104 0.780 -7.745 -3.660 1.00 0.84 C ATOM 1564 CE LYS A 104 1.483 -7.537 -4.997 1.00 0.99 C ATOM 1565 NZ LYS A 104 2.948 -7.331 -4.845 1.00 1.66 N ATOM 0 H LYS A 104 -0.998 -10.093 -2.246 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.692 -9.612 -5.049 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.184 -11.155 -3.252 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.574 -10.244 -4.697 1.00 0.61 H new ATOM 0 HG2 LYS A 104 0.689 -9.129 -2.019 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.276 -8.990 -2.749 1.00 0.70 H new ATOM 0 HD2 LYS A 104 -0.298 -7.762 -3.818 1.00 0.84 H new ATOM 0 HD3 LYS A 104 0.993 -6.900 -3.005 1.00 0.84 H new ATOM 0 HE2 LYS A 104 1.306 -8.402 -5.635 1.00 0.99 H new ATOM 0 HE3 LYS A 104 1.049 -6.674 -5.502 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 3.187 -6.349 -5.088 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 3.225 -7.522 -3.861 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 3.457 -7.979 -5.480 1.00 1.66 H new ATOM 1579 N ALA A 105 -1.265 -12.612 -3.957 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.704 -13.948 -4.359 1.00 0.61 C ATOM 1581 C ALA A 105 -2.756 -13.878 -5.464 1.00 0.62 C ATOM 1582 O ALA A 105 -2.717 -14.648 -6.422 1.00 0.77 O ATOM 1583 CB ALA A 105 -2.248 -14.720 -3.169 1.00 0.65 C ATOM 0 H ALA A 105 -1.355 -12.423 -2.959 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.833 -14.474 -4.749 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.568 -15.710 -3.493 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.469 -14.820 -2.413 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -3.098 -14.185 -2.746 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.696 -12.948 -5.322 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.724 -12.742 -6.337 1.00 0.64 C ATOM 1591 C ALA A 106 -4.199 -11.850 -7.462 1.00 0.64 C ATOM 1592 O ALA A 106 -4.634 -11.952 -8.609 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.978 -12.138 -5.721 1.00 0.68 C ATOM 0 H ALA A 106 -3.767 -12.327 -4.516 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.983 -13.713 -6.759 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.731 -11.993 -6.496 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -6.368 -12.811 -4.957 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.734 -11.177 -5.268 1.00 0.68 H new ATOM 1599 N ASN A 107 -3.279 -10.955 -7.080 1.00 0.59 N ATOM 1600 CA ASN A 107 -2.514 -10.115 -8.006 1.00 0.65 C ATOM 1601 C ASN A 107 -3.312 -8.873 -8.329 1.00 0.60 C ATOM 1602 O ASN A 107 -3.553 -8.532 -9.488 1.00 0.85 O ATOM 1603 CB ASN A 107 -2.103 -10.861 -9.270 1.00 0.85 C ATOM 1604 CG ASN A 107 -0.813 -10.345 -9.861 1.00 1.04 C ATOM 1605 OD1 ASN A 107 -0.435 -9.188 -9.671 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -0.127 -11.204 -10.584 1.00 1.41 N ATOM 0 H ASN A 107 -3.042 -10.793 -6.101 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.584 -9.828 -7.516 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -1.994 -11.921 -9.041 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -2.897 -10.775 -10.012 1.00 0.85 H new ATOM 0 HD21 ASN A 107 0.754 -10.921 -11.012 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -0.477 -12.153 -10.716 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.723 -8.212 -7.265 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.555 -7.038 -7.338 1.00 0.42 C ATOM 1615 C VAL A 108 -3.768 -5.794 -6.926 1.00 0.37 C ATOM 1616 O VAL A 108 -2.930 -5.859 -6.023 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.776 -7.207 -6.406 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.369 -7.845 -5.089 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.418 -5.873 -6.136 1.00 1.35 C ATOM 0 H VAL A 108 -3.482 -8.484 -6.312 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.892 -6.915 -8.367 1.00 0.42 H new ATOM 0 HB VAL A 108 -6.491 -7.859 -6.908 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -6.246 -7.953 -4.451 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.935 -8.827 -5.279 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -4.633 -7.214 -4.591 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -7.276 -6.009 -5.478 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -5.695 -5.212 -5.658 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -6.748 -5.431 -7.076 1.00 1.35 H new ATOM 1629 N PRO A 109 -4.005 -4.657 -7.603 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.429 -3.372 -7.209 1.00 0.33 C ATOM 1631 C PRO A 109 -3.934 -2.913 -5.845 1.00 0.28 C ATOM 1632 O PRO A 109 -5.105 -3.108 -5.499 1.00 0.29 O ATOM 1633 CB PRO A 109 -3.884 -2.403 -8.306 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.321 -3.269 -9.439 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.828 -4.535 -8.816 1.00 0.40 C ATOM 0 HA PRO A 109 -2.345 -3.430 -7.113 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -4.700 -1.769 -7.958 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.072 -1.741 -8.607 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.101 -2.782 -10.025 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.493 -3.472 -10.118 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.890 -4.471 -8.579 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.700 -5.391 -9.479 1.00 0.40 H new ATOM 1643 N ILE A 110 -3.059 -2.287 -5.078 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.377 -1.955 -3.705 1.00 0.21 C ATOM 1645 C ILE A 110 -3.639 -0.458 -3.551 1.00 0.19 C ATOM 1646 O ILE A 110 -3.236 0.356 -4.386 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.219 -2.401 -2.765 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -2.043 -3.926 -2.803 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.423 -1.933 -1.331 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -3.194 -4.692 -2.185 1.00 0.60 C ATOM 0 H ILE A 110 -2.129 -2.001 -5.382 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.286 -2.488 -3.425 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.311 -1.926 -3.138 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -1.924 -4.242 -3.839 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -1.123 -4.189 -2.281 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.588 -2.270 -0.716 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.475 -0.844 -1.307 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.352 -2.349 -0.941 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.996 -5.762 -2.250 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -3.301 -4.406 -1.139 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -4.115 -4.460 -2.721 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.344 -0.128 -2.493 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.550 1.237 -2.052 1.00 0.18 C ATOM 1664 C ILE A 111 -4.097 1.320 -0.611 1.00 0.16 C ATOM 1665 O ILE A 111 -4.883 1.147 0.316 1.00 0.18 O ATOM 1666 CB ILE A 111 -6.023 1.699 -2.143 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.489 1.725 -3.589 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.190 3.085 -1.524 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.719 2.702 -4.437 1.00 0.37 C ATOM 0 H ILE A 111 -4.803 -0.818 -1.898 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.980 1.893 -2.710 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.634 0.987 -1.588 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -6.391 0.726 -4.015 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.548 1.982 -3.619 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.233 3.393 -1.597 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -5.894 3.053 -0.475 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.562 3.799 -2.057 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -6.098 2.675 -5.459 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -5.838 3.707 -4.033 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.663 2.433 -4.434 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.814 1.513 -0.423 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.284 