USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 877 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 16 HIS : no HE2:sc= -0.343 K(o=-0.34,f=-1.7) USER MOD Set 1.2: A 114 MET CE :methyl 178:sc= 0 (180deg=0) USER MOD Set 2.1: A 82 CYS SG : rot -86:sc= 0.00586 USER MOD Set 2.2: A 102 THR OG1 : rot 107:sc= 1.63 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -0.186 K(o=-0.19,f=-2.9!) USER MOD Single : A 25 LYS NZ :NH3+ 168:sc= -0.015 (180deg=-0.156) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 68:sc= 0.882 USER MOD Single : A 32 SER OG : rot -84:sc= 0.958 USER MOD Single : A 33 GLN : amide:sc= 0.313 X(o=0.31,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0.649 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= 0.37 X(o=0.37,f=-0.00047) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0.0131 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0.0886 USER MOD Single : A 59 ASN : amide:sc= 0.0628 K(o=0.063,f=-4.4!) USER MOD Single : A 60 THR OG1 : rot 76:sc= 1.21 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= -0.0654 X(o=-0.065,f=-0.019) USER MOD Single : A 75 LYS NZ :NH3+ 151:sc= 1.13 (180deg=0.338) USER MOD Single : A 76 SER OG : rot 96:sc= 1.03 USER MOD Single : A 81 ASN : amide:sc=-0.00104 K(o=-0.001,f=-0.69) USER MOD Single : A 85 THR OG1 : rot 88:sc= 0.909 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 89 ASN : amide:sc= -0.984 X(o=-0.98,f=-0.74) USER MOD Single : A 90 GLN : amide:sc= 1.83 K(o=1.8,f=-0.03) USER MOD Single : A 91 GLN : amide:sc= -0.0613 K(o=-0.061,f=-3.4!) USER MOD Single : A 94 ASN : amide:sc= -0.536 X(o=-0.54,f=-0.42) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 113 GLN :FLIP amide:sc= -0.392 F(o=-5.5!,f=-0.39) USER MOD Single : A 115 GLN : amide:sc= 0.525 K(o=0.53,f=-0.33) USER MOD Single : A 116 TYR OH : rot 180:sc=-0.000658 USER MOD Single : A 123 GLN : amide:sc= -0.523 K(o=-0.52,f=-1.6!) USER MOD Single : A 125 GLN : amide:sc= -0.696 K(o=-0.7,f=-1.6) USER MOD Single : A 129 THR OG1 : rot 8:sc= 0.274 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 138:sc= 0.813 (180deg=-0.51) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 2.426 9.489 2.451 1.00 0.00 N ATOM 2 CA PRO A 1 3.291 8.857 1.463 1.00 0.00 C ATOM 3 C PRO A 1 4.680 9.466 1.547 1.00 0.00 C ATOM 4 O PRO A 1 4.869 10.473 2.203 1.00 0.00 O ATOM 5 CB PRO A 1 2.686 9.077 0.090 1.00 0.00 C ATOM 6 CG PRO A 1 1.276 9.457 0.404 1.00 0.00 C ATOM 7 CD PRO A 1 1.316 10.130 1.767 1.00 0.00 C ATOM 0 H2 PRO A 1 2.952 10.177 2.991 1.00 0.00 H new ATOM 0 H3 PRO A 1 2.079 8.794 3.111 1.00 0.00 H new ATOM 0 HA PRO A 1 3.376 7.787 1.651 1.00 0.00 H new ATOM 0 HB2 PRO A 1 3.204 9.864 -0.458 1.00 0.00 H new ATOM 0 HB3 PRO A 1 2.735 8.176 -0.522 1.00 0.00 H new ATOM 0 HG2 PRO A 1 0.876 10.132 -0.353 1.00 0.00 H new ATOM 0 HG3 PRO A 1 0.630 8.579 0.421 1.00 0.00 H new ATOM 0 HD2 PRO A 1 1.472 11.205 1.676 1.00 0.00 H new ATOM 0 HD3 PRO A 1 0.380 9.989 2.308 1.00 0.00 H new ATOM 17 N VAL A 2 5.615 8.867 0.882 1.00 0.00 N ATOM 18 CA VAL A 2 7.000 9.272 0.887 1.00 0.00 C ATOM 19 C VAL A 2 7.295 10.124 -0.343 1.00 0.00 C ATOM 20 O VAL A 2 6.739 9.875 -1.423 1.00 0.00 O ATOM 21 CB VAL A 2 7.903 8.003 0.839 1.00 0.00 C ATOM 22 CG1 VAL A 2 9.388 8.322 0.688 1.00 0.00 C ATOM 23 CG2 VAL A 2 7.657 7.112 2.043 1.00 0.00 C ATOM 0 H VAL A 2 5.437 8.051 0.296 1.00 0.00 H new ATOM 0 HA VAL A 2 7.201 9.848 1.790 1.00 0.00 H new ATOM 0 HB VAL A 2 7.616 7.461 -0.062 1.00 0.00 H new ATOM 0 HG11 VAL A 2 9.959 7.394 0.661 1.00 0.00 H new ATOM 0 HG12 VAL A 2 9.549 8.874 -0.238 1.00 0.00 H new ATOM 0 HG13 VAL A 2 9.718 8.927 1.533 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.300 6.234 1.983 1.00 0.00 H new ATOM 0 HG22 VAL A 2 7.880 7.664 2.956 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.614 6.797 2.055 1.00 0.00 H new ATOM 33 N THR A 3 8.147 11.126 -0.191 1.00 0.00 N ATOM 34 CA THR A 3 8.635 11.905 -1.275 1.00 0.00 C ATOM 35 C THR A 3 10.082 12.294 -0.942 1.00 0.00 C ATOM 36 O THR A 3 10.358 12.966 0.089 1.00 0.00 O ATOM 37 CB THR A 3 7.735 13.140 -1.551 1.00 0.00 C ATOM 38 OG1 THR A 3 8.269 13.920 -2.623 1.00 0.00 O ATOM 39 CG2 THR A 3 7.540 14.003 -0.298 1.00 0.00 C ATOM 0 H THR A 3 8.515 11.412 0.716 1.00 0.00 H new ATOM 0 HA THR A 3 8.612 11.328 -2.199 1.00 0.00 H new ATOM 0 HB THR A 3 6.753 12.768 -1.842 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.689 14.693 -2.785 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.904 14.855 -0.538 1.00 0.00 H new ATOM 0 HG22 THR A 3 7.069 13.408 0.484 1.00 0.00 H new ATOM 0 HG23 THR A 3 8.508 14.360 0.052 1.00 0.00 H new ATOM 228 N HIS A 16 10.245 10.631 4.330 1.00 0.00 N ATOM 229 CA HIS A 16 9.329 9.522 4.336 1.00 0.00 C ATOM 230 C HIS A 16 8.275 10.164 5.160 1.00 0.00 C ATOM 231 O HIS A 16 8.496 10.417 6.344 1.00 0.00 O ATOM 232 CB HIS A 16 9.950 8.248 5.004 1.00 0.00 C ATOM 233 CG HIS A 16 11.199 7.784 4.295 1.00 0.00 C ATOM 234 ND1 HIS A 16 12.453 8.202 4.633 1.00 0.00 N ATOM 235 CD2 HIS A 16 11.353 7.013 3.201 1.00 0.00 C ATOM 236 CE1 HIS A 16 13.323 7.719 3.773 1.00 0.00 C ATOM 237 NE2 HIS A 16 12.679 6.989 2.896 1.00 0.00 N ATOM 0 HA HIS A 16 9.009 9.135 3.368 1.00 0.00 H new ATOM 0 HB2 HIS A 16 10.185 8.464 6.046 1.00 0.00 H new ATOM 0 HB3 HIS A 16 9.214 7.444 5.003 1.00 0.00 H new ATOM 0 HD1 HIS A 16 12.681 8.797 5.430 1.00 0.00 H new ATOM 0 HD2 HIS A 16 10.566 6.505 2.663 1.00 0.00 H new ATOM 0 HE1 HIS A 16 14.389 7.895 3.787 1.00 0.00 H new ATOM 246 N ASN A 17 7.150 10.476 4.607 1.00 0.00 N ATOM 247 CA ASN A 17 6.344 11.561 5.118 1.00 0.00 C ATOM 248 C ASN A 17 4.994 11.104 5.642 1.00 0.00 C ATOM 249 O ASN A 17 4.685 9.916 5.611 1.00 0.00 O ATOM 250 CB ASN A 17 6.236 12.564 3.955 1.00 0.00 C ATOM 251 CG ASN A 17 5.636 13.908 4.257 1.00 0.00 C ATOM 252 OD1 ASN A 17 5.677 14.394 5.384 1.00 0.00 O ATOM 253 ND2 ASN A 17 5.113 14.526 3.243 1.00 0.00 N ATOM 0 H ASN A 17 6.757 9.998 3.796 1.00 0.00 H new ATOM 0 HA ASN A 17 6.804 12.020 5.993 1.00 0.00 H new ATOM 0 HB2 ASN A 17 7.237 12.724 3.554 1.00 0.00 H new ATOM 0 HB3 ASN A 17 5.646 12.101 3.164 1.00 0.00 H new ATOM 0 HD21 ASN A 17 4.713 15.456 3.364 1.00 0.00 H new ATOM 0 HD22 ASN A 17 5.102 14.081 2.325 1.00 0.00 H new ATOM 260 N GLY A 18 4.237 12.039 6.157 1.00 0.00 N ATOM 261 CA GLY A 18 2.965 11.758 6.723 1.00 0.00 C ATOM 262 C GLY A 18 1.907 11.448 5.706 1.00 0.00 C ATOM 263 O GLY A 18 2.130 11.502 4.487 1.00 0.00 O ATOM 0 H GLY A 18 4.500 13.024 6.190 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.059 10.913 7.405 1.00 0.00 H new ATOM 0 HA3 GLY A 18 2.645 12.613 7.318 1.00 0.00 H new ATOM 267 N PHE A 19 0.769 11.152 6.210 1.00 0.00 N ATOM 268 CA PHE A 19 -0.365 10.734 5.431 1.00 0.00 C ATOM 269 C PHE A 19 -1.102 11.984 5.009 1.00 0.00 C ATOM 270 O PHE A 19 -1.516 12.761 5.873 1.00 0.00 O ATOM 271 CB PHE A 19 -1.288 9.884 6.332 1.00 0.00 C ATOM 272 CG PHE A 19 -0.530 9.037 7.344 1.00 0.00 C ATOM 273 CD1 PHE A 19 0.246 7.958 6.950 1.00 0.00 C ATOM 274 CD2 PHE A 19 -0.567 9.366 8.695 1.00 0.00 C ATOM 275 CE1 PHE A 19 0.977 7.231 7.891 1.00 0.00 C ATOM 276 CE2 PHE A 19 0.149 8.640 9.626 1.00 0.00 C ATOM 277 CZ PHE A 19 0.924 7.578 9.227 1.00 0.00 C ATOM 0 H PHE A 19 0.580 11.191 7.212 1.00 0.00 H new ATOM 0 HA PHE A 19 -0.060 10.151 4.562 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -1.974 10.544 6.863 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -1.895 9.231 5.705 1.00 0.00 H new ATOM 0 HD1 PHE A 19 0.285 7.678 5.908 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -1.166 10.203 9.021 1.00 0.00 H new ATOM 0 HE1 PHE A 19 1.585 6.396 7.574 1.00 0.00 H new ATOM 0 HE2 PHE A 19 0.100 8.908 10.671 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.490 7.016 9.955 1.00 0.00 H new ATOM 287 N ASP A 20 -1.291 12.194 3.723 1.00 0.00 N ATOM 288 CA ASP A 20 -1.971 13.402 3.245 1.00 0.00 C ATOM 289 C ASP A 20 -3.426 13.249 3.520 1.00 0.00 C ATOM 290 O ASP A 20 -4.055 12.280 3.037 1.00 0.00 O ATOM 291 CB ASP A 20 -1.786 13.592 1.744 1.00 0.00 C ATOM 292 CG ASP A 20 -2.383 14.904 1.253 1.00 0.00 C ATOM 293 OD1 ASP A 20 -1.724 15.955 1.374 1.00 0.00 O ATOM 294 OD2 ASP A 20 -3.501 14.903 0.741 1.00 0.00 O ATOM 0 H ASP A 20 -0.990 11.555 2.987 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.548 14.267 3.756 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -0.723 13.566 1.504 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.252 12.762 1.214 1.00 0.00 H new ATOM 299 N PHE A 21 -3.982 14.172 4.272 1.00 0.00 N ATOM 300 CA PHE A 21 -5.341 14.037 4.652 1.00 0.00 C ATOM 301 C PHE A 21 -6.288 14.276 3.508 1.00 0.00 C ATOM 302 O PHE A 21 -7.271 13.622 3.441 1.00 0.00 O ATOM 303 CB PHE A 21 -5.726 14.850 5.877 1.00 0.00 C ATOM 304 CG PHE A 21 -6.988 14.331 6.477 1.00 0.00 C ATOM 305 CD1 PHE A 21 -7.044 13.019 6.917 1.00 0.00 C ATOM 306 CD2 PHE A 21 -8.122 15.120 6.567 1.00 0.00 C ATOM 307 CE1 PHE A 21 -8.192 12.499 7.432 1.00 0.00 C ATOM 308 CE2 PHE A 21 -9.284 14.604 7.092 1.00 0.00 C ATOM 309 CZ PHE A 21 -9.320 13.288 7.525 1.00 0.00 C ATOM 0 H PHE A 21 -3.510 15.007 4.620 1.00 0.00 H new ATOM 0 HA PHE A 21 -5.441 12.992 4.947 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.924 14.810 6.614 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.852 15.897 5.600 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -6.163 12.398 6.851 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -8.094 16.144 6.224 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -8.220 11.472 7.767 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -10.166 15.223 7.167 1.00 0.00 H new ATOM 0 HZ PHE A 21 -10.232 12.880 7.936 1.00 0.00 H new ATOM 319 N ALA A 22 -5.969 15.206 2.622 1.00 0.00 N ATOM 320 CA ALA A 22 -6.788 15.470 1.428 1.00 0.00 C ATOM 321 C ALA A 22 -6.964 14.203 0.586 1.00 0.00 C ATOM 322 O ALA A 22 -8.069 13.901 0.123 1.00 0.00 O ATOM 323 CB ALA A 22 -6.202 16.603 0.591 1.00 0.00 C ATOM 0 H ALA A 22 -5.144 15.800 2.700 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.774 15.785 1.771 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -6.831 16.772 -0.283 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.160 17.513 1.189 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.196 16.334 0.268 1.00 0.00 H new ATOM 329 N VAL A 23 -5.875 13.481 0.400 1.00 0.00 N ATOM 330 CA VAL A 23 -5.889 12.181 -0.255 1.00 0.00 C ATOM 331 C VAL A 23 -6.832 11.208 0.505 1.00 0.00 C ATOM 332 O VAL A 23 -7.788 10.670 -0.091 1.00 0.00 O ATOM 333 CB VAL A 23 -4.440 11.613 -0.363 1.00 0.00 C ATOM 334 CG1 VAL A 23 -4.426 10.171 -0.809 1.00 0.00 C ATOM 335 CG2 VAL A 23 -3.613 12.467 -1.330 1.00 0.00 C ATOM 0 H VAL A 23 -4.947 13.780 0.701 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.275 12.294 -1.268 1.00 0.00 H new ATOM 0 HB VAL A 23 -3.999 11.652 0.633 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -3.396 9.819 -0.870 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -4.976 9.563 -0.091 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.896 10.089 -1.789 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -2.603 12.063 -1.399 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -4.078 12.453 -2.316 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -3.569 13.493 -0.964 1.00 0.00 H new ATOM 345 N ILE A 24 -6.562 11.004 1.804 1.00 0.00 N ATOM 346 CA ILE A 24 -7.435 10.144 2.654 1.00 0.00 C ATOM 347 C ILE A 24 -8.909 10.579 2.550 1.00 0.00 C ATOM 348 O ILE A 24 -9.801 9.760 2.383 1.00 0.00 O ATOM 349 CB ILE A 24 -7.013 10.165 4.158 1.00 0.00 C ATOM 350 CG1 ILE A 24 -5.566 9.694 4.326 1.00 0.00 C ATOM 351 CG2 ILE A 24 -7.957 9.304 5.007 1.00 0.00 C ATOM 352 CD1 ILE A 24 -5.106 9.555 5.772 1.00 0.00 C ATOM 0 H ILE A 24 -5.764 11.410 2.292 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.317 9.129 2.275 1.00 0.00 H new ATOM 0 HB ILE A 24 -7.083 11.195 4.508 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -5.451 8.731 3.828 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.908 10.397 3.815 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -7.640 9.336 6.049 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -8.973 9.689 4.924 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -7.929 8.274 4.651 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -4.070 9.217 5.793 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -5.183 10.520 6.273 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -5.735 8.828 6.286 1.00 0.00 H new ATOM 364 N LYS A 25 -9.100 11.855 2.582 1.00 0.00 N ATOM 365 CA LYS A 25 -10.383 12.508 2.559 1.00 0.00 C ATOM 366 C LYS A 25 -11.104 12.194 1.259 1.00 0.00 C ATOM 367 O LYS A 25 -12.259 11.775 1.275 1.00 0.00 O ATOM 368 CB LYS A 25 -10.127 14.004 2.698 1.00 0.00 C ATOM 369 CG LYS A 25 -11.331 14.902 2.743 1.00 0.00 C ATOM 370 CD LYS A 25 -10.885 16.346 2.840 1.00 0.00 C ATOM 371 CE LYS A 25 -10.340 16.883 1.516 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.360 16.961 0.449 1.00 0.00 N ATOM 0 H LYS A 25 -8.325 12.516 2.628 1.00 0.00 H new ATOM 0 HA LYS A 25 -11.019 12.159 3.373 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.550 14.166 3.609 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.501 14.319 1.864 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.938 14.758 1.849 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.956 14.646 3.598 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.726 16.962 3.159 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.116 16.434 3.608 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.920 17.875 1.680 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.523 16.243 1.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -10.987 17.514 -0.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.597 16.002 0.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.215 17.422 0.820 1.00 0.00 H new ATOM 386 N GLU A 26 -10.386 12.345 0.152 1.00 0.00 N ATOM 387 CA GLU A 26 -10.905 12.093 -1.185 1.00 0.00 C ATOM 388 C GLU A 26 -11.305 10.634 -1.346 1.00 0.00 C ATOM 389 O GLU A 26 -12.434 10.325 -1.791 1.00 0.00 O ATOM 390 CB GLU A 26 -9.863 12.455 -2.232 1.00 0.00 C ATOM 391 CG GLU A 26 -10.289 12.234 -3.671 1.00 0.00 C ATOM 392 CD GLU A 26 -9.184 12.603 -4.629 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.297 11.775 -4.876 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.175 13.746 -5.138 1.00 0.00 O ATOM 0 H GLU A 26 -9.413 12.650 0.159 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.789 12.715 -1.326 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.594 13.504 -2.106 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -8.963 11.870 -2.043 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.565 11.189 -3.815 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.175 12.831 -3.887 1.00 0.00 H new ATOM 401 N LEU A 27 -10.403 9.728 -0.980 1.00 0.00 N ATOM 402 CA LEU A 27 -10.695 8.313 -1.095 1.00 0.00 C ATOM 403 C LEU A 27 -11.839 7.926 -0.143 1.00 0.00 C ATOM 404 O LEU A 27 -12.595 7.034 -0.433 1.00 0.00 O ATOM 405 CB LEU A 27 -9.436 7.439 -0.877 1.00 0.00 C ATOM 406 CG LEU A 27 -9.589 5.944 -1.186 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.137 5.755 -2.574 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.238 5.258 -1.079 1.00 0.00 C ATOM 0 H LEU A 27 -9.479 9.948 -0.608 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.024 8.118 -2.116 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.631 7.836 -1.496 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.121 7.544 0.161 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.280 5.505 -0.466 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.241 4.690 -2.782 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.112 6.237 -2.649 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.455 6.201 -3.298 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.351 4.196 -1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -7.545 5.705 -1.792 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -7.847 5.380 -0.069 1.00 0.00 H new ATOM 420 N LYS A 28 -11.980 8.660 0.977 1.00 0.00 N ATOM 421 CA LYS A 28 -13.069 8.446 1.931 1.00 0.00 C ATOM 422 C LYS A 28 -14.394 8.990 1.347 1.00 0.00 C ATOM 423 O LYS A 28 -15.494 8.487 1.657 1.00 0.00 O ATOM 424 CB LYS A 28 -12.747 9.118 3.270 1.00 0.00 C ATOM 425 CG LYS A 28 -13.729 8.793 4.391 1.00 0.00 C ATOM 426 CD LYS A 28 -13.395 9.552 5.666 1.00 0.00 C ATOM 427 CE LYS A 28 -11.973 9.290 6.141 1.00 0.00 C ATOM 428 NZ LYS A 28 -11.685 10.000 7.394 1.00 0.00 N ATOM 0 H LYS A 28 -11.343 9.412 1.239 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.181 7.376 2.109 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.747 8.818 3.582 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.725 10.198 3.125 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.741 9.043 4.073 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.713 7.721 4.590 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -13.527 10.620 5.495 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.096 9.266 6.450 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.828 8.220 6.287 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -11.267 9.605 5.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -10.708 9.800 7.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -11.800 11.023 7.247 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.343 9.680 8.133 1.00 0.00 H new ATOM 442 N THR A 29 -14.293 10.005 0.499 1.00 0.00 N ATOM 443 CA THR A 29 -15.436 10.519 -0.195 1.00 0.00 C ATOM 444 C THR A 29 -15.981 9.408 -1.109 1.00 0.00 C ATOM 445 O THR A 29 -17.152 9.009 -1.009 1.00 0.00 O ATOM 446 CB THR A 29 -15.049 11.773 -1.002 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.557 12.759 -0.090 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.238 12.334 -1.757 1.00 0.00 C ATOM 0 H THR A 29 -13.418 10.483 0.283 1.00 0.00 H new ATOM 0 HA THR A 29 -16.211 10.817 0.511 1.00 0.00 H new ATOM 0 HB THR A 29 -14.287 11.503 -1.733 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.707 12.456 0.292 1.00 0.00 H new ATOM 0 HG21 THR A 29 -15.930 13.218 -2.316 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.618 11.582 -2.448 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.022 12.606 -1.050 1.00 0.00 H new ATOM 456 N ALA A 30 -15.114 8.880 -1.974 1.00 0.00 N ATOM 457 CA ALA A 30 -15.442 7.781 -2.815 1.00 0.00 C ATOM 458 C ALA A 30 -15.893 6.583 -1.992 1.00 0.00 C ATOM 459 O ALA A 30 -16.810 5.927 -2.335 1.00 0.00 O ATOM 460 CB ALA A 30 -14.254 7.438 -3.684 1.00 0.00 C ATOM 0 H ALA A 30 -14.161 9.223 -2.094 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.275 8.060 -3.460 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.506 6.596 -4.328 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.992 8.299 -4.298 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.406 7.171 -3.053 1.00 0.00 H new ATOM 466 N ALA A 31 -15.229 6.335 -0.916 1.00 0.00 N ATOM 467 CA ALA A 31 -15.558 5.252 -0.020 1.00 0.00 C ATOM 468 C ALA A 31 -17.036 5.275 0.439 1.00 0.00 C ATOM 469 O ALA A 31 -17.701 4.252 0.418 1.00 0.00 O ATOM 470 CB ALA A 31 -14.688 5.365 1.187 1.00 0.00 C ATOM 0 H ALA A 31 -14.423 6.884 -0.618 1.00 0.00 H new ATOM 0 HA ALA A 31 -15.398 4.318 -0.559 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -14.919 4.556 1.879 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -13.642 5.299 0.889 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -14.867 6.323 1.676 1.00 0.00 H new ATOM 476 N SER A 32 -17.538 6.439 0.802 1.00 0.00 N ATOM 477 CA SER A 32 -18.821 6.514 1.458 1.00 0.00 C ATOM 478 C SER A 32 -19.954 6.549 0.462 1.00 0.00 C ATOM 479 O SER A 32 -21.038 5.953 0.641 1.00 0.00 O ATOM 480 CB SER A 32 -18.828 7.712 2.414 1.00 0.00 C ATOM 481 OG SER A 32 -18.291 8.868 1.766 1.00 0.00 O ATOM 0 H SER A 32 -17.078 7.337 0.654 1.00 0.00 H new ATOM 0 HA SER A 32 -18.981 5.611 2.047 1.00 0.00 H new ATOM 0 HB2 SER A 32 -19.846 7.914 2.747 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.242 7.480 3.303 1.00 0.00 H new ATOM 0 HG SER A 32 -17.313 8.855 1.831 1.00 0.00 H new ATOM 487 N GLN A 33 -19.687 7.246 -0.588 1.00 0.00 N ATOM 488 CA GLN A 33 -20.591 7.553 -1.639 1.00 0.00 C ATOM 489 C GLN A 33 -20.541 6.534 -2.807 1.00 0.00 C ATOM 490 O GLN A 33 -21.573 6.138 -3.336 1.00 0.00 O ATOM 491 CB GLN A 33 -20.203 8.967 -2.048 1.00 0.00 C ATOM 492 CG GLN A 33 -20.395 9.367 -3.456 1.00 0.00 C ATOM 493 CD GLN A 33 -21.838 9.596 -3.872 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.373 10.692 -3.719 1.00 0.00 O ATOM 495 NE2 GLN A 33 -22.460 8.610 -4.460 1.00 0.00 N ATOM 0 H GLN A 33 -18.762 7.645 -0.745 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.632 7.490 -1.322 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -20.769 9.660 -1.426 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -19.150 9.106 -1.804 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.832 10.282 -3.637 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.966 8.597 -4.098 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.995 7.710 -4.575 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -23.411 8.740 -4.804 1.00 0.00 H new ATOM 504 N TYR A 34 -19.369 6.125 -3.177 1.00 0.00 N ATOM 505 CA TYR A 34 -19.161 5.251 -4.317 1.00 0.00 C ATOM 506 C TYR A 34 -19.016 