1.606 0.905 1.00 0.18 C ATOM 1683 C VAL A 112 -2.733 2.890 1.542 1.00 0.20 C ATOM 1684 O VAL A 112 -2.914 3.908 0.881 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.759 1.544 0.927 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.241 1.645 2.333 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.276 0.261 0.309 1.00 0.19 C ATOM 0 H VAL A 112 -2.126 1.607 -1.170 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.662 0.749 1.463 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.382 2.388 0.349 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.848 1.599 2.324 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.560 2.591 2.771 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.634 0.819 2.926 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.813 0.233 0.333 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.673 -0.585 0.870 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.618 0.204 -0.724 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.903 2.819 2.823 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.356 3.945 3.585 1.00 0.24 C ATOM 1699 C ALA A 113 -2.700 3.937 4.943 1.00 0.25 C ATOM 1700 O ALA A 113 -3.075 3.184 5.838 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.867 3.947 3.676 1.00 0.29 C ATOM 0 H ALA A 113 -2.732 1.978 3.374 1.00 0.21 H new ATOM 0 HA ALA A 113 -3.067 4.869 3.083 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -5.195 4.808 4.258 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.292 4.003 2.674 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.203 3.031 4.162 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.681 4.762 5.054 1.00 0.24 N ATOM 1708 CA ILE A 114 -0.933 4.913 6.271 1.00 0.27 C ATOM 1709 C ILE A 114 -1.794 5.622 7.297 1.00 0.30 C ATOM 1710 O ILE A 114 -2.507 6.546 6.954 1.00 0.50 O ATOM 1711 CB ILE A 114 0.359 5.725 6.017 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.365 4.916 5.197 1.00 0.38 C ATOM 1713 CG2 ILE A 114 0.985 6.168 7.316 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.136 4.968 3.701 1.00 0.59 C ATOM 0 H ILE A 114 -1.350 5.351 4.290 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.651 3.928 6.642 1.00 0.27 H new ATOM 0 HB ILE A 114 0.082 6.612 5.447 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.369 5.282 5.412 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.328 3.876 5.522 1.00 0.38 H new ATOM 0 HG21 ILE A 114 1.891 6.737 7.108 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.281 6.795 7.864 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.235 5.293 7.916 1.00 0.44 H new ATOM 0 HD11 ILE A 114 1.893 4.368 3.196 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.147 4.573 3.470 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.203 6.001 3.358 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.742 5.189 8.541 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.515 5.831 9.595 1.00 0.22 C ATOM 1728 C ASN A 115 -1.535 6.321 10.614 1.00 0.20 C ATOM 1729 O ASN A 115 -0.334 6.045 10.498 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.564 4.864 10.193 1.00 0.33 C ATOM 1731 CG ASN A 115 -3.150 4.172 11.487 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -1.998 3.853 11.697 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -4.107 3.930 12.366 1.00 0.56 N ATOM 0 H ASN A 115 -1.176 4.399 8.850 1.00 0.19 H new ATOM 0 HA ASN A 115 -3.092 6.670 9.205 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.484 5.420 10.376 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -3.795 4.101 9.450 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -3.885 3.465 13.246 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -5.067 4.209 12.164 1.00 0.56 H new ATOM 1740 N LYS A 116 -2.019 7.075 11.571 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.174 7.567 12.618 1.00 0.20 C ATOM 1742 C LYS A 116 -0.145 8.565 12.097 1.00 0.21 C ATOM 1743 O LYS A 116 0.954 8.681 12.636 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.512 6.381 13.316 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.447 5.669 14.277 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.729 4.583 15.060 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.685 3.739 15.888 1.00 0.51 C ATOM 1748 NZ LYS A 116 -0.976 2.624 16.572 1.00 0.59 N ATOM 0 H LYS A 116 -2.996 7.359 11.642 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.782 8.113 13.340 1.00 0.20 H new ATOM 0 HB2 LYS A 116 -0.161 5.673 12.565 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.366 6.729 13.861 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -1.877 6.393 14.969 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -2.275 5.229 13.721 1.00 0.32 H new ATOM 0 HD2 LYS A 116 -0.185 3.939 14.369 1.00 0.40 H new ATOM 0 HD3 LYS A 116 0.010 5.041 15.717 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -2.178 4.368 16.630 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -2.466 3.334 15.244 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -1.624 1.819 16.687 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 -0.158 2.331 16.001 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -0.650 2.942 17.507 1.00 0.59 H new ATOM 1762 N MET A 117 -0.515 9.291 11.049 1.00 0.21 N ATOM 1763 CA MET A 117 0.305 10.384 10.552 1.00 0.28 C ATOM 1764 C MET A 117 0.013 11.636 11.357 1.00 0.29 C ATOM 1765 O MET A 117 0.660 12.674 11.197 1.00 0.37 O ATOM 1766 CB MET A 117 0.035 10.613 9.072 1.00 0.38 C ATOM 1767 CG MET A 117 0.541 9.485 8.192 1.00 0.48 C ATOM 1768 SD MET A 117 2.325 9.505 7.989 1.00 0.77 S ATOM 1769 CE MET A 117 2.497 10.969 6.984 1.00 0.92 C ATOM 0 H MET A 117 -1.379 9.141 10.528 1.00 0.21 H new ATOM 0 HA MET A 117 1.359 10.131 10.665 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.038 10.732 8.919 1.00 0.38 H new ATOM 0 HB3 MET A 117 0.506 11.546 8.763 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.240 8.531 8.624 1.00 0.48 H new ATOM 0 HG3 MET A 117 0.068 9.555 7.212 1.00 0.48 H new ATOM 0 HE1 MET A 117 2.864 10.691 5.996 1.00 0.92 H new ATOM 0 HE2 MET A 117 1.528 11.459 6.887 1.00 0.92 H new ATOM 0 HE3 MET A 117 3.204 11.652 7.455 1.00 0.92 H new ATOM 1779 N ASP A 118 -0.987 11.519 12.221 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.265 12.538 13.229 1.00 0.34 C ATOM 1781 C ASP A 118 -0.128 12.564 14.224 1.00 0.33 C ATOM 1782 O ASP A 118 0.152 13.579 14.861 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.560 12.227 13.976 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.499 10.900 14.706 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.603 9.854 14.033 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -2.356 10.895 15.945 1.00 0.76 O ATOM 0 H ASP A 118 -1.624 10.723 12.245 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.368 13.502 12.731 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.764 13.024 14.691 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.390 12.213 13.269 1.00 0.39 H new ATOM 1791 N LYS A 119 0.497 11.411 14.361 1.00 0.23 N ATOM 1792 CA LYS A 119 1.638 11.240 15.242 1.00 0.26 C ATOM 1793 C LYS A 119 2.878 11.869 14.631 1.00 0.28 C ATOM 1794 O LYS A 119 3.163 11.666 13.454 1.00 0.26 O ATOM 1795 CB LYS A 119 1.890 9.747 15.491 1.00 0.29 C ATOM 1796 CG LYS A 119 0.757 9.036 16.209 1.00 0.36 C ATOM 1797 CD LYS A 119 1.067 7.558 16.414 1.00 0.72 C ATOM 1798 CE LYS A 119 2.318 7.352 17.257 1.00 0.87 C ATOM 1799 NZ LYS A 119 2.099 7.693 18.687 1.00 1.17 N ATOM 0 H LYS A 119 0.227 10.563 13.863 1.00 0.23 H new ATOM 0 HA LYS A 119 1.420 11.733 16.189 1.00 0.26 H new ATOM 0 HB2 LYS A 119 2.064 9.255 14.534 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.802 9.637 16.077 1.00 0.29 H new ATOM 0 HG2 LYS A 119 0.583 9.510 17.175 1.00 0.36 H new ATOM 0 HG3 LYS A 119 -0.162 9.140 15.633 1.00 0.36 H new ATOM 0 HD2 LYS A 119 0.219 7.073 16.898 1.00 0.72 H new ATOM 0 HD3 LYS A 119 1.199 7.077 15.445 1.00 0.72 H new ATOM 0 HE2 LYS A 119 2.639 6.313 17.179 1.00 0.87 H new ATOM 0 HE3 LYS A 119 3.126 7.966 16.859 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 2.936 8.186 19.058 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 1.267 8.311 18.773 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 1.941 6.821 19.232 1.00 1.17 H new ATOM 1813 N PRO A 120 3.634 12.650 15.417 1.00 0.38 N ATOM 1814 CA PRO A 120 4.928 13.191 14.980 1.00 0.45 C ATOM 1815 C PRO A 120 5.940 12.069 14.752 1.00 0.40 C ATOM 1816 O PRO A 120 6.971 12.252 14.106 1.00 0.45 O ATOM 1817 CB PRO A 120 5.366 14.083 16.146 1.00 0.57 C ATOM 1818 CG PRO A 120 4.581 13.609 17.323 1.00 0.58 C ATOM 1819 CD PRO A 120 3.280 13.088 16.779 1.00 0.48 C ATOM 0 HA PRO A 120 4.858 13.731 14.036 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.437 13.995 16.327 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.163 15.133 15.935 1.00 0.57 H new ATOM 0 HG2 PRO A 120 5.119 12.828 17.860 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.410 14.421 18.029 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.894 12.264 17.379 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.511 13.860 16.766 1.00 0.48 H new ATOM 1827 N GLU A 121 5.607 10.904 15.289 1.00 0.35 N ATOM 1828 CA GLU A 121 6.421 9.704 15.153 1.00 0.37 C ATOM 1829 C GLU A 121 6.173 9.037 13.806 1.00 0.30 C ATOM 1830 O GLU A 121 6.765 8.008 13.490 1.00 0.37 O ATOM 1831 CB GLU A 121 6.066 8.739 16.273 1.00 0.48 C ATOM 1832 CG GLU A 121 6.154 9.371 17.644 1.00 0.62 C ATOM 1833 CD GLU A 121 5.545 8.506 18.726 1.00 1.04 C ATOM 1834 OE1 GLU A 121 6.092 7.414 18.988 1.00 1.40 O ATOM 1835 OE2 GLU A 121 4.539 8.919 19.334 1.00 1.45 O ATOM 0 H GLU A 121 4.757 10.764 15.836 1.00 0.35 H new ATOM 0 HA GLU A 121 7.474 9.978 15.213 1.00 0.37 H new ATOM 0 HB2 GLU A 121 5.055 8.364 16.116 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.735 7.880 16.231 1.00 0.48 H new ATOM 0 HG2 GLU A 121 7.200 9.564 17.884 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.647 10.336 17.628 1.00 0.62 H new ATOM 1842 N ALA A 122 5.267 9.629 13.042 1.00 0.24 N ATOM 1843 CA ALA A 122 4.901 9.126 11.724 1.00 0.22 C ATOM 1844 C ALA A 122 6.114 8.973 10.824 1.00 0.21 C ATOM 1845 O ALA A 122 6.865 9.927 10.599 1.00 0.26 O ATOM 1846 CB ALA A 122 3.887 10.047 11.065 1.00 0.27 C ATOM 0 H ALA A 122 4.764 10.472 13.318 1.00 0.24 H new ATOM 0 HA ALA A 122 4.457 8.141 11.865 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.625 9.656 10.082 1.00 0.27 H new ATOM 0 HB2 ALA A 122 2.991 10.104 11.683 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.317 11.043 10.957 1.00 0.27 H new ATOM 1852 N ASN A 123 6.297 7.771 10.309 1.00 0.21 N ATOM 1853 CA ASN A 123 7.325 7.520 9.320 1.00 0.23 C ATOM 1854 C ASN A 123 6.702 6.804 8.142 1.00 0.23 C ATOM 1855 O ASN A 123 6.887 5.602 7.948 1.00 0.25 O ATOM 1856 CB ASN A 123 8.453 6.678 9.900 1.00 0.26 C ATOM 1857 CG ASN A 123 9.785 7.323 9.728 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.437 6.999 8.651 1.00 0.95 O flip ATOM 1859 ND2 ASN A 123 10.226 8.109 10.564 1.00 0.52 N flip ATOM 0 H ASN A 123 5.744 6.952 10.561 1.00 0.21 H new ATOM 0 HA ASN A 123 7.750 8.472 9.002 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.268 6.508 10.961 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.460 5.701 9.417 1.00 0.26 H new ATOM 0 HD21 ASN A 123 9.677 8.332 11.394 1.00 0.52 H new ATOM 0 HD22 ASN A 123 11.141 8.538 10.428 1.00 0.52 H new ATOM 1866 N PRO A 124 5.969 7.556 7.326 1.00 0.25 N ATOM 1867 CA PRO A 124 5.180 7.005 6.228 1.00 0.32 C ATOM 1868 C PRO A 124 6.028 6.333 5.183 1.00 0.33 C ATOM 1869 O PRO A 124 5.894 5.146 4.946 1.00 0.35 O ATOM 1870 CB PRO A 124 4.495 8.225 5.644 1.00 0.40 C ATOM 1871 CG PRO A 124 5.344 9.377 6.049 1.00 0.32 C ATOM 1872 CD PRO A 124 5.848 9.021 7.408 1.00 0.27 C ATOM 0 HA PRO A 124 4.494 6.232 6.573 1.00 0.32 H new ATOM 0 HB2 PRO A 124 4.420 8.153 4.559 1.00 0.40 H new ATOM 0 HB3 PRO A 124 3.480 8.329 6.028 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.166 9.528 5.349 1.00 0.32 H new ATOM 0 HG3 PRO A 124 4.770 10.303 6.070 1.00 0.32 H new ATOM 0 HD2 PRO A 124 6.805 9.496 7.624 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.155 9.328 8.192 1.00 0.27 H new ATOM 1880 N ASP A 125 6.915 7.105 4.588 1.00 0.37 N ATOM 1881 CA ASP A 125 7.811 6.612 3.546 1.00 0.44 C ATOM 1882 C ASP A 125 8.625 5.419 4.025 1.00 0.34 C ATOM 1883 O ASP A 125 9.148 4.657 3.220 1.00 0.33 O ATOM 1884 CB ASP A 125 8.751 7.721 3.100 1.00 0.61 C ATOM 1885 CG ASP A 125 8.024 8.833 2.370 1.00 0.99 C ATOM 1886 OD1 ASP A 125 7.268 9.585 3.019 1.00 1.44 O ATOM 1887 OD2 ASP A 125 8.203 8.960 1.137 1.00 1.13 O ATOM 0 H ASP A 125 7.040 8.093 4.809 1.00 0.37 H new ATOM 0 HA ASP A 125 7.195 6.289 2.707 1.00 0.44 H new ATOM 0 HB2 ASP A 125 9.261 8.134 3.970 1.00 0.61 H new ATOM 0 HB3 ASP A 125 9.519 7.303 2.449 1.00 0.61 H new ATOM 1892 N ARG A 126 8.707 5.237 5.333 1.00 0.31 N ATOM 1893 CA ARG A 126 9.444 4.103 5.879 1.00 0.31 C ATOM 1894 C ARG A 126 8.592 2.857 5.771 1.00 0.27 C ATOM 1895 O ARG A 126 8.979 1.874 5.144 1.00 0.30 O ATOM 1896 CB ARG A 126 9.835 4.354 7.336 1.00 0.35 C ATOM 1897 CG ARG A 126 10.443 3.151 8.049 1.00 0.51 C ATOM 1898 CD ARG A 126 11.706 2.655 7.358 1.00 1.24 C ATOM 1899 NE ARG A 126 11.507 1.361 6.697 1.00 1.92 N ATOM 1900 CZ ARG A 126 12.253 0.923 5.681 1.00 2.94 C ATOM 1901 NH1 ARG A 126 13.163 1.715 5.128 1.00 3.49 N ATOM 1902 NH2 ARG A 126 12.066 -0.299 5.192 1.00 3.79 N ATOM 0 H ARG A 126 8.280 5.848 6.029 1.00 0.31 H new ATOM 0 HA ARG A 126 10.362 3.969 5.306 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.548 5.178 7.370 1.00 0.35 H new ATOM 0 HB3 ARG A 126 8.950 4.676 7.885 1.00 0.35 H new ATOM 0 HG2 ARG A 126 10.676 3.420 9.079 1.00 0.51 H new ATOM 0 HG3 ARG A 126 9.711 2.345 8.088 1.00 0.51 H new ATOM 0 HD2 ARG A 126 12.027 3.391 6.621 1.00 1.24 H new ATOM 0 HD3 ARG A 126 12.508 2.567 8.091 1.00 1.24 H new ATOM 0 HE ARG A 126 10.754 0.761 7.034 1.00 1.92 H new ATOM 0 HH11 ARG A 126 13.295 2.663 5.479 1.00 3.49 H new ATOM 0 HH12 ARG A 126 13.731 1.375 4.352 1.00 3.49 H new ATOM 0 HH21 ARG A 126 11.350 -0.905 5.593 1.00 3.79 H new ATOM 0 HH22 ARG A 126 12.638 -0.631 4.415 1.00 3.79 H new ATOM 1916 N VAL A 127 7.413 2.936 6.360 1.00 0.25 N ATOM 1917 CA VAL A 127 6.460 1.826 6.344 1.00 0.28 C ATOM 1918 C VAL A 127 5.961 1.579 4.917 1.00 0.28 C ATOM 1919 O VAL A 127 5.546 0.481 4.546 1.00 0.33 O ATOM 1920 CB VAL A 127 5.296 2.110 7.325 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.883 2.535 8.651 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.321 3.177 6.827 1.00 0.44 C ATOM 0 H VAL A 127 7.085 3.762 6.861 1.00 0.25 H new ATOM 0 HA VAL A 127 6.957 0.915 6.679 1.00 0.28 H new ATOM 0 HB VAL A 127 4.716 1.192 7.419 1.00 0.36 H new ATOM 0 HG11 VAL A 127 5.078 2.740 9.356 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.514 1.737 9.042 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.481 3.435 8.512 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.533 3.323 7.566 1.00 0.44 H new ATOM 0 HG22 VAL A 127 4.855 4.115 6.676 1.00 0.44 H new ATOM 0 HG23 VAL A 127 3.880 2.855 5.884 1.00 0.44 H new ATOM 1932 N MET A 128 6.072 2.627 4.127 1.00 0.27 N ATOM 1933 CA MET A 128 5.768 2.623 2.707 1.00 0.31 C ATOM 1934 C MET A 128 6.785 1.772 1.943 1.00 0.26 C ATOM 1935 O MET A 128 6.428 0.962 1.082 1.00 0.35 O ATOM 1936 CB MET A 128 5.814 4.089 2.267 1.00 0.52 C ATOM 1937 CG MET A 128 5.457 4.390 0.834 1.00 0.81 C ATOM 1938 SD MET A 128 5.462 6.178 0.545 1.00 0.67 S ATOM 1939 CE MET A 128 4.210 6.381 -0.721 1.00 0.46 C ATOM 0 H MET A 128 6.387 3.536 4.465 1.00 0.27 H new ATOM 0 HA MET A 128 4.791 2.186 2.500 1.00 0.31 H new ATOM 0 HB2 MET A 128 5.140 4.656 2.909 1.00 0.52 H new ATOM 0 HB3 MET A 128 6.820 4.465 2.451 1.00 0.52 H new ATOM 0 HG2 MET A 128 6.169 3.905 0.166 1.00 0.81 H new ATOM 0 HG3 MET A 128 4.473 3.981 0.604 1.00 0.81 H new ATOM 0 HE1 MET A 128 4.666 6.793 -1.621 1.00 0.46 H new ATOM 0 HE2 MET A 128 3.764 5.413 -0.950 1.00 0.46 H new ATOM 0 HE3 