3.809 -3.870 1.00 0.00 C ATOM 507 O TYR A 34 -19.572 2.901 -4.489 1.00 0.00 O ATOM 508 CB TYR A 34 -17.910 5.721 -5.114 1.00 0.00 C ATOM 509 CG TYR A 34 -18.131 6.936 -6.002 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.030 8.223 -5.496 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.410 6.790 -7.351 1.00 0.00 C ATOM 512 CE1 TYR A 34 -18.197 9.323 -6.291 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.586 7.887 -8.156 1.00 0.00 C ATOM 514 CZ TYR A 34 -18.473 9.154 -7.624 1.00 0.00 C ATOM 515 OH TYR A 34 -18.638 10.251 -8.422 1.00 0.00 O ATOM 0 H TYR A 34 -18.508 6.386 -2.696 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.032 5.305 -4.971 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.112 5.947 -4.407 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.562 4.895 -5.734 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -17.814 8.360 -4.447 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -18.490 5.800 -7.775 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -18.112 10.315 -5.873 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.813 7.758 -9.204 1.00 0.00 H new ATOM 0 HH TYR A 34 -18.827 9.963 -9.339 1.00 0.00 H new ATOM 525 N GLY A 35 -18.290 3.604 -2.788 1.00 0.00 N ATOM 526 CA GLY A 35 -17.995 2.270 -2.317 1.00 0.00 C ATOM 527 C GLY A 35 -16.834 1.724 -3.094 1.00 0.00 C ATOM 528 O GLY A 35 -16.600 2.156 -4.215 1.00 0.00 O ATOM 0 H GLY A 35 -17.893 4.351 -2.218 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.760 2.290 -1.253 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.866 1.626 -2.439 1.00 0.00 H new ATOM 532 N ALA A 36 -16.144 0.744 -2.563 1.00 0.00 N ATOM 533 CA ALA A 36 -14.959 0.265 -3.233 1.00 0.00 C ATOM 534 C ALA A 36 -15.313 -0.812 -4.213 1.00 0.00 C ATOM 535 O ALA A 36 -15.284 -1.983 -3.901 1.00 0.00 O ATOM 536 CB ALA A 36 -13.898 -0.179 -2.283 1.00 0.00 C ATOM 0 H ALA A 36 -16.375 0.271 -1.689 1.00 0.00 H new ATOM 0 HA ALA A 36 -14.534 1.105 -3.782 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -13.031 -0.529 -2.843 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.606 0.657 -1.647 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.281 -0.990 -1.663 1.00 0.00 H new ATOM 542 N THR A 37 -15.597 -0.392 -5.419 1.00 0.00 N ATOM 543 CA THR A 37 -16.134 -1.249 -6.443 1.00 0.00 C ATOM 544 C THR A 37 -16.396 -0.402 -7.681 1.00 0.00 C ATOM 545 O THR A 37 -16.263 -0.868 -8.799 1.00 0.00 O ATOM 546 CB THR A 37 -17.426 -2.020 -5.960 1.00 0.00 C ATOM 547 OG1 THR A 37 -17.865 -2.984 -6.936 1.00 0.00 O ATOM 548 CG2 THR A 37 -18.576 -1.078 -5.611 1.00 0.00 C ATOM 0 H THR A 37 -15.459 0.572 -5.722 1.00 0.00 H new ATOM 0 HA THR A 37 -15.410 -2.028 -6.683 1.00 0.00 H new ATOM 0 HB THR A 37 -17.136 -2.545 -5.050 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.665 -3.444 -6.605 1.00 0.00 H new ATOM 0 HG21 THR A 37 -19.438 -1.661 -5.285 1.00 0.00 H new ATOM 0 HG22 THR A 37 -18.267 -0.408 -4.809 1.00 0.00 H new ATOM 0 HG23 THR A 37 -18.845 -0.492 -6.489 1.00 0.00 H new ATOM 556 N ALA A 38 -16.764 0.854 -7.445 1.00 0.00 N ATOM 557 CA ALA A 38 -16.922 1.840 -8.502 1.00 0.00 C ATOM 558 C ALA A 38 -15.545 2.222 -9.050 1.00 0.00 C ATOM 559 O ALA A 38 -14.660 2.550 -8.270 1.00 0.00 O ATOM 560 CB ALA A 38 -17.635 3.069 -7.957 1.00 0.00 C ATOM 0 H ALA A 38 -16.961 1.215 -6.511 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.521 1.419 -9.309 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.751 3.805 -8.753 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.617 2.783 -7.581 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.048 3.501 -7.146 1.00 0.00 H new ATOM 566 N PRO A 39 -15.366 2.183 -10.395 1.00 0.00 N ATOM 567 CA PRO A 39 -14.069 2.444 -11.092 1.00 0.00 C ATOM 568 C PRO A 39 -13.259 3.650 -10.550 1.00 0.00 C ATOM 569 O PRO A 39 -12.024 3.625 -10.542 1.00 0.00 O ATOM 570 CB PRO A 39 -14.515 2.699 -12.528 1.00 0.00 C ATOM 571 CG PRO A 39 -15.711 1.825 -12.692 1.00 0.00 C ATOM 572 CD PRO A 39 -16.431 1.846 -11.378 1.00 0.00 C ATOM 0 HA PRO A 39 -13.380 1.611 -10.956 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.762 3.748 -12.689 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -13.732 2.442 -13.241 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.353 2.191 -13.493 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -15.417 0.810 -12.958 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.230 2.587 -11.372 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.889 0.882 -11.157 1.00 0.00 H new ATOM 580 N TYR A 40 -13.956 4.680 -10.118 1.00 0.00 N ATOM 581 CA TYR A 40 -13.349 5.886 -9.545 1.00 0.00 C ATOM 582 C TYR A 40 -12.467 5.574 -8.327 1.00 0.00 C ATOM 583 O TYR A 40 -11.258 5.817 -8.358 1.00 0.00 O ATOM 584 CB TYR A 40 -14.455 6.905 -9.186 1.00 0.00 C ATOM 585 CG TYR A 40 -14.003 8.188 -8.513 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.296 9.174 -9.208 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.326 8.427 -7.193 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.931 10.352 -8.582 1.00 0.00 C ATOM 589 CE2 TYR A 40 -13.958 9.595 -6.571 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.268 10.551 -7.260 1.00 0.00 C ATOM 591 OH TYR A 40 -12.911 11.721 -6.620 1.00 0.00 O ATOM 0 H TYR A 40 -14.975 4.714 -10.151 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.691 6.320 -10.298 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -14.986 7.169 -10.101 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.174 6.412 -8.532 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.033 9.014 -10.243 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -14.878 7.682 -6.639 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.386 11.110 -9.125 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.215 9.758 -5.535 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.228 11.697 -5.693 1.00 0.00 H new ATOM 601 N THR A 41 -13.057 5.014 -7.258 1.00 0.00 N ATOM 602 CA THR A 41 -12.377 4.774 -6.006 1.00 0.00 C ATOM 603 C THR A 41 -11.157 3.857 -6.142 1.00 0.00 C ATOM 604 O THR A 41 -10.115 4.168 -5.598 1.00 0.00 O ATOM 605 CB THR A 41 -13.350 4.266 -4.914 1.00 0.00 C ATOM 606 OG1 THR A 41 -12.689 4.117 -3.652 1.00 0.00 O ATOM 607 CG2 THR A 41 -13.935 2.958 -5.300 1.00 0.00 C ATOM 0 H THR A 41 -14.033 4.717 -7.255 1.00 0.00 H new ATOM 0 HA THR A 41 -11.991 5.742 -5.688 1.00 0.00 H new ATOM 0 HB THR A 41 -14.139 5.012 -4.818 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.329 3.797 -2.983 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.616 2.619 -4.519 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.482 3.066 -6.236 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.137 2.226 -5.429 1.00 0.00 H new ATOM 615 N LEU A 42 -11.256 2.758 -6.876 1.00 0.00 N ATOM 616 CA LEU A 42 -10.097 1.883 -6.984 1.00 0.00 C ATOM 617 C LEU A 42 -8.989 2.445 -7.841 1.00 0.00 C ATOM 618 O LEU A 42 -7.833 2.098 -7.658 1.00 0.00 O ATOM 619 CB LEU A 42 -10.366 0.347 -7.167 1.00 0.00 C ATOM 620 CG LEU A 42 -11.473 -0.135 -8.120 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.838 0.088 -7.504 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.367 0.497 -9.503 1.00 0.00 C ATOM 0 H LEU A 42 -12.088 2.459 -7.385 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.708 1.891 -5.966 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.433 -0.108 -7.499 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.587 -0.062 -6.181 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.336 -1.206 -8.266 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.609 -0.259 -8.192 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.910 -0.467 -6.569 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -12.979 1.151 -7.307 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.171 0.123 -10.136 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.448 1.580 -9.415 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.406 0.240 -9.948 1.00 0.00 H new ATOM 634 N ALA A 43 -9.334 3.366 -8.730 1.00 0.00 N ATOM 635 CA ALA A 43 -8.343 4.074 -9.502 1.00 0.00 C ATOM 636 C ALA A 43 -7.514 4.925 -8.558 1.00 0.00 C ATOM 637 O ALA A 43 -6.302 5.048 -8.698 1.00 0.00 O ATOM 638 CB ALA A 43 -8.989 4.926 -10.574 1.00 0.00 C ATOM 0 H ALA A 43 -10.297 3.635 -8.929 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.699 3.357 -10.012 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.216 5.447 -11.139 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.564 4.290 -11.247 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.652 5.655 -10.109 1.00 0.00 H new ATOM 644 N ILE A 44 -8.179 5.457 -7.555 1.00 0.00 N ATOM 645 CA ILE A 44 -7.539 6.237 -6.521 1.00 0.00 C ATOM 646 C ILE A 44 -6.684 5.304 -5.630 1.00 0.00 C ATOM 647 O ILE A 44 -5.572 5.652 -5.265 1.00 0.00 O ATOM 648 CB ILE A 44 -8.584 6.974 -5.675 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.475 7.809 -6.593 1.00 0.00 C ATOM 650 CG2 ILE A 44 -7.894 7.859 -4.637 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.717 8.320 -5.926 1.00 0.00 C ATOM 0 H ILE A 44 -9.187 5.359 -7.435 1.00 0.00 H new ATOM 0 HA ILE A 44 -6.894 6.983 -6.985 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.201 6.250 -5.143 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -8.901 8.656 -6.970 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.758 7.206 -7.456 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.647 8.377 -4.043 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.278 7.241 -3.984 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.265 8.591 -5.143 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.299 8.904 -6.639 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.313 7.478 -5.573 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.443 8.950 -5.080 1.00 0.00 H new ATOM 663 N VAL A 45 -7.194 4.100 -5.338 1.00 0.00 N ATOM 664 CA VAL A 45 -6.422 3.088 -4.579 1.00 0.00 C ATOM 665 C VAL A 45 -5.117 2.803 -5.339 1.00 0.00 C ATOM 666 O VAL A 45 -4.011 2.762 -4.757 1.00 0.00 O ATOM 667 CB VAL A 45 -7.248 1.756 -4.376 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.457 0.688 -3.618 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.547 2.027 -3.635 1.00 0.00 C ATOM 0 H VAL A 45 -8.129 3.798 -5.610 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.202 3.479 -3.585 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.464 1.378 -5.375 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.069 -0.207 -3.505 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.553 0.441 -4.175 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.184 1.068 -2.633 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.096 