MET A 128 3.437 7.061 -0.363 1.00 0.46 H new ATOM 1949 N GLN A 129 8.051 1.942 2.287 1.00 0.24 N ATOM 1950 CA GLN A 129 9.130 1.178 1.651 1.00 0.27 C ATOM 1951 C GLN A 129 9.079 -0.300 2.034 1.00 0.30 C ATOM 1952 O GLN A 129 9.455 -1.167 1.239 1.00 0.33 O ATOM 1953 CB GLN A 129 10.500 1.760 2.001 1.00 0.32 C ATOM 1954 CG GLN A 129 10.822 3.046 1.259 1.00 0.42 C ATOM 1955 CD GLN A 129 12.177 3.619 1.628 1.00 0.54 C ATOM 1956 OE1 GLN A 129 13.128 2.752 1.938 1.00 1.17 O flip ATOM 1957 NE2 GLN A 129 12.372 4.834 1.616 1.00 1.31 N flip ATOM 0 H GLN A 129 8.364 2.599 3.001 1.00 0.24 H new ATOM 0 HA GLN A 129 8.980 1.256 0.574 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.542 1.949 3.074 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.268 1.019 1.778 1.00 0.32 H new ATOM 0 HG2 GLN A 129 10.794 2.857 0.186 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.050 3.786 1.473 1.00 0.42 H new ATOM 0 HE21 GLN A 129 11.613 5.470 1.372 1.00 1.31 H new ATOM 0 HE22 GLN A 129 13.293 5.205 1.850 1.00 1.31 H new ATOM 1966 N GLU A 130 8.616 -0.587 3.246 1.00 0.37 N ATOM 1967 CA GLU A 130 8.467 -1.970 3.690 1.00 0.43 C ATOM 1968 C GLU A 130 7.478 -2.679 2.786 1.00 0.36 C ATOM 1969 O GLU A 130 7.644 -3.842 2.427 1.00 0.35 O ATOM 1970 CB GLU A 130 7.969 -2.034 5.130 1.00 0.61 C ATOM 1971 CG GLU A 130 8.581 -0.984 6.025 1.00 0.63 C ATOM 1972 CD GLU A 130 8.223 -1.169 7.486 1.00 1.04 C ATOM 1973 OE1 GLU A 130 7.036 -0.997 7.832 1.00 1.63 O ATOM 1974 OE2 GLU A 130 9.118 -1.483 8.290 1.00 1.64 O ATOM 0 H GLU A 130 8.339 0.113 3.934 1.00 0.37 H new ATOM 0 HA GLU A 130 9.441 -2.456 3.641 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.885 -1.919 5.137 1.00 0.61 H new ATOM 0 HB3 GLU A 130 8.188 -3.021 5.538 1.00 0.61 H new ATOM 0 HG2 GLU A 130 9.665 -1.009 5.916 1.00 0.63 H new ATOM 0 HG3 GLU A 130 8.251 0.002 5.698 1.00 0.63 H new ATOM 1981 N LEU A 131 6.452 -1.953 2.387 1.00 0.36 N ATOM 1982 CA LEU A 131 5.471 -2.505 1.486 1.00 0.37 C ATOM 1983 C LEU A 131 6.127 -2.862 0.167 1.00 0.29 C ATOM 1984 O LEU A 131 5.782 -3.866 -0.446 1.00 0.32 O ATOM 1985 CB LEU A 131 4.323 -1.529 1.269 1.00 0.49 C ATOM 1986 CG LEU A 131 3.127 -1.698 2.211 1.00 0.71 C ATOM 1987 CD1 LEU A 131 3.560 -1.912 3.643 1.00 1.36 C ATOM 1988 CD2 LEU A 131 2.253 -0.478 2.154 1.00 1.18 C ATOM 0 H LEU A 131 6.280 -0.989 2.672 1.00 0.36 H new ATOM 0 HA LEU A 131 5.059 -3.410 1.931 1.00 0.37 H new ATOM 0 HB2 LEU A 131 4.707 -0.514 1.376 1.00 0.49 H new ATOM 0 HB3 LEU A 131 3.972 -1.631 0.242 1.00 0.49 H new ATOM 0 HG LEU A 131 2.579 -2.580 1.878 1.00 0.71 H new ATOM 0 HD11 LEU A 131 2.680 -2.027 4.276 1.00 1.36 H new ATOM 0 HD12 LEU A 131 4.173 -2.811 3.707 1.00 1.36 H new ATOM 0 HD13 LEU A 131 4.140 -1.053 3.980 1.00 1.36 H new ATOM 0 HD21 LEU A 131 1.405 -0.606 2.827 1.00 1.18 H new ATOM 0 HD22 LEU A 131 2.828 0.396 2.458 1.00 1.18 H new ATOM 0 HD23 LEU A 131 1.890 -0.337 1.136 1.00 1.18 H new ATOM 2000 N MET A 132 7.099 -2.059 -0.263 1.00 0.25 N ATOM 2001 CA MET A 132 7.775 -2.342 -1.518 1.00 0.26 C ATOM 2002 C MET A 132 8.657 -3.575 -1.420 1.00 0.30 C ATOM 2003 O MET A 132 9.033 -4.147 -2.441 1.00 0.37 O ATOM 2004 CB MET A 132 8.625 -1.182 -2.005 1.00 0.32 C ATOM 2005 CG MET A 132 7.975 0.162 -1.839 1.00 0.88 C ATOM 2006 SD MET A 132 8.143 1.165 -3.320 1.00 1.60 S ATOM 2007 CE MET A 132 9.884 0.968 -3.677 1.00 1.61 C ATOM 0 H MET A 132 7.427 -1.228 0.229 1.00 0.25 H new ATOM 0 HA MET A 132 6.975 -2.516 -2.238 1.00 0.26 H new ATOM 0 HB2 MET A 132 9.571 -1.186 -1.464 1.00 0.32 H new ATOM 0 HB3 MET A 132 8.859 -1.334 -3.059 1.00 0.32 H new ATOM 0 HG2 MET A 132 6.918 0.030 -1.606 1.00 0.88 H new ATOM 0 HG3 MET A 132 8.425 0.682 -0.993 1.00 0.88 H new ATOM 0 HE1 MET A 132 10.270 1.884 -4.124 1.00 1.61 H new ATOM 0 HE2 MET A 132 10.424 0.760 -2.753 1.00 1.61 H new ATOM 0 HE3 MET A 132 10.021 0.140 -4.372 1.00 1.61 H new ATOM 2017 N GLU A 133 8.997 -3.999 -0.207 1.00 0.32 N ATOM 2018 CA GLU A 133 9.769 -5.219 -0.064 1.00 0.40 C ATOM 2019 C GLU A 133 8.826 -6.398 -0.221 1.00 0.38 C ATOM 2020 O GLU A 133 9.241 -7.528 -0.472 1.00 0.45 O ATOM 2021 CB GLU A 133 10.525 -5.279 1.264 1.00 0.54 C ATOM 2022 CG GLU A 133 9.709 -5.784 2.439 1.00 0.79 C ATOM 2023 CD GLU A 133 10.582 -6.181 3.608 1.00 1.07 C ATOM 2024 OE1 GLU A 133 11.158 -5.284 4.260 1.00 1.67 O ATOM 2025 OE2 GLU A 133 10.717 -7.394 3.865 1.00 1.53 O ATOM 0 H GLU A 133 8.757 -3.529 0.666 1.00 0.32 H new ATOM 0 HA GLU A 133 10.535 -5.248 -0.839 1.00 0.40 H new ATOM 0 HB2 GLU A 133 11.396 -5.923 1.141 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.897 -4.282 1.500 1.00 0.54 H new ATOM 0 HG2 GLU A 133 9.011 -5.009 2.755 1.00 0.79 H new ATOM 0 HG3 GLU A 133 9.113 -6.641 2.125 1.00 0.79 H new ATOM 2032 N TYR A 134 7.540 -6.104 -0.080 1.00 0.35 N ATOM 2033 CA TYR A 134 6.494 -7.042 -0.451 1.00 0.40 C ATOM 2034 C TYR A 134 5.977 -6.687 -1.844 1.00 0.41 C ATOM 2035 O TYR A 134 4.856 -7.025 -2.232 1.00 0.50 O ATOM 2036 CB TYR A 134 5.388 -7.023 0.587 1.00 0.46 C ATOM 2037 CG TYR A 134 5.836 -7.559 1.928 1.00 0.55 C ATOM 2038 CD1 TYR A 134 6.266 -8.874 2.076 1.00 0.98 C ATOM 2039 CD2 TYR A 134 5.809 -6.752 3.057 1.00 0.88 C ATOM 2040 CE1 TYR A 134 6.653 -9.362 3.307 1.00 1.08 C ATOM 2041 CE2 TYR A 134 6.193 -7.234 4.291 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.713 -8.547 4.376 1.00 0.80 C ATOM 2043 OH TYR A 134 6.989 -9.023 5.644 1.00 0.95 O ATOM 0 H TYR A 134 7.197 -5.218 0.291 1.00 0.35 H new ATOM 0 HA TYR A 134 6.890 -8.057 -0.483 1.00 0.40 H new ATOM 0 HB2 TYR A 134 5.029 -6.001 0.710 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.547 -7.615 0.226 1.00 0.46 H new ATOM 0 HD1 TYR A 134 6.297 -9.523 1.213 1.00 0.98 H new ATOM 0 HD2 TYR A 134 5.481 -5.727 2.968 1.00 0.88 H new ATOM 0 HE1 TYR A 134 6.910 -10.406 3.413 1.00 1.08 H new ATOM 0 HE2 TYR A 134 6.099 -6.621 5.175 1.00 0.95 H new ATOM 0 HH TYR A 134 6.989 -8.278 6.280 1.00 0.95 H new ATOM 2053 N ASN A 135 6.849 -5.992 -2.578 1.00 0.36 N ATOM 2054 CA ASN A 135 6.604 -5.522 -3.938 1.00 0.43 C ATOM 2055 C ASN A 135 5.323 -4.693 -4.029 1.00 0.48 C ATOM 2056 O ASN A 135 4.433 -4.969 -4.835 1.00 0.64 O ATOM 2057 CB ASN A 135 6.588 -6.692 -4.929 1.00 0.58 C ATOM 2058 CG ASN A 135 6.542 -6.240 -6.372 1.00 0.71 C ATOM 2059 OD1 ASN A 135 6.915 -5.114 -6.697 1.00 0.89 O ATOM 2060 ND2 ASN A 135 6.141 -7.134 -7.250 1.00 1.10 N ATOM 0 H ASN A 135 7.772 -5.734 -2.229 1.00 0.36 H new ATOM 0 HA ASN A 135 7.429 -4.864 -4.212 1.00 0.43 H new ATOM 0 HB2 ASN A 135 7.476 -7.305 -4.774 1.00 0.58 H new ATOM 0 HB3 ASN A 135 5.724 -7.324 -4.724 1.00 0.58 H new ATOM 0 HD21 ASN A 135 6.132 -6.904 -8.244 1.00 1.10 H new ATOM 0 HD22 ASN A 135 5.840 -8.057 -6.937 1.00 1.10 H new ATOM 2067 N LEU A 136 5.231 -3.688 -3.175 1.00 0.44 N ATOM 2068 CA LEU A 136 4.152 -2.731 -3.227 1.00 0.54 C ATOM 2069 C LEU A 136 4.704 -1.340 -3.405 1.00 0.41 C ATOM 2070 O LEU A 136 5.102 -0.691 -2.443 1.00 0.47 O ATOM 2071 CB LEU A 136 3.350 -2.800 -1.959 1.00 0.78 C ATOM 2072 CG LEU A 136 2.631 -4.114 -1.739 1.00 0.64 C ATOM 2073 CD1 LEU A 136 2.115 -4.185 -0.317 1.00 1.36 C ATOM 2074 CD2 LEU A 136 1.508 -4.254 -2.749 1.00 1.17 C ATOM 0 H LEU A 136 5.905 -3.517 -2.428 1.00 0.44 H new ATOM 0 HA LEU A 136 3.508 -2.969 -4.074 1.00 0.54 H new ATOM 0 HB2 LEU A 136 4.014 -2.618 -1.114 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.615 -1.995 -1.965 1.00 0.78 H new ATOM 0 HG LEU A 136 3.322 -4.944 -1.885 1.00 0.64 H new ATOM 0 HD11 LEU A 136 1.598 -5.133 -0.164 1.00 1.36 H new ATOM 0 HD12 LEU A 136 2.952 -4.112 0.378 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.423 -3.362 -0.140 1.00 1.36 H new ATOM 0 HD21 LEU A 136 0.991 -5.200 -2.590 1.00 1.17 H new ATOM 0 HD22 LEU A 136 0.804 -3.431 -2.627 1.00 1.17 H new ATOM 0 HD23 LEU A 136 1.921 -4.231 -3.758 1.00 1.17 H new ATOM 2086 N VAL A 137 4.725 -0.893 -4.637 1.00 0.31 N ATOM 2087 CA VAL A 137 5.341 0.378 -4.950 1.00 0.27 C ATOM 2088 C VAL A 137 4.297 1.455 -5.179 1.00 0.29 C ATOM 2089 O VAL A 137 3.409 1.314 -6.017 1.00 0.33 O ATOM 2090 CB VAL A 137 6.256 0.286 -6.172 1.00 0.29 C ATOM 2091 CG1 VAL A 137 6.907 1.640 -6.441 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.291 -0.805 -5.953 1.00 0.41 C ATOM 0 H VAL A 137 4.326 -1.385 -5.436 1.00 0.31 H new ATOM 0 HA VAL A 137 5.948 0.648 -4.086 1.00 0.27 H new ATOM 0 HB VAL A 137 5.671 0.022 -7.053 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.557 1.565 -7.313 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.134 2.385 -6.628 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.496 1.939 -5.574 1.00 0.43 H new ATOM 0 HG21 VAL A 137 7.942 -0.869 -6.825 1.00 0.41 H new ATOM 0 HG22 VAL A 137 7.887 -0.569 -5.071 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.787 -1.760 -5.805 1.00 0.41 H new ATOM 2102 N PRO A 138 4.388 2.514 -4.378 1.00 0.34 N ATOM 2103 CA PRO A 138 3.567 3.703 -4.488 1.00 0.43 C ATOM 2104 C PRO A 138 3.348 4.165 -5.910 1.00 0.43 C ATOM 2105 O PRO A 138 4.238 4.104 -6.761 1.00 0.45 O ATOM 2106 CB PRO A 138 4.378 4.749 -3.745 1.00 0.53 C ATOM 2107 CG PRO A 138 5.151 3.997 -2.727 1.00 0.54 C ATOM 2108 CD PRO A 138 5.280 2.590 -3.224 1.00 0.39 C ATOM 0 HA PRO A 138 2.567 3.521 -4.095 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.040 5.287 -4.423 1.00 0.53 H new ATOM 0 HB3 PRO A 138 3.730 5.490 -3.278 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.134 4.446 -2.580 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.643 4.020 -1.763 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.309 2.363 -3.504 1.00 0.39 H new ATOM 0 HD3 PRO A 138 4.993 1.872 -2.456 1.00 0.39 H new ATOM 2116 N GLU A 139 2.159 4.667 -6.131 1.00 0.48 N ATOM 2117 CA GLU A 139 1.788 5.235 -7.422 1.00 0.56 C ATOM 2118 C GLU A 139 2.461 6.582 -7.590 1.00 0.56 C ATOM 2119 O GLU A 139 2.636 7.082 -8.704 1.00 0.64 O ATOM 2120 CB GLU A 139 0.275 5.385 -7.536 1.00 0.71 C ATOM 2121 CG GLU A 139 -0.426 4.128 -8.012 1.00 1.35 C ATOM 2122 CD GLU A 139 -0.077 3.791 -9.440 1.00 2.40 C ATOM 2123 OE1 GLU A 139 0.920 3.081 -9.658 1.00 3.08 O ATOM 2124 OE2 GLU A 139 -0.786 4.260 -10.355 1.00 2.78 O ATOM 0 H GLU A 139 1.418 4.698 -5.431 1.00 0.48 H new ATOM 0 HA GLU A 139 2.119 4.560 -8.211 1.00 0.56 H new ATOM 0 HB2 GLU A 139 -0.128 5.669 -6.564 1.00 0.71 H new ATOM 0 HB3 GLU A 139 0.050 6.199 -8.225 1.00 0.71 H new ATOM 0 HG2 GLU A 139 -0.153 3.294 -7.366 1.00 1.35 H new ATOM 0 HG3 GLU A 139 -1.504 4.259 -7.924 1.00 1.35 H new ATOM 2131 N GLU A 140 2.827 7.161 -6.459 1.00 0.54 N ATOM 2132 CA GLU A 140 3.614 8.380 -6.417 1.00 0.60 C ATOM 2133 C GLU A 140 5.042 8.112 -6.868 1.00 0.56 C ATOM 2134 O GLU A 140 5.754 9.034 -7.270 1.00 0.65 O ATOM 2135 CB GLU A 140 3.619 8.984 -5.003 1.00 0.67 C ATOM 2136 CG GLU A 140 3.376 7.980 -3.888 1.00 0.63 C ATOM 2137 CD GLU A 140 1.910 7.625 -3.731 1.00 1.12 C ATOM 2138 OE1 GLU A 140 1.145 8.475 -3.243 1.00 1.27 O ATOM 2139 OE2 GLU A 140 1.524 6.500 -4.118 1.00 1.57 O ATOM 0 H GLU A 140 2.584 6.795 -5.538 1.00 0.54 H new ATOM 0 HA GLU A 140 3.155 9.095 -7.099 1.00 0.60 H new ATOM 0 HB2 GLU A 140 4.579 9.471 -4.833 1.00 0.67 H new ATOM 0 HB3 GLU A 140 2.854 9.759 -4.950 1.00 0.67 H new ATOM 0 HG2 GLU A 140 3.946 7.073 -4.090 1.00 0.63 H new ATOM 0 HG3 GLU A 140 3.750 8.388 -2.949 1.00 0.63 H new ATOM 2146 N TRP A 141 5.472 6.850 -6.794 1.00 0.47 N ATOM 2147 CA TRP A 141 6.821 6.499 -7.157 1.00 0.49 C ATOM 2148 C TRP A 141 6.855 5.855 -8.531 1.00 0.51 C ATOM 2149 O TRP A 141 7.800 6.048 -9.295 1.00 0.66 O ATOM 2150 CB TRP A 141 7.418 5.577 -6.113 1.00 0.45 C ATOM 2151 CG TRP A 141 7.498 6.178 -4.737 1.00 0.46 C ATOM 2152 CD1 TRP A 141 7.101 7.425 -4.338 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.006 5.536 -3.572 1.00 0.44 C ATOM 2154 NE1 TRP A 141 7.327 7.587 -2.996 1.00 0.55 N ATOM 2155 CE2 TRP A 141 7.886 6.440 -2.503 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.546 4.280 -3.335 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.292 6.118 -1.212 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 8.945 3.954 -2.056 1.00 0.50 C ATOM 2159 CH2 TRP A 141 8.816 4.870 -1.005 1.00 0.52 C ATOM 0 H TRP A 141 4.897 6.066 -6.485 1.00 0.47 H new ATOM 0 HA TRP A 141 7.421 7.408 -7.198 1.00 0.49 H new ATOM 0 HB2 TRP A 141 6.822 4.665 -6.066 1.00 0.45 H new ATOM 0 HB3 TRP A 141 8.420 5.287 -6.430 1.00 0.45 H new ATOM 0 HD1 TRP A 141 6.671 8.174 -4.987 1.00 0.54 H new ATOM 0 HE1 TRP A 141 7.114 8.425 -2.454 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.652 3.568 -4.140 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.197 6.827 -0.402 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 9.363 2.977 -1.862 1.00 0.50 H new ATOM 0 HH2 TRP A 141 9.136 4.587 -0.013 1.00 0.52 H new ATOM 2170 N GLY A 142 5.808 5.106 -8.848 1.00 0.45 N ATOM 2171 CA GLY A 142 5.706 4.493 -10.155 1.00 0.50 C ATOM 2172 C GLY A 142 5.573 2.988 -10.083 1.00 0.45 C ATOM 2173 O GLY A 142 6.026 2.280 -10.979 1.00 0.53 O ATOM 0 H GLY A 142 5.027 4.912 -8.222 1.00 0.45 H new ATOM 0 HA2 GLY A 142 4.844 4.905 -10.679 1.00 0.50 H new ATOM 0 HA3 GLY A 142 6.588 4.748 -10.742 1.00 0.50 H new ATOM 2177 N GLY A 143 4.979 2.492 -9.007 1.00 0.39 N ATOM 2178 CA GLY A 143 4.740 1.066 -8.891 1.00 0.41 C ATOM 2179 C GLY A 143 3.345 0.676 -9.327 1.00 0.45 C ATOM 2180 O GLY A 143 3.011 0.765 -10.513 1.00 0.60 O ATOM 0 H GLY A 143 4.659 3.048 -8.214 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.470 0.528 -9.496 1.00 0.41 H new ATOM 0 HA3 GLY A 143 4.894 0.758 -7.857 1.00 0.41 H new ATOM 2184 N ASP A 144 2.532 0.233 -8.374 1.00 0.40 N ATOM 2185 CA ASP A 144 1.141 -0.101 -8.651 1.00 0.45 C ATOM 2186 C ASP A 144 0.319 -0.175 -7.358 1.00 0.33 C ATOM 2187 O ASP A 144 -0.313 -1.192 -7.022 1.00 0.35 O ATOM 2188 CB ASP A 144 1.048 -1.426 -9.430 1.00 0.64 C ATOM 2189 CG ASP A 144 1.725 -2.599 -8.729 1.00 1.33 C ATOM 2190 OD1 ASP A 144 2.970 -2.598 -8.614 1.00 1.91 O ATOM 2191 OD2 ASP A 144 1.011 -3.519 -8.266 1.00 1.91 O ATOM 0 H ASP A 144 2.813 0.097 -7.403 1.00 0.40 H new ATOM 0 HA ASP A 144 0.722 0.694 -9.268 1.00 0.45 H new ATOM 0 HB2 ASP A 144 -0.002 -1.669 -9.593 1.00 0.64 H new ATOM 0 HB3 ASP A 144 1.500 -1.292 -10.413 1.00 0.64 H new ATOM 2196 N THR A 145 0.281 0.947 -6.664 1.00 0.26 N ATOM 2197 CA THR A 145 -0.462 1.067 -5.427 1.00 0.24 C ATOM 2198 C THR A 145 -0.629 2.532 -5.050 1.00 0.27 C ATOM 2199 O THR A 145 0.358 3.221 -4.802 1.00 0.37 O ATOM 2200 CB THR A 145 0.244 0.338 -4.261 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.292 -1.077 -4.495 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.475 0.614 -2.954 1.00 0.30 C ATOM 0 H THR A 145 0.765 1.800 -6.943 1.00 0.26 H new ATOM 0 HA THR A 145 -1.435 0.605 -5.594 1.00 0.24 H new ATOM 0 HB THR A 145 1.264 0.716 -4.198 1.00 0.25 H new ATOM 0 HG1 THR A 145 -0.268 -1.300 -5.268 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.034 0.094 -2.142 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.472 1.686 -2.756 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.504 0.261 -3.023 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.859 3.021 -5.012 1.00 0.26 N ATOM 2211 CA ILE A 146 -2.099 4.362 -4.528 1.00 0.28 C ATOM 2212 C ILE A 146 -1.870 4.396 -3.028 1.00 0.23 C ATOM 2213 O ILE A 146 -2.651 3.852 -2.248 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.522 4.855 -4.862 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.649 5.184 -6.350 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.885 6.061 -4.014 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.872 6.416 -6.766 1.00 0.63 C ATOM 0 H ILE A 146 -2.693 2.514 -5.307 1.00 0.26 H new ATOM 0 HA ILE A 146 -1.403 5.035 -5.030 1.00 0.28 H new ATOM 0 HB ILE A 146 -4.221 4.051 -4.631 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -3.302 4.331 -6.933 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.702 5.329 -6.593 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.892 6.393 -4.265 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.845 5.789 -2.959 