1.094 -3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.326 2.453 -2.656 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.153 2.729 -4.208 1.00 0.00 H new ATOM 679 N GLU A 46 -5.246 2.680 -6.649 1.00 0.00 N ATOM 680 CA GLU A 46 -4.101 2.484 -7.514 1.00 0.00 C ATOM 681 C GLU A 46 -3.188 3.685 -7.547 1.00 0.00 C ATOM 682 O GLU A 46 -1.968 3.530 -7.599 1.00 0.00 O ATOM 683 CB GLU A 46 -4.492 2.153 -8.935 1.00 0.00 C ATOM 684 CG GLU A 46 -5.205 0.848 -9.117 1.00 0.00 C ATOM 685 CD GLU A 46 -4.770 0.194 -10.405 1.00 0.00 C ATOM 686 OE1 GLU A 46 -3.674 -0.416 -10.433 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.467 0.333 -11.415 1.00 0.00 O ATOM 0 H GLU A 46 -6.141 2.713 -7.137 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.572 1.636 -7.079 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.129 2.952 -9.314 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.592 2.145 -9.549 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.993 0.188 -8.276 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.282 1.012 -9.129 1.00 0.00 H new ATOM 694 N SER A 47 -3.768 4.878 -7.510 1.00 0.00 N ATOM 695 CA SER A 47 -3.032 6.100 -7.586 1.00 0.00 C ATOM 696 C SER A 47 -2.173 6.284 -6.338 1.00 0.00 C ATOM 697 O SER A 47 -1.000 6.632 -6.435 1.00 0.00 O ATOM 698 CB SER A 47 -4.005 7.278 -7.791 1.00 0.00 C ATOM 699 OG SER A 47 -3.319 8.510 -7.900 1.00 0.00 O ATOM 0 H SER A 47 -4.776 5.009 -7.425 1.00 0.00 H new ATOM 0 HA SER A 47 -2.356 6.066 -8.441 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.596 7.110 -8.691 1.00 0.00 H new ATOM 0 HB3 SER A 47 -4.703 7.323 -6.955 1.00 0.00 H new ATOM 0 HG SER A 47 -3.966 9.234 -8.031 1.00 0.00 H new ATOM 705 N VAL A 48 -2.749 5.995 -5.173 1.00 0.00 N ATOM 706 CA VAL A 48 -2.039 6.138 -3.920 1.00 0.00 C ATOM 707 C VAL A 48 -0.834 5.208 -3.859 1.00 0.00 C ATOM 708 O VAL A 48 0.259 5.647 -3.521 1.00 0.00 O ATOM 709 CB VAL A 48 -2.958 5.911 -2.688 1.00 0.00 C ATOM 710 CG1 VAL A 48 -2.166 6.083 -1.404 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.134 6.873 -2.705 1.00 0.00 C ATOM 0 H VAL A 48 -3.708 5.660 -5.079 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.688 7.169 -3.880 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.345 4.893 -2.735 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -2.821 5.921 -0.548 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -1.351 5.359 -1.379 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -1.756 7.092 -1.362 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.763 6.695 -1.833 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -3.765 7.899 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.719 6.717 -3.612 1.00 0.00 H new ATOM 721 N ALA A 49 -1.019 3.959 -4.275 1.00 0.00 N ATOM 722 CA ALA A 49 0.070 2.962 -4.227 1.00 0.00 C ATOM 723 C ALA A 49 1.094 3.149 -5.332 1.00 0.00 C ATOM 724 O ALA A 49 2.135 2.516 -5.312 1.00 0.00 O ATOM 725 CB ALA A 49 -0.471 1.530 -4.233 1.00 0.00 C ATOM 0 H ALA A 49 -1.900 3.606 -4.647 1.00 0.00 H new ATOM 0 HA ALA A 49 0.585 3.132 -3.281 1.00 0.00 H new ATOM 0 HB1 ALA A 49 0.361 0.827 -4.197 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.112 1.379 -3.364 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.048 1.363 -5.142 1.00 0.00 H new ATOM 731 N ASP A 50 0.827 4.061 -6.252 1.00 0.00 N ATOM 732 CA ASP A 50 1.723 4.275 -7.375 1.00 0.00 C ATOM 733 C ASP A 50 2.845 5.207 -6.951 1.00 0.00 C ATOM 734 O ASP A 50 3.750 5.525 -7.704 1.00 0.00 O ATOM 735 CB ASP A 50 0.953 4.840 -8.573 1.00 0.00 C ATOM 736 CG ASP A 50 1.723 4.717 -9.864 1.00 0.00 C ATOM 737 OD1 ASP A 50 1.991 3.577 -10.298 1.00 0.00 O ATOM 738 OD2 ASP A 50 2.060 5.739 -10.490 1.00 0.00 O ATOM 0 H ASP A 50 0.002 4.661 -6.244 1.00 0.00 H new ATOM 0 HA ASP A 50 2.157 3.324 -7.683 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.002 4.316 -8.669 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.722 5.889 -8.390 1.00 0.00 H new ATOM 743 N ASN A 51 2.757 5.632 -5.711 1.00 0.00 N ATOM 744 CA ASN A 51 3.728 6.495 -5.090 1.00 0.00 C ATOM 745 C ASN A 51 4.583 5.689 -4.164 1.00 0.00 C ATOM 746 O ASN A 51 4.302 4.525 -3.893 1.00 0.00 O ATOM 747 CB ASN A 51 3.037 7.562 -4.231 1.00 0.00 C ATOM 748 CG ASN A 51 2.125 8.488 -4.982 1.00 0.00 C ATOM 749 OD1 ASN A 51 2.545 9.521 -5.505 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.868 8.147 -5.010 1.00 0.00 N ATOM 0 H ASN A 51 1.986 5.378 -5.093 1.00 0.00 H new ATOM 0 HA ASN A 51 4.313 6.963 -5.881 1.00 0.00 H new ATOM 0 HB2 ASN A 51 2.462 7.063 -3.452 1.00 0.00 H new ATOM 0 HB3 ASN A 51 3.802 8.156 -3.731 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.188 8.745 -5.479 1.00 0.00 H new ATOM 0 HD22 ASN A 51 0.564 7.282 -4.563 1.00 0.00 H new ATOM 757 N TRP A 52 5.609 6.298 -3.672 1.00 0.00 N ATOM 758 CA TRP A 52 6.383 5.692 -2.620 1.00 0.00 C ATOM 759 C TRP A 52 5.610 5.827 -1.326 1.00 0.00 C ATOM 760 O TRP A 52 5.222 6.942 -0.951 1.00 0.00 O ATOM 761 CB TRP A 52 7.706 6.398 -2.404 1.00 0.00 C ATOM 762 CG TRP A 52 8.744 6.267 -3.471 1.00 0.00 C ATOM 763 CD1 TRP A 52 8.908 5.255 -4.378 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.829 7.158 -3.651 1.00 0.00 C ATOM 765 NE1 TRP A 52 10.033 5.488 -5.130 1.00 0.00 N ATOM 766 CE2 TRP A 52 10.619 6.658 -4.693 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.201 8.346 -3.028 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.772 7.314 -5.111 1.00 0.00 C ATOM 769 CZ3 TRP A 52 11.331 8.982 -3.434 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.105 8.481 -4.453 1.00 0.00 C ATOM 0 H TRP A 52 5.938 7.215 -3.975 1.00 0.00 H new ATOM 0 HA TRP A 52 6.569 4.656 -2.903 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.501 7.459 -2.264 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.135 6.030 -1.472 1.00 0.00 H new ATOM 0 HD1 TRP A 52 8.253 4.403 -4.486 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.378 4.895 -5.885 1.00 0.00 H new ATOM 0 HE3 TRP A 52 9.599 8.757 -2.231 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.380 6.927 -5.915 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 11.627 9.899 -2.946 1.00 0.00 H new ATOM 0 HH2 TRP A 52 12.997 9.014 -4.747 1.00 0.00 H new ATOM 781 N LEU A 53 5.341 4.744 -0.674 1.00 0.00 N ATOM 782 CA LEU A 53 4.726 4.811 0.622 1.00 0.00 C ATOM 783 C LEU A 53 5.081 3.612 1.481 1.00 0.00 C ATOM 784 O LEU A 53 5.235 2.499 0.989 1.00 0.00 O ATOM 785 CB LEU A 53 3.192 5.093 0.550 1.00 0.00 C ATOM 786 CG LEU A 53 2.228 4.029 -0.004 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.825 4.612 -0.068 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.637 3.510 -1.372 1.00 0.00 C ATOM 0 H LEU A 53 5.535 3.801 -1.012 1.00 0.00 H new ATOM 0 HA LEU A 53 5.149 5.679 1.128 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.861 5.332 1.561 1.00 0.00 H new ATOM 0 HB3 LEU A 53 3.058 5.993 -0.051 1.00 0.00 H new ATOM 0 HG LEU A 53 2.259 3.176 0.674 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.137 3.863 -0.460 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.508 4.908 0.932 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.823 5.484 -0.722 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.918 2.763 -1.708 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.660 4.336 -2.083 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.627 3.058 -1.309 1.00 0.00 H new ATOM 800 N THR A 54 5.290 3.887 2.733 1.00 0.00 N ATOM 801 CA THR A 54 5.663 2.921 3.738 1.00 0.00 C ATOM 802 C THR A 54 4.438 2.017 4.077 1.00 0.00 C ATOM 803 O THR A 54 3.307 2.446 3.909 1.00 0.00 O ATOM 804 CB THR A 54 6.083 3.734 4.994 1.00 0.00 C ATOM 805 OG1 THR A 54 6.935 4.804 4.574 1.00 0.00 O ATOM 806 CG2 THR A 54 6.840 2.889 6.004 1.00 0.00 C ATOM 0 H THR A 54 5.203 4.833 3.105 1.00 0.00 H new ATOM 0 HA THR A 54 6.473 2.279 3.393 1.00 0.00 H new ATOM 0 HB THR A 54 5.176 4.099 5.475 1.00 0.00 H new ATOM 0 HG1 THR A 54 7.209 5.330 5.354 1.00 0.00 H new ATOM 0 HG21 THR A 54 7.111 3.504 6.863 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.209 2.063 6.333 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.744 2.493 5.542 1.00 0.00 H new ATOM 814 N PRO A 55 4.636 0.745 4.501 1.00 0.00 N ATOM 815 CA PRO A 55 3.523 -0.134 4.950 1.00 0.00 C ATOM 816 C PRO A 55 2.680 0.516 6.060 1.00 0.00 C ATOM 817 O PRO A 55 1.487 0.277 6.171 1.00 0.00 O ATOM 818 CB PRO A 55 4.238 -1.386 5.482 1.00 0.00 C ATOM 819 CG PRO A 55 5.691 -1.017 5.558 1.00 0.00 C ATOM 820 CD PRO A 55 5.905 0.001 4.475 1.00 0.00 C ATOM 0 HA PRO A 55 2.822 -0.344 4.142 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.854 -1.671 6.461 1.00 0.00 H new ATOM 0 HB3 PRO A 55 4.084 -2.237 4.819 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.941 -0.607 6.537 1.00 0.00 H new ATOM 0 HG3 PRO A 55 6.326 -1.890 5.407 1.00 0.00 H new ATOM 0 HD2 PRO A 55 6.760 0.645 4.683 1.00 0.00 H new ATOM 0 HD3 PRO A 55 6.085 -0.465 3.506 1.00 0.00 H new ATOM 828 N THR A 56 3.322 1.326 6.878 1.00 0.00 N ATOM 829 CA THR A 56 2.674 2.097 7.917 1.00 0.00 C ATOM 830 C THR A 56 1.699 3.116 7.288 1.00 0.00 C ATOM 831 O THR A 56 0.589 3.343 7.793 1.00 0.00 O ATOM 832 CB THR A 56 3.769 2.838 8.690 1.00 0.00 C ATOM 833 OG1 THR A 56 4.896 1.954 8.793 1.00 0.00 O ATOM 834 CG2 THR A 56 3.295 3.189 10.081 1.00 0.00 C ATOM 0 H THR A 56 4.331 1.469 6.837 1.00 0.00 H new ATOM 0 HA THR A 56 2.106 1.444 8.580 1.00 0.00 H new ATOM 0 HB THR A 56 4.029 3.761 8.171 1.00 0.00 H new ATOM 0 HG1 THR A 56 5.618 2.400 9.283 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.087 3.715 10.614 1.00 0.00 H new ATOM 0 HG22 THR A 56 2.415 3.829 10.015 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.040 2.276 10.619 1.00 0.00 H new ATOM 842 N ASP A 57 2.122 3.700 6.160 1.00 0.00 N ATOM 843 CA ASP A 57 1.332 4.654 5.392 1.00 0.00 C ATOM 844 C ASP A 57 0.148 3.911 4.841 1.00 0.00 C ATOM 845 O ASP A 57 -0.995 4.339 5.007 1.00 0.00 O ATOM 846 CB ASP A 57 2.197 5.220 4.254 1.00 0.00 C ATOM 847 CG ASP A 57 1.794 6.585 3.762 1.00 0.00 C ATOM 848 OD1 ASP A 57 0.953 6.713 2.885 1.00 0.00 O ATOM 849 OD2 ASP A 57 2.408 7.570 4.218 1.00 0.00 O ATOM 0 H ASP A 57 3.039 3.516 5.754 1.00 0.00 H new ATOM 0 HA ASP A 57 0.995 5.486 6.010 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.232 5.264 4.593 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.166 4.525 3.415 1.00 0.00 H new ATOM 854 N TRP A 58 0.438 2.745 4.242 1.00 0.00 N ATOM 855 CA TRP A 58 -0.583 1.819 3.757 1.00 0.00 C ATOM 856 C TRP A 58 -1.644 1.537 4.811 1.00 0.00 C ATOM 857 O TRP A 58 -2.825 1.794 4.589 1.00 0.00 O ATOM 858 CB TRP A 58 0.046 0.482 3.326 1.00 0.00 C ATOM 859 CG TRP A 58 0.509 0.400 1.917 1.00 0.00 C ATOM 860 CD1 TRP A 58 0.358 1.326 0.939 1.00 0.00 C ATOM 861 CD2 TRP A 58 1.151 -0.713 1.312 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.891 0.853 -0.232 1.00 0.00 N ATOM 863 CE2 TRP A 58 1.374 -0.380 -0.031 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.569 -1.953 1.773 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.977 -1.232 -0.909 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.173 -2.800 0.887 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.370 -2.423 -0.444 1.00 0.00 C ATOM 0 H TRP A 58 1.392 2.422 4.083 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.055 2.302 2.901 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.895 0.277 3.978 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -0.684 -0.310 3.494 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -0.111 2.291 1.063 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.916 1.360 -1.117 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.421 -2.241 2.803 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 2.131 -0.955 -1.