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -3.178 6.868 -4.208 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -3.008 6.589 -7.834 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -3.235 7.280 -6.209 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.813 6.267 -6.555 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.762 4.986 -2.645 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.408 5.114 -1.251 1.00 0.30 C ATOM 2231 C PHE A 147 -0.981 6.397 -0.669 1.00 0.32 C ATOM 2232 O PHE A 147 -0.604 7.495 -1.066 1.00 0.50 O ATOM 2233 CB PHE A 147 1.099 5.143 -1.101 1.00 0.41 C ATOM 2234 CG PHE A 147 1.740 3.799 -0.951 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.814 2.941 -2.022 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.283 3.405 0.259 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.417 1.711 -1.903 1.00 0.33 C ATOM 2238 CE2 PHE A 147 2.892 2.173 0.387 1.00 0.36 C ATOM 2239 CZ PHE A 147 2.959 1.323 -0.697 1.00 0.33 C ATOM 0 H PHE A 147 -0.082 5.390 -3.289 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.820 4.258 -0.716 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.527 5.639 -1.972 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.352 5.750 -0.232 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.392 3.237 -2.971 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.230 4.067 1.111 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.466 1.049 -2.755 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.315 1.875 1.335 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.434 0.358 -0.601 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.892 6.262 0.259 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.407 7.411 0.971 1.00 0.27 C ATOM 2251 C CYS A 148 -1.795 7.503 2.362 1.00 0.31 C ATOM 2252 O CYS A 148 -1.972 6.613 3.184 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.924 7.333 1.054 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.746 7.449 -0.551 1.00 0.68 S ATOM 0 H CYS A 148 -2.295 5.369 0.542 1.00 0.26 H new ATOM 0 HA CYS A 148 -2.132 8.313 0.424 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -4.205 6.393 1.529 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -4.286 8.136 1.696 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.075 6.259 -0.957 1.00 0.68 H new ATOM 2260 N LYS A 149 -1.053 8.570 2.610 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.466 8.811 3.924 1.00 0.28 C ATOM 2262 C LYS A 149 -1.449 9.615 4.764 1.00 0.28 C ATOM 2263 O LYS A 149 -1.615 10.815 4.552 1.00 0.40 O ATOM 2264 CB LYS A 149 0.856 9.573 3.783 1.00 0.36 C ATOM 2265 CG LYS A 149 1.834 8.914 2.821 1.00 0.56 C ATOM 2266 CD LYS A 149 3.085 9.758 2.619 1.00 0.89 C ATOM 2267 CE LYS A 149 3.964 9.176 1.525 1.00 1.01 C ATOM 2268 NZ LYS A 149 5.203 9.970 1.306 1.00 1.44 N ATOM 0 H LYS A 149 -0.841 9.288 1.917 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.261 7.858 4.412 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.648 10.586 3.440 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.324 9.658 4.764 1.00 0.36 H new ATOM 0 HG2 LYS A 149 2.115 7.933 3.204 1.00 0.56 H new ATOM 0 HG3 LYS A 149 1.345 8.753 1.860 1.00 0.56 H new ATOM 0 HD2 LYS A 149 2.802 10.778 2.359 1.00 0.89 H new ATOM 0 HD3 LYS A 149 3.647 9.811 3.552 1.00 0.89 H new ATOM 0 HE2 LYS A 149 4.234 8.153 1.786 1.00 1.01 H new ATOM 0 HE3 LYS A 149 3.398 9.129 0.595 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 5.751 9.551 0.528 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 4.950 10.949 1.063 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 5.776 9.966 2.174 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.124 8.959 5.697 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.192 9.611 6.420 1.00 0.22 C ATOM 2284 C LEU A 150 -3.141 9.348 7.921 1.00 0.19 C ATOM 2285 O LEU A 150 -2.232 8.731 8.460 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.540 9.147 5.863 1.00 0.25 C ATOM 2287 CG LEU A 150 -4.875 7.674 6.028 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -5.738 7.438 7.253 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -5.548 7.138 4.777 1.00 0.84 C ATOM 0 H LEU A 150 -1.951 7.990 5.964 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.067 10.685 6.281 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.326 9.731 6.343 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.570 9.386 4.800 1.00 0.25 H new ATOM 0 HG LEU A 150 -3.942 7.131 6.175 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -5.960 6.375 7.342 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -5.206 7.774 8.143 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -6.669 7.996 7.155 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -5.781 6.082 4.913 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -6.469 7.692 4.594 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -4.878 7.255 3.925 1.00 0.84 H new ATOM 2301 N SER A 151 -4.162 9.828 8.565 1.00 0.26 N ATOM 2302 CA SER A 151 -4.421 9.605 9.963 1.00 0.29 C ATOM 2303 C SER A 151 -5.910 9.701 10.147 1.00 0.25 C ATOM 2304 O SER A 151 -6.510 10.733 9.837 1.00 0.29 O ATOM 2305 CB SER A 151 -3.742 10.619 10.863 1.00 0.46 C ATOM 2306 OG SER A 151 -4.261 10.521 12.174 1.00 1.77 O ATOM 0 H SER A 151 -4.869 10.410 8.116 1.00 0.26 H new ATOM 0 HA SER A 151 -4.023 8.630 10.244 1.00 0.29 H new ATOM 0 HB2 SER A 151 -2.666 10.445 10.874 1.00 0.46 H new ATOM 0 HB3 SER A 151 -3.898 11.625 10.475 1.00 0.46 H new ATOM 0 HG SER A 151 -3.689 9.933 12.709 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.518 8.630 10.588 1.00 0.28 N ATOM 2313 CA ALA A 152 -7.929 8.666 10.877 1.00 0.31 C ATOM 2314 C ALA A 152 -8.148 9.311 12.226 1.00 0.33 C ATOM 2315 O ALA A 152 -9.280 9.573 12.631 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.518 7.280 10.826 1.00 0.41 C ATOM 0 H ALA A 152 -6.065 7.731 10.754 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.439 9.262 10.120 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.584 7.329 11.047 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -8.373 6.859 9.831 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -8.024 6.647 11.563 1.00 0.41 H new ATOM 2322 N LYS A 153 -7.049 9.556 12.926 1.00 0.30 N ATOM 2323 CA LYS A 153 -7.098 10.315 14.147 1.00 0.34 C ATOM 2324 C LYS A 153 -7.299 11.796 13.839 1.00 0.36 C ATOM 2325 O LYS A 153 -8.241 12.412 14.334 1.00 0.49 O ATOM 2326 CB LYS A 153 -5.831 10.109 14.953 1.00 0.35 C ATOM 2327 CG LYS A 153 -6.091 10.039 16.437 1.00 0.60 C ATOM 2328 CD LYS A 153 -6.701 11.334 16.944 1.00 1.12 C ATOM 2329 CE LYS A 153 -7.146 11.240 18.389 1.00 1.65 C ATOM 2330 NZ LYS A 153 -7.845 12.480 18.819 1.00 2.30 N ATOM 0 H LYS A 153 -6.117 9.236 12.661 1.00 0.30 H new ATOM 0 HA LYS A 153 -7.942 9.964 14.740 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.345 9.189 14.629 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.138 10.925 14.748 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -6.762 9.208 16.654 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -5.158 9.841 16.964 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -5.973 12.139 16.843 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -7.555 11.598 16.321 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -7.809 10.384 18.513 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -6.280 11.067 19.028 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -8.138 12.387 19.812 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -7.202 13.292 18.722 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -8.684 12.630 18.223 1.00 2.30 H new ATOM 2344 N THR A 154 -6.424 12.374 13.015 1.00 0.30 N ATOM 2345 CA THR A 154 -6.566 13.785 12.667 1.00 0.39 C ATOM 2346 C THR A 154 -7.573 13.987 11.542 1.00 0.36 C ATOM 2347 O THR A 154 -7.943 15.119 11.220 1.00 0.41 O ATOM 2348 CB THR A 154 -5.222 14.428 12.283 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.406 13.489 11.570 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.489 14.926 13.519 1.00 0.70 C ATOM 0 H THR A 154 -5.629 11.900 12.586 1.00 0.30 H new ATOM 0 HA THR A 154 -6.936 14.282 13.564 1.00 0.39 H new ATOM 0 HB THR A 154 -5.425 15.281 11.636 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.766 13.973 11.008 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.542 15.377 13.223 1.00 0.70 H new ATOM 0 HG22 THR A 154 -5.101 15.670 14.030 1.00 0.70 H new ATOM 0 HG23 THR A 154 -4.299 14.089 14.191 1.00 0.70 H new ATOM 2358 N LYS A 155 -8.000 12.871 10.945 1.00 0.30 N ATOM 2359 CA LYS A 155 -9.060 12.869 9.933 1.00 0.32 C ATOM 2360 C LYS A 155 -8.635 13.605 8.684 1.00 0.34 C ATOM 2361 O LYS A 155 -9.427 14.307 8.058 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.343 13.491 10.479 1.00 0.38 C ATOM 2363 CG LYS A 155 -11.088 12.580 11.420 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.322 11.228 10.775 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.332 10.415 11.567 1.00 0.61 C ATOM 2366 NZ LYS A 155 -11.923 10.249 12.988 1.00 1.36 N ATOM 0 H LYS A 155 -7.622 11.946 11.149 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.251 11.827 9.676 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -10.098 14.418 10.998 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -10.995 13.755 9.646 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.520 12.456 12.342 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -12.043 13.030 11.692 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.680 11.365 9.755 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.380 10.683 10.712 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -13.305 10.905 11.525 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -12.449 9.434 11.106 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -12.499 9.505 13.431 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -10.919 9.981 13.031 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -12.064 11.145 13.497 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.396 13.408 8.302 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.843 14.165 7.184 1.00 0.33 C ATOM 2382 C GLU A 156 -6.902 13.345 5.916 1.00 0.28 C ATOM 2383 O GLU A 156 -7.658 13.622 4.974 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.389 14.550 7.466 1.00 0.40 C ATOM 2385 CG GLU A 156 -5.188 15.159 8.833 1.00 1.30 C ATOM 2386 CD GLU A 156 -3.757 15.586 9.081 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -3.353 16.656 8.579 1.00 1.52 O ATOM 2388 OE2 GLU A 156 -3.027 14.855 9.783 1.00 2.48 O ATOM 0 H GLU A 156 -6.754 12.744 8.734 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.438 15.070 7.059 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -4.761 13.664 7.375 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -5.054 15.258 6.708 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -5.844 16.023 8.941 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -5.484 14.437 9.594 1.00 1.30 H new ATOM 2395 N GLY A 157 -6.112 12.302 5.931 1.00 0.29 N ATOM 2396 CA GLY A 157 -5.941 11.480 4.772 1.00 0.28 C ATOM 2397 C GLY A 157 -7.176 10.679 4.400 1.00 0.27 C ATOM 2398 O GLY A 157 -7.222 10.119 3.316 1.00 0.29 O ATOM 0 H GLY A 157 -5.574 12.004 6.745 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.661 12.111 3.929 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.112 10.793 4.944 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.172 10.605 5.285 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.383 9.859 4.976 1.00 0.28 C ATOM 2404 C LEU A 158 -10.142 10.551 3.863 1.00 0.30 C ATOM 2405 O LEU A 158 -10.708 9.914 2.972 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.273 9.730 6.209 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.778 8.751 7.273 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.786 8.648 8.406 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.521 7.377 6.666 1.00 0.80 C ATOM 0 H LEU A 158 -8.162 11.046 6.205 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.098 8.858 4.653 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.378 10.714 6.665 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.267 9.420 5.888 1.00 0.31 H new ATOM 0 HG LEU A 158 -8.838 9.129 7.674 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.420 7.947 9.156 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -10.923 9.629 8.862 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.739 8.294 8.014 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.169 6.697 7.442 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.445 6.991 6.236 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.764 7.460 5.886 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.121 11.870 3.910 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.768 12.666 2.892 1.00 0.38 C ATOM 2423 C ASP A 159 -9.966 12.584 1.600 1.00 0.32 C ATOM 2424 O ASP A 159 -10.521 12.415 0.518 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.897 14.118 3.347 1.00 0.50 C ATOM 2426 CG ASP A 159 -11.943 14.879 2.560 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -13.131 14.812 2.939 1.00 2.20 O ATOM 2428 OD2 ASP A 159 -11.586 15.555 1.575 1.00 1.42 O ATOM 0 H ASP A 159 -9.662 12.410 4.644 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.771 12.276 2.718 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -11.154 14.143 4.406 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -9.933 14.616 3.241 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.644 12.666 1.742 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.732 12.545 0.600 1.00 0.30 C ATOM 2435 C HIS A 160 -7.760 11.120 0.026 1.00 0.28 C ATOM 2436 O HIS A 160 -7.395 10.897 -1.128 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.306 12.934 1.033 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.243 12.745 -0.014 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -4.959 13.678 -0.995 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.379 11.721 -0.218 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -3.966 13.232 -1.749 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.600 12.049 -1.296 1.00 0.54 N ATOM 0 H HIS A 160 -8.178 12.816 2.637 1.00 0.30 H new ATOM 0 HA HIS A 160 -8.060 13.224 -0.187 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.309 13.980 1.339 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -6.037 12.346 1.911 1.00 0.34 H new ATOM 0 HD2 HIS A 160 -4.316 10.813 0.363 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -3.530 13.749 -2.591 1.00 0.58 H new ATOM 0 HE2 HIS A 160 -2.856 11.471 -1.686 1.00 0.54 H new ATOM 2451 N LEU A 161 -8.211 10.170 0.836 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.279 8.767 0.436 1.00 0.28 C ATOM 2453 C LEU A 161 -9.293 8.585 -0.675 1.00 0.29 C ATOM 2454 O LEU A 161 -8.967 8.096 -1.756 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.672 7.901 1.634 1.00 0.29 C ATOM 2456 CG LEU A 161 -8.741 6.393 1.369 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.367 5.839 1.034 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -9.330 5.671 2.569 1.00 1.16 C ATOM 0 H LEU A 161 -8.539 10.348 1.785 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.297 8.461 0.075 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -7.957 8.078 2.437 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.645 8.233 1.995 1.00 0.29 H new ATOM 0 HG LEU A 161 -9.391 6.226 0.510 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.442 4.767 0.850 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -6.982 6.334 0.142 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -6.689 6.017 1.869 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -9.372 4.601 2.365 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -8.705 5.849 3.444 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -10.336 6.044 2.760 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.523 8.990 -0.394 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.611 8.894 -1.363 1.00 0.37 C ATOM 2472 C LEU A 162 -11.241 