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.502 -3.773 1.220 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.854 -3.114 -1.118 1.00 0.00 H new ATOM 878 N ASN A 59 -1.224 1.005 5.944 1.00 0.00 N ATOM 879 CA ASN A 59 -2.146 0.652 7.042 1.00 0.00 C ATOM 880 C ASN A 59 -3.046 1.827 7.423 1.00 0.00 C ATOM 881 O ASN A 59 -4.242 1.660 7.575 1.00 0.00 O ATOM 882 CB ASN A 59 -1.377 0.114 8.263 1.00 0.00 C ATOM 883 CG ASN A 59 -2.282 -0.196 9.455 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.508 0.662 10.313 1.00 0.00 O ATOM 885 ND2 ASN A 59 -2.768 -1.412 9.541 1.00 0.00 N ATOM 0 H ASN A 59 -0.244 0.801 6.142 1.00 0.00 H new ATOM 0 HA ASN A 59 -2.794 -0.146 6.680 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -0.841 -0.791 7.977 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -0.628 0.846 8.564 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.353 -1.673 10.335 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.561 -2.097 8.814 1.00 0.00 H new ATOM 892 N THR A 60 -2.456 3.011 7.419 1.00 0.00 N ATOM 893 CA THR A 60 -3.208 4.200 7.806 1.00 0.00 C ATOM 894 C THR A 60 -4.217 4.600 6.732 1.00 0.00 C ATOM 895 O THR A 60 -5.368 4.978 7.038 1.00 0.00 O ATOM 896 CB THR A 60 -2.266 5.365 8.166 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.292 4.876 9.123 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.059 6.495 8.829 1.00 0.00 C ATOM 0 H THR A 60 -1.484 3.177 7.160 1.00 0.00 H new ATOM 0 HA THR A 60 -3.776 3.952 8.702 1.00 0.00 H new ATOM 0 HB THR A 60 -1.785 5.739 7.262 1.00 0.00 H new ATOM 0 HG1 THR A 60 -0.623 4.330 8.659 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.385 7.314 9.080 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.825 6.853 8.142 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.532 6.123 9.738 1.00 0.00 H new ATOM 906 N LEU A 61 -3.809 4.422 5.488 1.00 0.00 N ATOM 907 CA LEU A 61 -4.606 4.747 4.343 1.00 0.00 C ATOM 908 C LEU A 61 -5.906 3.928 4.367 1.00 0.00 C ATOM 909 O LEU A 61 -6.967 4.496 4.531 1.00 0.00 O ATOM 910 CB LEU A 61 -3.763 4.533 3.050 1.00 0.00 C ATOM 911 CG LEU A 61 -4.301 5.051 1.685 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.544 4.308 1.200 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.553 6.554 1.747 1.00 0.00 C ATOM 0 H LEU A 61 -2.894 4.039 5.252 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.900 5.796 4.360 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -2.791 4.998 3.214 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.591 3.462 2.947 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.524 4.847 0.948 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.865 4.721 0.243 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.311 3.250 1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.344 4.422 1.931 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.929 6.900 0.784 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.289 6.768 2.522 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.621 7.070 1.979 1.00 0.00 H new ATOM 925 N VAL A 62 -5.787 2.606 4.295 1.00 0.00 N ATOM 926 CA VAL A 62 -6.965 1.702 4.244 1.00 0.00 C ATOM 927 C VAL A 62 -7.896 1.888 5.450 1.00 0.00 C ATOM 928 O VAL A 62 -9.107 2.113 5.293 1.00 0.00 O ATOM 929 CB VAL A 62 -6.561 0.179 4.087 1.00 0.00 C ATOM 930 CG1 VAL A 62 -5.560 -0.266 5.144 1.00 0.00 C ATOM 931 CG2 VAL A 62 -7.788 -0.720 4.141 1.00 0.00 C ATOM 0 H VAL A 62 -4.890 2.121 4.270 1.00 0.00 H new ATOM 0 HA VAL A 62 -7.514 1.991 3.348 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.085 0.086 3.111 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -5.315 -1.317 4.993 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.653 0.333 5.062 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -5.994 -0.133 6.135 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -7.482 -1.760 4.031 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -8.293 -0.590 5.098 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -8.469 -0.455 3.333 1.00 0.00 H new ATOM 941 N ARG A 63 -7.289 1.862 6.623 1.00 0.00 N ATOM 942 CA ARG A 63 -8.028 1.901 7.914 1.00 0.00 C ATOM 943 C ARG A 63 -8.841 3.189 8.107 1.00 0.00 C ATOM 944 O ARG A 63 -9.823 3.202 8.857 1.00 0.00 O ATOM 945 CB ARG A 63 -7.083 1.711 9.113 1.00 0.00 C ATOM 946 CG ARG A 63 -6.229 2.919 9.445 1.00 0.00 C ATOM 947 CD ARG A 63 -5.155 2.600 10.470 1.00 0.00 C ATOM 948 NE ARG A 63 -5.646 2.343 11.824 1.00 0.00 N ATOM 949 CZ ARG A 63 -4.842 2.093 12.866 1.00 0.00 C ATOM 950 NH1 ARG A 63 -3.528 1.887 12.671 1.00 0.00 N ATOM 951 NH2 ARG A 63 -5.344 2.003 14.092 1.00 0.00 N ATOM 0 H ARG A 63 -6.276 1.814 6.729 1.00 0.00 H new ATOM 0 HA ARG A 63 -8.730 1.069 7.869 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.677 1.452 9.989 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.427 0.864 8.911 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.760 3.291 8.534 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.865 3.718 9.825 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -4.598 1.727 10.130 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -4.452 3.432 10.507 1.00 0.00 H new ATOM 0 HE ARG A 63 -6.653 2.355 11.983 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -3.141 1.921 11.728 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -2.918 1.697 13.466 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -6.345 2.124 14.243 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -4.728 1.812 14.883 1.00 0.00 H new ATOM 965 N ALA A 64 -8.442 4.261 7.453 1.00 0.00 N ATOM 966 CA ALA A 64 -9.156 5.504 7.595 1.00 0.00 C ATOM 967 C ALA A 64 -10.138 5.710 6.440 1.00 0.00 C ATOM 968 O ALA A 64 -11.322 6.000 6.667 1.00 0.00 O ATOM 969 CB ALA A 64 -8.165 6.663 7.705 1.00 0.00 C ATOM 0 H ALA A 64 -7.637 4.293 6.827 1.00 0.00 H new ATOM 0 HA ALA A 64 -9.745 5.469 8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.711 7.600 7.812 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.526 6.514 8.575 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.550 6.702 6.806 1.00 0.00 H new ATOM 975 N VAL A 65 -9.586 5.639 5.252 1.00 0.00 N ATOM 976 CA VAL A 65 -10.391 5.865 4.021 1.00 0.00 C ATOM 977 C VAL A 65 -11.711 5.074 3.966 1.00 0.00 C ATOM 978 O VAL A 65 -12.751 5.645 3.659 1.00 0.00 O ATOM 979 CB VAL A 65 -9.619 5.705 2.686 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.432 6.634 2.606 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.231 4.263 2.409 1.00 0.00 C ATOM 0 H VAL A 65 -8.601 5.432 5.087 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.641 6.922 4.117 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.308 5.997 1.894 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.920 6.489 1.655 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.773 7.667 2.681 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.745 6.418 3.424 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.693 4.206 1.463 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.592 3.898 3.212 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -10.130 3.649 2.353 1.00 0.00 H new ATOM 991 N LEU A 66 -11.697 3.810 4.330 1.00 0.00 N ATOM 992 CA LEU A 66 -12.911 3.021 4.269 1.00 0.00 C ATOM 993 C LEU A 66 -13.250 2.430 5.627 1.00 0.00 C ATOM 994 O LEU A 66 -12.466 2.562 6.574 1.00 0.00 O ATOM 995 CB LEU A 66 -12.895 1.961 3.139 1.00 0.00 C ATOM 996 CG LEU A 66 -13.817 2.272 1.958 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.576 1.367 0.793 1.00 0.00 C ATOM 998 CD2 LEU A 66 -15.276 2.167 2.389 1.00 0.00 C ATOM 0 H LEU A 66 -10.873 3.312 4.666 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.718 3.704 4.002 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.875 1.859 2.769 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -13.179 0.997 3.560 1.00 0.00 H new ATOM 0 HG LEU A 66 -13.593 3.290 1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.255 1.629 -0.018 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -12.546 1.477 0.454 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.751 0.334 1.093 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.923 2.390 1.541 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -15.479 1.157 2.744 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.471 2.879 3.191 1.00 0.00 H new ATOM 1010 N SER A 67 -14.405 1.824 5.731 1.00 0.00 N ATOM 1011 CA SER A 67 -14.892 1.286 6.974 1.00 0.00 C ATOM 1012 C SER A 67 -15.520 -0.074 6.763 1.00 0.00 C ATOM 1013 O SER A 67 -16.143 -0.330 5.722 1.00 0.00 O ATOM 1014 CB SER A 67 -15.913 2.261 7.568 1.00 0.00 C ATOM 1015 OG SER A 67 -16.920 2.596 6.611 1.00 0.00 O ATOM 0 H SER A 67 -15.041 1.689 4.945 1.00 0.00 H new ATOM 0 HA SER A 67 -14.058 1.161 7.664 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.377 1.816 8.448 1.00 0.00 H new ATOM 0 HB3 SER A 67 -15.406 3.167 7.899 1.00 0.00 H new ATOM 0 HG SER A 67 -17.561 3.218 7.015 1.00 0.00 H new ATOM 1021 N GLY A 68 -15.314 -0.950 7.725 1.00 0.00 N ATOM 1022 CA GLY A 68 -15.933 -2.250 7.745 1.00 0.00 C ATOM 1023 C GLY A 68 -15.384 -3.195 6.691 1.00 0.00 C ATOM 1024 O GLY A 68 -14.450 -3.969 6.959 1.00 0.00 O ATOM 0 H GLY A 68 -14.704 -0.772 8.523 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -15.794 -2.696 8.730 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -17.007 -2.135 7.596 1.00 0.00 H new ATOM 1028 N GLY A 69 -15.921 -3.073 5.487 1.00 0.00 N ATOM 1029 CA GLY A 69 -15.585 -3.920 4.378 1.00 0.00 C ATOM 1030 C GLY A 69 -14.125 -3.844 3.980 1.00 0.00 C ATOM 1031 O GLY A 69 -13.576 -4.824 3.471 1.00 0.00 O ATOM 0 H GLY A 69 -16.617 -2.363 5.260 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -15.831 -4.951 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -16.202 -3.646 3.522 1.00 0.00 H new ATOM 1035 N ASP A 70 -13.508 -2.682 4.212 1.00 0.00 N ATOM 1036 CA ASP A 70 -12.073 -2.439 3.864 1.00 0.00 C ATOM 1037 C ASP A 70 -11.189 -3.610 4.275 1.00 0.00 C ATOM 1038 O ASP A 70 -10.539 -4.246 3.429 1.00 0.00 O ATOM 1039 CB ASP A 70 -11.524 -1.114 4.486 1.00 0.00 C ATOM 1040 CG ASP A 70 -11.336 -1.115 6.005 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -12.334 -0.996 6.743 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -10.189 -1.254 6.484 1.00 0.00 O ATOM 0 H ASP A 70 -13.969 -1.880 4.641 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.040 -2.339 2.779 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -10.565 -0.888 4.021 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -12.204 -0.304 4.224 1.00 0.00 H new ATOM 1047 N HIS A 71 -11.274 -3.956 5.527 1.00 0.00 N ATOM 1048 CA HIS A 71 -10.463 -4.972 6.097 1.00 0.00 C ATOM 1049 C HIS A 71 -10.766 -6.325 5.485 1.00 0.00 C ATOM 1050 O HIS A 71 -9.840 -7.007 5.024 1.00 0.00 O ATOM 1051 CB HIS A 71 -10.642 -4.974 7.607 1.00 0.00 C ATOM 1052 CG HIS A 71 -9.837 -5.999 8.346 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.372 -6.761 9.343 1.00 0.00 N ATOM 1054 CD2 HIS A 71 -8.534 -6.366 8.250 1.00 0.00 C ATOM 1055 CE1 HIS A 71 -9.455 -7.553 9.834 1.00 0.00 C ATOM 1056 NE2 HIS A 71 -8.326 -7.343 9.188 1.00 0.00 N ATOM 0 H HIS A 71 -11.924 -3.527 6.186 1.00 0.00 H new ATOM 0 HA HIS A 71 -9.416 -4.762 5.876 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -10.381 -3.987 7.989 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -11.697 -5.134 7.831 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -7.801 -5.965 7.565 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.599 -8.262 10.636 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -7.444 -7.827 9.358 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.047 -6.686 5.419 1.00 0.00 N ATOM 1066 CA LEU A 72 -12.411 -7.989 4.922 1.00 0.00 C ATOM 1067 C LEU A 72 -11.840 -8.295 3.537 1.00 0.00 C ATOM 1068 O LEU A 72 -11.035 -9.199 3.419 1.00 0.00 O ATOM 1069 CB LEU A 72 -13.921 -8.339 5.116 1.00 0.00 C ATOM 1070 CG LEU A 72 -14.996 -7.355 4.626 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -15.311 -7.528 3.161 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -16.248 -7.475 5.456 1.00 0.00 C ATOM 0 H LEU A 72 -12.831 -6.097 5.701 1.00 0.00 H new ATOM 0 HA LEU A 72 -11.904 -8.703 5.572 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.101 -9.293 4.620 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.085 -8.498 6.182 1.00 0.00 H new ATOM 0 HG LEU A 72 -14.587 -6.352 4.748 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.076 -6.809 2.866 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -14.409 -7.360 2.573 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -15.676 -8.540 2.984 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -16.995 -6.770 5.092 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -16.639 -8.490 5.380 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.017 -7.253 6.498 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.156 -7.530 2.520 1.00 0.00 N ATOM 1085 CA LEU A 73 -11.566 -7.842 1.223 1.00 0.00 C ATOM 1086 C LEU A 73 -10.263 -7.223 0.847 1.00 0.00 C ATOM 1087 O LEU A 73 -9.358 -7.946 0.451 1.00 0.00 O ATOM 1088 CB LEU A 73 -12.486 -8.155 0.071 1.00 0.00 C ATOM 1089 CG LEU A 73 -12.901 -9.654 -0.011 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.753 -10.090 1.159 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -13.575 -9.993 -1.316 1.00 0.00 C ATOM 0 H LEU A 73 -12.783 -6.726 2.548 1.00 0.00 H new ATOM 0 HA LEU A 73 -11.234 -8.836 1.523 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.384 -7.543 0.158 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -11.996 -7.871 -0.861 1.00 0.00 H new ATOM 0 HG LEU A 73 -11.969 -10.217 0.038 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -14.012 -11.143 1.048 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -13.198 -9.949 2.086 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -14.665 -9.493 1.188 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -13.844 -11.049 -1.323 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.475 -9.388 -1.429 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -12.894 -9.787 -2.142 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.134 -5.900 0.963 1.00 0.00 N ATOM 1104 CA TRP A 74 -8.881 -5.252 0.668 1.00 0.00 C ATOM 1105 C TRP A 74 -7.766 -5.925 1.493 1.00 0.00 C ATOM 1106 O TRP A 74 -6.725 -6.277 1.007 1.00 0.00 O ATOM 1107 CB TRP A 74 -8.901 -3.751 1.055 1.00 0.00 C ATOM 1108 CG TRP A 74 -9.691 -2.703 0.221 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.732 -2.843 -0.670 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.401 -1.321 0.240 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.130 -1.596 -1.145 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.326 -0.643 -0.573 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.446 -0.618 0.897 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.308 0.749 -0.727 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.394 0.764 0.761 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.336 1.446 -0.039 1.00 0.00 C ATOM 0 H TRP A 74 -10.882 -5.272 1.257 1.00 0.00 H new ATOM 0 HA TRP A 74 -8.709 -5.341 -0.405 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.280 -3.693 2.075 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -7.864 -3.417 1.080 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.176 -3.784 -0.959 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.888 -1.421 -1.804 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -7.729 -1.129 1.523 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.024 1.255 -1.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -7.624 1.322 1.273 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.296 2.523 -0.113 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.030 -6.110 2.736 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.020 -6.561 3.656 1.00 0.00 C ATOM 1129 C LYS A 75 -6.809 -8.045 3.811 1.00 0.00 C ATOM 1130 O LYS A 75 -5.657 -8.463 3.922 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.023 -5.782 4.926 1.00 0.00 C ATOM 1132 CG LYS A 75 -6.923 -4.296 4.631 1.00 0.00 C ATOM 1133 CD LYS A 75 -5.574 -3.897 4.028 1.00 0.00 C ATOM 1134 CE LYS A 75 -4.520 -3.841 5.140 1.00 0.00 C ATOM 1135 NZ LYS A 75 -3.215 -3.285 4.723 1.00 0.00 N ATOM 0 H LYS A 75 -8.947 -5.957 3.155 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.093 -6.317 3.137 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -7.936 -5.988 5.485 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -6.187 -6.092 5.553 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -7.720 -4.013 3.944 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -7.083 -3.736 5.553 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.277 -4.616 3.265 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.654 -2.927 3.538 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -4.910 -3.241 5.962 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -4.364 -4.848 5.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -2.754 -2.832 5.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -2.610 -4.051 4.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -3.362 -2.581 3.972 1.00 0.00 H new ATOM 1149 N SER A 76 -7.863 -8.861 3.809 1.00 0.00 N ATOM 1150 CA SER A 76 -7.616 -10.298 3.913 1.00 0.00 C ATOM 1151 C SER A 76 -6.911 -10.762 2.656 1.00 0.00 C ATOM 1152 O SER A 76 -6.018 -11.603 2.710 1.00 0.00 O ATOM 1153 CB SER A 76 -8.897 -11.093 4.166 1.00 0.00 C ATOM 1154 OG SER A 76 -9.621 -10.537 5.265 1.00 0.00 O ATOM 0 H SER A 76 -8.840 -8.576 3.741 1.00 0.00 H new ATOM 0 HA SER A 76 -6.979 -10.482 4.778 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.520 -11.085 3.271 1.00 0.00 H new ATOM 0 HB3 SER A 76 -8.651 -12.134 4.374 1.00 0.00 H new ATOM 0 HG SER A 76 -10.306 -9.922 4.928 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.255 -10.142 1.523 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.581 -10.447 0.290 1.00 0.00 C ATOM 1162 C GLU A 77 -5.181 -9.850 0.304 1.00 0.00 C ATOM 1163 O GLU A 77 -4.299 -10.367 -0.363 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.359 -9.946 -0.922 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.736 -10.550 -1.106 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.729 -12.004 -1.479 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.766 -12.867 -0.593 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.742 -12.307 -2.683 1.00 0.00 O ATOM 0 H GLU A 77 -7.989 -9.437 1.449 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.512 -11.532 0.206 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.463 -8.864 -0.843 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.771 -10.145 -1.818 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.300 -10.427 -0.181 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.264 -9.991 -1.879 1.00 0.00 H new ATOM 1175 N PHE A 78 -4.963 -8.754 1.065 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.635 -8.188 1.170 1.00 0.00 C ATOM 1177 C PHE A 78 -2.678 -9.219 1.695 1.00 0.00 C ATOM 1178 O PHE A 78 -1.635 -9.487 1.084 1.00 0.00 O ATOM 1179 CB PHE A 78 -3.637 -6.924 2.058 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.264 -6.373 2.302 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -1.625 -5.650 1.325 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -1.610 -6.593 3.510 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.365 -5.161 1.535 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.356 -6.108 3.728 1.00 0.00 C ATOM 1185 CZ PHE A 78 0.275 -5.392 2.743 1.00 0.00 C ATOM 0 H PHE A 78 -5.683 -8.266 1.598 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.307 -7.885 0.176 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.251 -6.157 1.586 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.102 -7.161 3.015 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.121 -5.466 0.384 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.104 -7.157 4.287 1.00 0.00 H new ATOM 0 HE1 PHE A 78 0.131 -4.595 0.760 1.00 0.00 H new ATOM 0 HE2 PHE A 78 0.139 -6.286 4.671 1.00 0.00 H new ATOM 0 HZ PHE A 78 1.271 -5.008 2.908 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.067 -9.836 2.773 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.265 -10.839 3.412 1.00 0.00 C ATOM 1197 C PHE A 79 -2.021 -12.016 2.510 1.00 