9.625 -2.639 1.00 0.38 C ATOM 2473 O LEU A 162 -11.515 9.157 -3.739 1.00 0.45 O ATOM 2474 CB LEU A 162 -12.880 9.518 -0.796 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.155 9.206 0.668 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -14.426 9.899 1.121 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -13.255 7.702 0.897 1.00 1.51 C ATOM 0 H LEU A 162 -10.796 9.391 0.503 1.00 0.31 H new ATOM 0 HA LEU A 162 -11.783 7.839 -1.577 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -12.819 10.600 -0.916 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.729 9.179 -1.389 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.320 9.581 1.260 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -14.612 9.668 2.170 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -14.316 10.977 1.001 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -15.265 9.551 0.518 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -13.452 7.507 1.951 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -14.068 7.295 0.295 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -12.317 7.227 0.609 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.623 10.785 -2.468 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.148 11.583 -3.594 1.00 0.44 C ATOM 2491 C GLU A 163 -9.220 10.779 -4.500 1.00 0.41 C ATOM 2492 O GLU A 163 -9.358 10.800 -5.721 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.428 12.827 -3.088 1.00 0.56 C ATOM 2494 CG GLU A 163 -10.344 13.799 -2.372 1.00 1.03 C ATOM 2495 CD GLU A 163 -11.398 14.385 -3.285 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -11.035 14.940 -4.344 1.00 2.14 O ATOM 2497 OE2 GLU A 163 -12.596 14.312 -2.941 1.00 2.57 O ATOM 0 H GLU A 163 -10.437 11.198 -1.554 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.017 11.879 -4.181 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.629 12.526 -2.411 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -8.958 13.334 -3.930 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -10.831 13.289 -1.541 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -9.749 14.606 -1.945 1.00 1.03 H new ATOM 2504 N MET A 164 -8.281 10.062 -3.896 1.00 0.37 N ATOM 2505 CA MET A 164 -7.353 9.240 -4.662 1.00 0.39 C ATOM 2506 C MET A 164 -8.076 8.045 -5.263 1.00 0.37 C ATOM 2507 O MET A 164 -7.894 7.719 -6.436 1.00 0.43 O ATOM 2508 CB MET A 164 -6.200 8.763 -3.782 1.00 0.43 C ATOM 2509 CG MET A 164 -5.297 9.872 -3.264 1.00 0.64 C ATOM 2510 SD MET A 164 -4.303 10.663 -4.552 1.00 0.58 S ATOM 2511 CE MET A 164 -5.505 11.728 -5.350 1.00 0.53 C ATOM 0 H MET A 164 -8.142 10.033 -2.886 1.00 0.37 H new ATOM 0 HA MET A 164 -6.945 9.850 -5.468 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.611 8.220 -2.931 1.00 0.43 H new ATOM 0 HB3 MET A 164 -5.595 8.056 -4.350 1.00 0.43 H new ATOM 0 HG2 MET A 164 -5.910 10.629 -2.775 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.631 9.461 -2.505 1.00 0.64 H new ATOM 0 HE1 MET A 164 -5.040 12.684 -5.592 1.00 0.53 H new ATOM 0 HE2 MET A 164 -5.859 11.255 -6.266 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.347 11.894 -4.678 1.00 0.53 H new ATOM 2521 N ILE A 165 -8.911 7.410 -4.452 1.00 0.34 N ATOM 2522 CA ILE A 165 -9.681 6.255 -4.885 1.00 0.38 C ATOM 2523 C ILE A 165 -10.583 6.595 -6.068 1.00 0.44 C ATOM 2524 O ILE A 165 -10.586 5.890 -7.076 1.00 0.52 O ATOM 2525 CB ILE A 165 -10.547 5.702 -3.736 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -9.658 5.119 -2.634 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -11.516 4.651 -4.258 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -10.433 4.606 -1.439 1.00 0.50 C ATOM 0 H ILE A 165 -9.072 7.680 -3.482 1.00 0.34 H new ATOM 0 HA ILE A 165 -8.962 5.496 -5.194 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.128 6.521 -3.312 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.066 4.304 -3.050 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -8.957 5.885 -2.301 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -12.120 4.271 -3.434 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.168 5.098 -5.009 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -10.956 3.830 -4.706 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -9.739 4.208 -0.699 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -11.004 5.423 -0.998 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -11.114 3.818 -1.758 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.338 7.680 -5.949 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.279 8.068 -6.989 1.00 0.57 C ATOM 2542 C LEU A 166 -11.546 8.629 -8.202 1.00 0.61 C ATOM 2543 O LEU A 166 -12.073 8.618 -9.309 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.329 9.052 -6.439 1.00 0.66 C ATOM 2545 CG LEU A 166 -13.407 10.423 -7.120 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -14.807 11.001 -6.968 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -12.386 11.377 -6.523 1.00 1.38 C ATOM 0 H LEU A 166 -11.316 8.305 -5.143 1.00 0.46 H new ATOM 0 HA LEU A 166 -12.815 7.179 -7.321 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -14.309 8.580 -6.510 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -13.127 9.209 -5.379 1.00 0.66 H new ATOM 0 HG LEU A 166 -13.184 10.295 -8.179 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -14.853 11.975 -7.455 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -15.530 10.329 -7.431 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -15.041 11.113 -5.909 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -12.458 12.344 -7.020 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -12.583 11.501 -5.458 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -11.384 10.971 -6.662 1.00 1.38 H new ATOM 2559 N LEU A 167 -10.329 9.114 -7.989 1.00 0.56 N ATOM 2560 CA LEU A 167 -9.456 9.473 -9.098 1.00 0.64 C ATOM 2561 C LEU A 167 -9.165 8.226 -9.920 1.00 0.66 C ATOM 2562 O LEU A 167 -9.343 8.201 -11.137 1.00 0.75 O ATOM 2563 CB LEU A 167 -8.142 10.067 -8.590 1.00 0.64 C ATOM 2564 CG LEU A 167 -7.241 10.671 -9.670 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -7.930 11.844 -10.351 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -5.910 11.107 -9.076 1.00 1.51 C ATOM 0 H LEU A 167 -9.927 9.267 -7.064 1.00 0.56 H new ATOM 0 HA LEU A 167 -9.956 10.223 -9.711 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -8.371 10.840 -7.856 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -7.586 9.287 -8.070 1.00 0.64 H new ATOM 0 HG LEU A 167 -7.048 9.904 -10.420 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -7.272 12.259 -11.115 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -8.855 11.503 -10.815 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -8.157 12.612 -9.612 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -5.284 11.534 -9.860 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -6.084 11.856 -8.303 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -5.407 10.245 -8.639 1.00 1.51 H new ATOM 2578 N VAL A 168 -8.741 7.179 -9.227 1.00 0.61 N ATOM 2579 CA VAL A 168 -8.490 5.903 -9.855 1.00 0.69 C ATOM 2580 C VAL A 168 -9.784 5.309 -10.414 1.00 0.77 C ATOM 2581 O VAL A 168 -9.789 4.707 -11.485 1.00 0.89 O ATOM 2582 CB VAL A 168 -7.841 4.914 -8.874 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -7.496 3.630 -9.587 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -6.603 5.523 -8.239 1.00 0.66 C ATOM 0 H VAL A 168 -8.564 7.195 -8.223 1.00 0.61 H new ATOM 0 HA VAL A 168 -7.796 6.075 -10.677 1.00 0.69 H new ATOM 0 HB VAL A 168 -8.554 4.692 -8.080 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -7.037 2.935 -8.884 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -8.404 3.186 -9.996 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -6.798 3.840 -10.398 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -6.159 4.807 -7.548 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -5.881 5.773 -9.016 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -6.880 6.427 -7.696 1.00 0.66 H new