0.00 C ATOM 1198 O PHE A 79 -0.878 -12.435 2.343 1.00 0.00 O ATOM 1199 CB PHE A 79 -2.894 -11.242 4.712 1.00 0.00 C ATOM 1200 CG PHE A 79 -2.736 -10.174 5.762 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -1.524 -9.994 6.410 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -3.779 -9.328 6.063 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -1.369 -8.980 7.340 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -3.648 -8.321 6.989 1.00 0.00 C ATOM 1205 CZ PHE A 79 -2.442 -8.140 7.629 1.00 0.00 C ATOM 0 H PHE A 79 -3.957 -9.656 3.237 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.284 -10.415 3.627 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -3.953 -11.445 4.556 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -2.440 -12.168 5.064 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -0.695 -10.649 6.188 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -4.725 -9.459 5.558 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -0.421 -8.841 7.839 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -4.485 -7.676 7.213 1.00 0.00 H new ATOM 0 HZ PHE A 79 -2.328 -7.348 8.354 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.068 -12.478 1.867 1.00 0.00 N ATOM 1216 CA GLU A 80 -2.977 -13.592 0.957 1.00 0.00 C ATOM 1217 C GLU A 80 -2.036 -13.274 -0.199 1.00 0.00 C ATOM 1218 O GLU A 80 -1.037 -13.928 -0.364 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.358 -13.945 0.434 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.295 -14.434 1.520 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.793 -15.700 2.179 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -4.860 -16.777 1.528 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -4.332 -15.653 3.347 1.00 0.00 O ATOM 0 H GLU A 80 -4.007 -12.091 1.961 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.571 -14.448 1.496 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -4.793 -13.069 -0.047 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.265 -14.715 -0.332 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.412 -13.656 2.274 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.281 -14.615 1.093 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.331 -12.205 -0.927 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.604 -11.816 -2.129 1.00 0.00 C ATOM 1232 C ASN A 81 -0.146 -11.534 -1.881 1.00 0.00 C ATOM 1233 O ASN A 81 0.701 -11.983 -2.650 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.261 -10.617 -2.857 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.615 -10.958 -3.461 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -3.859 -12.085 -3.898 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.506 -10.016 -3.459 1.00 0.00 N ATOM 0 H ASN A 81 -3.096 -11.572 -0.695 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.661 -12.688 -2.781 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.380 -9.793 -2.154 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.595 -10.269 -3.646 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.440 -10.197 -3.826 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.273 -9.094 -3.090 1.00 0.00 H new ATOM 1244 N CYS A 82 0.169 -10.804 -0.812 1.00 0.00 N ATOM 1245 CA CYS A 82 1.558 -10.471 -0.528 1.00 0.00 C ATOM 1246 C CYS A 82 2.380 -11.704 -0.177 1.00 0.00 C ATOM 1247 O CYS A 82 3.480 -11.876 -0.681 1.00 0.00 O ATOM 1248 CB CYS A 82 1.677 -9.386 0.555 1.00 0.00 C ATOM 1249 SG CYS A 82 1.005 -9.818 2.173 1.00 0.00 S ATOM 0 H CYS A 82 -0.507 -10.439 -0.141 1.00 0.00 H new ATOM 0 HA CYS A 82 1.976 -10.058 -1.446 1.00 0.00 H new ATOM 0 HB2 CYS A 82 2.730 -9.133 0.675 1.00 0.00 H new ATOM 0 HB3 CYS A 82 1.172 -8.488 0.200 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.265 -9.544 2.202 1.00 0.00 H new ATOM 1255 N ARG A 83 1.826 -12.589 0.632 1.00 0.00 N ATOM 1256 CA ARG A 83 2.561 -13.782 1.047 1.00 0.00 C ATOM 1257 C ARG A 83 2.560 -14.822 -0.083 1.00 0.00 C ATOM 1258 O ARG A 83 3.481 -15.629 -0.195 1.00 0.00 O ATOM 1259 CB ARG A 83 1.990 -14.358 2.358 1.00 0.00 C ATOM 1260 CG ARG A 83 1.812 -13.301 3.444 1.00 0.00 C ATOM 1261 CD ARG A 83 3.128 -12.646 3.865 1.00 0.00 C ATOM 1262 NE ARG A 83 2.900 -11.402 4.604 1.00 0.00 N ATOM 1263 CZ ARG A 83 2.845 -11.274 5.934 1.00 0.00 C ATOM 1264 NH1 ARG A 83 3.126 -12.307 6.725 1.00 0.00 N ATOM 1265 NH2 ARG A 83 2.559 -10.101 6.456 1.00 0.00 N ATOM 0 H ARG A 83 0.883 -12.512 1.013 1.00 0.00 H new ATOM 0 HA ARG A 83 3.596 -13.504 1.248 1.00 0.00 H new ATOM 0 HB2 ARG A 83 1.028 -14.827 2.154 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.655 -15.140 2.725 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.129 -12.531 3.085 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.346 -13.760 4.316 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.698 -13.339 4.485 1.00 0.00 H new ATOM 0 HD3 ARG A 83 3.731 -12.439 2.981 1.00 0.00 H new ATOM 0 HE ARG A 83 2.771 -10.554 4.052 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.386 -13.205 6.318 1.00 0.00 H new ATOM 0 HH12 ARG A 83 3.082 -12.200 7.738 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.382 -9.302 5.848 1.00 0.00 H new ATOM 0 HH22 ARG A 83 2.514 -9.991 7.469 1.00 0.00 H new ATOM 1279 N ASP A 84 1.542 -14.754 -0.948 1.00 0.00 N ATOM 1280 CA ASP A 84 1.414 -15.637 -2.124 1.00 0.00 C ATOM 1281 C ASP A 84 2.520 -15.304 -3.081 1.00 0.00 C ATOM 1282 O ASP A 84 3.317 -16.164 -3.494 1.00 0.00 O ATOM 1283 CB ASP A 84 0.091 -15.350 -2.831 1.00 0.00 C ATOM 1284 CG ASP A 84 -0.256 -16.351 -3.915 1.00 0.00 C ATOM 1285 OD1 ASP A 84 0.317 -16.265 -5.016 1.00 0.00 O ATOM 1286 OD2 ASP A 84 -1.140 -17.228 -3.683 1.00 0.00 O ATOM 0 H ASP A 84 0.778 -14.084 -0.856 1.00 0.00 H new ATOM 0 HA ASP A 84 1.458 -16.680 -1.809 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.710 -15.338 -2.091 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.134 -14.353 -3.271 1.00 0.00 H new ATOM 1291 N THR A 85 2.592 -14.035 -3.367 1.00 0.00 N ATOM 1292 CA THR A 85 3.568 -13.458 -4.237 1.00 0.00 C ATOM 1293 C THR A 85 4.971 -13.639 -3.636 1.00 0.00 C ATOM 1294 O THR A 85 5.967 -13.841 -4.352 1.00 0.00 O ATOM 1295 CB THR A 85 3.205 -11.977 -4.420 1.00 0.00 C ATOM 1296 OG1 THR A 85 1.937 -11.880 -5.105 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.270 -11.172 -5.139 1.00 0.00 C ATOM 0 H THR A 85 1.943 -13.348 -2.982 1.00 0.00 H new ATOM 0 HA THR A 85 3.575 -13.948 -5.211 1.00 0.00 H new ATOM 0 HB THR A 85 3.132 -11.538 -3.425 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.209 -11.892 -4.449 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.943 -10.136 -5.231 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.200 -11.210 -4.571 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.434 -11.590 -6.132 1.00 0.00 H new ATOM 1305 N ALA A 86 5.007 -13.671 -2.336 1.00 0.00 N ATOM 1306 CA ALA A 86 6.212 -13.901 -1.630 1.00 0.00 C ATOM 1307 C ALA A 86 6.671 -15.324 -1.857 1.00 0.00 C ATOM 1308 O ALA A 86 7.848 -15.547 -2.124 1.00 0.00 O ATOM 1309 CB ALA A 86 6.015 -13.628 -0.177 1.00 0.00 C ATOM 0 H ALA A 86 4.190 -13.536 -1.741 1.00 0.00 H new ATOM 0 HA ALA A 86 6.984 -13.225 -1.999 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.948 -13.808 0.357 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.713 -12.590 -0.040 1.00 0.00 H new ATOM 0 HB3 ALA A 86 5.240 -14.286 0.215 1.00 0.00 H new ATOM 1315 N LYS A 87 5.735 -16.293 -1.779 1.00 0.00 N ATOM 1316 CA LYS A 87 6.050 -17.690 -2.055 1.00 0.00 C ATOM 1317 C LYS A 87 6.594 -17.814 -3.462 1.00 0.00 C ATOM 1318 O LYS A 87 7.603 -18.458 -3.683 1.00 0.00 O ATOM 1319 CB LYS A 87 4.818 -18.617 -1.895 1.00 0.00 C ATOM 1320 CG LYS A 87 4.201 -18.600 -0.503 1.00 0.00 C ATOM 1321 CD LYS A 87 3.145 -19.694 -0.304 1.00 0.00 C ATOM 1322 CE LYS A 87 1.963 -19.561 -1.267 1.00 0.00 C ATOM 1323 NZ LYS A 87 0.940 -20.614 -1.050 1.00 0.00 N ATOM 0 H LYS A 87 4.761 -16.124 -1.527 1.00 0.00 H new ATOM 0 HA LYS A 87 6.795 -18.008 -1.326 1.00 0.00 H new ATOM 0 HB2 LYS A 87 4.059 -18.323 -2.620 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.112 -19.638 -2.138 1.00 0.00 H new ATOM 0 HG2 LYS A 87 4.989 -18.724 0.240 1.00 0.00 H new ATOM 0 HG3 LYS A 87 3.745 -17.626 -0.325 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.610 -20.670 -0.440 1.00 0.00 H new ATOM 0 HD3 LYS A 87 2.778 -19.656 0.722 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.504 -18.580 -1.142 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.325 -19.615 -2.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.159 -20.484 -1.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.369 -21.550 -1.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.574 -20.547 -0.079 1.00 0.00 H new ATOM 1337 N ARG A 88 5.957 -17.122 -4.388 1.00 0.00 N ATOM 1338 CA ARG A 88 6.379 -17.130 -5.790 1.00 0.00 C ATOM 1339 C ARG A 88 7.789 -16.582 -5.971 1.00 0.00 C ATOM 1340 O ARG A 88 8.572 -17.107 -6.783 1.00 0.00 O ATOM 1341 CB ARG A 88 5.342 -16.465 -6.715 1.00 0.00 C ATOM 1342 CG ARG A 88 4.306 -17.445 -7.266 1.00 0.00 C ATOM 1343 CD ARG A 88 3.439 -18.077 -6.176 1.00 0.00 C ATOM 1344 NE ARG A 88 2.726 -19.245 -6.697 1.00 0.00 N ATOM 1345 CZ ARG A 88 1.408 -19.495 -6.599 1.00 0.00 C ATOM 1346 NH1 ARG A 88 0.576 -18.618 -6.090 1.00 0.00 N ATOM 1347 NH2 ARG A 88 0.936 -20.649 -7.032 1.00 0.00 N ATOM 0 H ARG A 88 5.140 -16.542 -4.200 1.00 0.00 H new ATOM 0 HA ARG A 88 6.426 -18.173 -6.102 1.00 0.00 H new ATOM 0 HB2 ARG A 88 4.829 -15.676 -6.166 1.00 0.00 H new ATOM 0 HB3 ARG A 88 5.860 -15.989 -7.547 1.00 0.00 H new ATOM 0 HG2 ARG A 88 3.664 -16.924 -7.976 1.00 0.00 H new ATOM 0 HG3 ARG A 88 4.818 -18.234 -7.818 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.063 -18.372 -5.333 1.00 0.00 H new ATOM 0 HD3 ARG A 88 2.724 -17.344 -5.802 1.00 0.00 H new ATOM 0 HE ARG A 88 3.288 -19.942 -7.186 1.00 0.00 H new ATOM 0 HH11 ARG A 88 0.924 -17.719 -5.756 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -0.419 -18.835 -6.028 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.569 -21.340 -7.436 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -0.062 -20.850 -6.963 1.00 0.00 H new ATOM 1361 N ASN A 89 8.132 -15.568 -5.181 1.00 0.00 N ATOM 1362 CA ASN A 89 9.475 -15.012 -5.163 1.00 0.00 C ATOM 1363 C ASN A 89 10.457 -15.997 -4.551 1.00 0.00 C ATOM 1364 O ASN A 89 11.610 -16.072 -4.973 1.00 0.00 O ATOM 1365 CB ASN A 89 9.550 -13.649 -4.412 1.00 0.00 C ATOM 1366 CG ASN A 89 8.974 -12.480 -5.190 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.077 -12.631 -5.986 1.00 0.00 O ATOM 1368 ND2 ASN A 89 9.507 -11.308 -4.968 1.00 0.00 N ATOM 0 H ASN A 89 7.485 -15.112 -4.538 1.00 0.00 H new ATOM 0 HA ASN A 89 9.748 -14.826 -6.202 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.018 -13.739 -3.465 1.00 0.00 H new ATOM 0 HB3 ASN A 89 10.592 -13.435 -4.173 1.00 0.00 H new ATOM 0 HD21 ASN A 89 9.167 -10.489 -5.473 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.263 -11.212 -4.290 1.00 0.00 H new ATOM 1375 N GLN A 90 10.004 -16.778 -3.579 1.00 0.00 N ATOM 1376 CA GLN A 90 10.874 -17.748 -2.908 1.00 0.00 C ATOM 1377 C GLN A 90 11.158 -18.941 -3.815 1.00 0.00 C ATOM 1378 O GLN A 90 12.282 -19.428 -3.844 1.00 0.00 O ATOM 1379 CB GLN A 90 10.318 -18.270 -1.552 1.00 0.00 C ATOM 1380 CG GLN A 90 9.924 -17.236 -0.493 1.00 0.00 C ATOM 1381 CD GLN A 90 10.864 -16.065 -0.398 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.875 -16.102 0.287 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.492 -14.985 -1.028 1.00 0.00 N ATOM 0 H GLN A 90 9.044 -16.763 -3.235 1.00 0.00 H new ATOM 0 HA GLN A 90 11.792 -17.201 -2.691 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.442 -18.883 -1.764 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.069 -18.928 -1.114 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.923 -16.867 -0.716 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.874 -17.728 0.478 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.642 -14.990 -1.591 1.00 0.00 H new ATOM 0 HE22 GLN A 90 11.052 -14.135 -0.957 1.00 0.00 H new ATOM 1392 N GLN A 91 10.140 -19.408 -4.573 1.00 0.00 N ATOM 1393 CA GLN A 91 10.286 -20.591 -5.484 1.00 0.00 C ATOM 1394 C GLN A 91 11.457 -20.394 -6.400 1.00 0.00 C ATOM 1395 O GLN A 91 12.310 -21.256 -6.528 1.00 0.00 O ATOM 1396 CB GLN A 91 9.077 -20.769 -6.415 1.00 0.00 C ATOM 1397 CG GLN A 91 7.696 -20.578 -5.825 1.00 0.00 C ATOM 1398 CD GLN A 91 7.287 -21.543 -4.733 1.00 0.00 C ATOM 1399 OE1 GLN A 91 8.102 -22.041 -3.957 1.00 0.00 O ATOM 1400 NE2 GLN A 91 6.015 -21.808 -4.657 1.00 0.00 N ATOM 0 H GLN A 91 9.208 -18.993 -4.580 1.00 0.00 H new ATOM 0 HA GLN A 91 10.397 -21.455 -4.829 1.00 0.00 H new ATOM 0 HB2 GLN A 91 9.187 -20.069 -7.243 1.00 0.00 H new ATOM 0 HB3 GLN A 91 9.125 -21.773 -6.837 1.00 0.00 H new ATOM 0 HG2 GLN A 91 7.633 -19.565 -5.426 1.00 0.00 H new ATOM 0 HG3 GLN A 91 6.968 -20.649 -6.633 1.00 0.00 H new ATOM 0 HE21 GLN A 91 5.364 -21.379 -5.315 1.00 0.00 H new ATOM 0 HE22 GLN A 91 5.669 -22.445 -3.939 1.00 0.00 H new ATOM 1409 N ALA A 92 11.496 -19.226 -7.016 1.00 0.00 N ATOM 1410 CA ALA A 92 12.513 -18.898 -7.976 1.00 0.00 C ATOM 1411 C ALA A 92 13.816 -18.510 -7.300 1.00 0.00 C ATOM 1412 O ALA A 92 14.849 -18.415 -7.944 1.00 0.00 O ATOM 1413 CB ALA A 92 12.044 -17.780 -8.860 1.00 0.00 C ATOM 0 H ALA A 92 10.817 -18.481 -6.858 1.00 0.00 H new ATOM 0 HA ALA A 92 12.700 -19.786 -8.579 1.00 0.00 H new ATOM 0 HB1 ALA A 92 12.822 -17.538 -9.585 1.00 0.00 H new ATOM 0 HB2 ALA A 92 11.140 -18.087 -9.386 1.00 0.00 H new ATOM 0 HB3 ALA A 92 11.829 -16.901 -8.252 1.00 0.00 H new ATOM 1419 N GLY A 93 13.761 -18.298 -5.997 1.00 0.00 N ATOM 1420 CA GLY A 93 14.929 -17.907 -5.278 1.00 0.00 C ATOM 1421 C GLY A 93 15.278 -16.454 -5.501 1.00 0.00 C ATOM 1422 O GLY A 93 16.385 -16.141 -5.890 1.00 0.00 O ATOM 0 H GLY A 93 12.918 -18.393 -5.430 1.00 0.00 H new ATOM 0 HA2 GLY A 93 14.774 -18.082 -4.213 1.00 0.00 H new ATOM 0 HA3 GLY A 93 15.768 -18.531 -5.585 1.00 0.00 H new ATOM 1426 N ASN A 94 14.324 -15.588 -5.307 1.00 0.00 N ATOM 1427 CA ASN A 94 14.553 -14.161 -5.447 1.00 0.00 C ATOM 1428 C ASN A 94 15.010 -13.623 -4.117 1.00 0.00 C ATOM 1429 O ASN A 94 14.596 -14.149 -3.063 1.00 0.00 O ATOM 1430 CB ASN A 94 13.267 -13.423 -5.853 1.00 0.00 C ATOM 1431 CG ASN A 94 12.809 -13.683 -7.268 1.00 0.00 C ATOM 1432 OD1 ASN A 94 13.163 -12.960 -8.194 1.00 0.00 O ATOM 1433 ND2 ASN A 94 12.011 -14.698 -7.448 1.00 0.00 N ATOM 0 H ASN A 94 13.370 -15.839 -5.049 1.00 0.00 H new ATOM 0 HA ASN A 94 15.302 -14.003 -6.223 1.00 0.00 H new ATOM 0 HB2 ASN A 94 12.468 -13.710 -5.169 1.00 0.00 H new ATOM 0 HB3 ASN A 94 13.424 -12.352 -5.728 1.00 0.00 H new ATOM 0 HD21 ASN A 94 11.661 -14.912 -8.382 1.00 0.00 H new ATOM 0 HD22 ASN A 94 11.737 -15.278 -6.655 1.00 0.00 H new ATOM 1440 N GLY A 95 15.801 -12.581 -4.142 1.00 0.00 N ATOM 1441 CA GLY A 95 16.299 -11.958 -2.940 1.00 0.00 C ATOM 1442 C GLY A 95 15.300 -10.965 -2.394 1.00 0.00 C ATOM 1443 O GLY A 95 15.629 -9.812 -2.120 1.00 0.00 O ATOM 0 H GLY A 95 16.121 -12.137 -5.003 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.507 -12.721 -2.190 1.00 0.00 H new ATOM 0 HA3 GLY A 95 17.242 -11.453 -3.151 1.00 0.00 H new ATOM 1447 N TRP A 96 14.088 -11.437 -2.222 1.00 0.00 N ATOM 1448 CA TRP A 96 12.980 -10.676 -1.752 1.00 0.00 C ATOM 1449 C TRP A 96 12.252 -11.501 -0.804 1.00 0.00 C ATOM 1450 O TRP A 96 12.171 -12.732 -0.971 1.00 0.00 O ATOM 1451 CB TRP A 96 12.093 -10.139 -2.872 1.00 0.00 C ATOM 1452 CG TRP A 96 12.726 -8.966 -3.509 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.053 -7.807 -2.876 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.118 -8.809 -4.874 1.00 0.00 C ATOM 1455 NE1 TRP A 96 13.663 -6.957 -3.726 1.00 0.00 N ATOM 1456 CE2 TRP A 96 13.714 -7.540 -4.978 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.040 -9.620 -6.016 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 14.221 -7.056 -6.177 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 13.549 -9.135 -7.208 1.00 0.00 C ATOM 1460 CH2 TRP A 96 14.138 -7.868 -7.278 1.00 0.00 C ATOM 0 H TRP A 96 13.848 -12.409 -2.418 1.00 0.00 H new ATOM 0 HA TRP A 96 13.345 -9.775 -1.259 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.923 -10.918 -3.616 1.00 0.00 H new ATOM 0 HB3 TRP A 96 11.118 -9.862 -2.472 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.852 -7.597 -1.836 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.027 -6.035 -3.485 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.592 -10.602 -5.966 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 14.665 -6.074 -6.240 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 13.491 -9.744 -8.098 1.00 0.00 H new ATOM 0 HH2 TRP A 96 14.536 -7.522 -8.220 1.00 0.00 H new ATOM 1471 N ASP A 97 11.718 -10.881 0.178 1.00 0.00 N ATOM 1472 CA ASP A 97 11.286 -11.612 1.324 1.00 0.00 C ATOM 1473 C ASP A 97 9.851 -11.413 1.623 1.00 0.00 C ATOM 1474 O ASP A 97 9.292 -10.370 1.339 1.00 0.00 O ATOM 1475 CB ASP A 97 12.159 -11.270 2.520 1.00 0.00 C ATOM 1476 CG ASP A 97 13.616 -11.585 2.280 1.00 0.00 C ATOM 1477 OD1 ASP A 97 13.981 -12.785 2.340 1.00 0.00 O ATOM 1478 OD2 ASP A 97 14.413 -10.659 1.986 1.00 0.00 O ATOM 0 H ASP A 97 11.566 -9.873 0.220 1.00 0.00 H new ATOM 0 HA ASP A 97 11.399 -12.672 1.098 1.00 0.00 H new ATOM 0 HB2 ASP A 97 12.053 -10.210 2.752 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.809 -11.824 3.391 1.00 0.00 H new ATOM 1483 N PHE A 98 9.254 -12.419 2.234 1.00 0.00 N ATOM 1484 CA PHE A 98 7.838 -12.424 2.500 1.00 0.00 C ATOM 1485 C PHE A 98 7.443 -11.429 3.599 1.00 0.00 C ATOM 1486 O PHE A 98 6.307 -11.043 3.682 1.00 0.00 O ATOM 1487 CB PHE A 98 7.351 -13.854 2.817 1.00 0.00 C ATOM 1488 CG PHE A 98 7.467 -14.289 4.238 1.00 0.00 C ATOM 1489 CD1 PHE A 98 8.681 -14.584 4.798 1.00 0.00 C ATOM 1490 CD2 PHE A 98 6.339 -14.407 5.004 1.00 0.00 C ATOM 1491 CE1 PHE A 98 8.772 -14.986 6.102 1.00 0.00 C ATOM 1492 CE2 PHE A 98 6.404 -14.809 6.316 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.631 -15.102 6.874 1.00 0.00 C ATOM 0 H PHE A 98 9.742 -13.254 2.558 1.00 0.00 H new ATOM 0 HA PHE A 98 7.334 -12.087 1.594 1.00 0.00 H new ATOM 0 HB2 PHE A 98 6.306 -13.934 2.519 1.00 0.00 H new ATOM 0 HB3 PHE A 98 7.914 -14.553 2.198 1.00 0.00 H new ATOM 0 HD1 PHE A 98 9.578 -14.498 4.203 1.00 0.00 H new ATOM 0 HD2 PHE A 98 5.378 -14.179 4.568 1.00 0.00 H new ATOM 0 HE1 PHE A 98 9.737 -15.213 6.530 1.00 0.00 H new ATOM 0 HE2 PHE A 98 5.503 -14.895 6.905 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.700 -15.419 7.904 1.00 0.00 H new ATOM 1503 N ASP A 99 8.393 -11.065 4.440 1.00 0.00 N ATOM 1504 CA ASP A 99 8.166 -10.070 5.495 1.00 0.00 C ATOM 1505 C ASP A 99 8.406 -8.683 4.974 1.00 0.00 C ATOM 1506 O ASP A 99 7.733 -7.729 5.384 1.00 0.00 O ATOM 1507 CB ASP A 99 9.009 -10.360 6.749 1.00 0.00 C ATOM 1508 CG ASP A 99 10.486 -10.345 6.573 1.00 0.00 C ATOM 1509 OD1 ASP A 99 10.978 -10.809 5.523 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.163 -9.935 7.521 1.00 0.00 O ATOM 0 H ASP A 99 9.341 -11.442 4.420 1.00 0.00 H new ATOM 0 HA ASP A 99 7.122 -10.140 5.799 1.00 0.00 H new ATOM 0 HB2 ASP A 99 8.749 -9.627 7.512 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.721 -11.338 7.135 1.00 0.00 H new ATOM 1515 N MET A 100 9.329 -8.560 4.033 1.00 0.00 N ATOM 1516 CA MET A 100 9.597 -7.266 3.412 1.00 0.00 C ATOM 1517 C MET A 100 8.512 -6.952 2.412 1.00 0.00 C ATOM 1518 O MET A 100 8.067 -5.817 2.293 1.00 0.00 O ATOM 1519 CB MET A 100 10.962 -7.220 2.707 1.00 0.00 C ATOM 1520 CG MET A 100 12.137 -7.517 3.604 1.00 0.00 C ATOM 1521 SD MET A 100 12.189 -6.442 5.027 1.00 0.00 S ATOM 1522 CE MET A 100 13.791 -6.894 5.646 1.00 0.00 C ATOM 0 H MET A 100 9.901 -9.329 3.683 1.00 0.00 H new ATOM 0 HA MET A 100 9.614 -6.523 4.210 1.00 0.00 H new ATOM 0 HB2 MET A 100 10.957 -7.937 1.886 1.00 0.00 H new ATOM 0 HB3 MET A 100 11.097 -6.232 2.267 1.00 0.00 H new ATOM 0 HG2 MET A 100 12.085 -8.554 3.936 1.00 0.00 H new ATOM 0 HG3 MET A 100 13.061 -7.410 3.036 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.008 -6.320 6.547 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.803 -7.958 5.882 1.00 0.00 H new ATOM 0 HE3 MET A 100 14.547 -6.681 4.890 1.00 0.00 H new ATOM 1532 N LEU A 101 8.069 -7.962 1.695 1.00 0.00 N ATOM 1533 CA LEU A 101 7.030 -7.791 0.725 1.00 0.00 C ATOM 1534 C LEU A 101 5.703 -8.016 1.433 1.00 0.00 C ATOM 1535 O LEU A 101 5.177 -9.128 1.462 1.00 0.00 O ATOM 1536 CB LEU A 101 7.244 -8.799 -0.426 1.00 0.00 C ATOM 1537 CG LEU A 101 6.434 -8.627 -1.713 1.00 0.00 C ATOM 1538 CD1 LEU A 101 7.091 -9.434 -2.787 1.00 0.00 C ATOM 1539 CD2 LEU A 101 5.023 -9.127 -1.568 1.00 0.00 C ATOM 0 H LEU A 101 8.422 -8.916 1.773 1.00 0.00 H new ATOM 0 HA LEU A 101 7.039 -6.791 0.292 1.00 0.00 H new ATOM 0 HB2 LEU A 101 8.300 -8.775 -0.694 1.00 0.00 H new ATOM 0 HB3 LEU A 101 7.037 -9.795 -0.036 1.00 0.00 H new ATOM 0 HG LEU A 101 6.401 -7.564 -1.950 1.00 0.00 H new ATOM 0 HD11 LEU A 101 6.531 -9.328 -3.716 1.00 0.00 H new ATOM 0 HD12 LEU A 101 8.111 -9.080 -2.936 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.110 -10.483 -2.493 1.00 0.00 H new ATOM 0 HD21 LEU A 101 4.488 -8.984 -2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.037 -10.187 -1.316 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.520 -8.573 -0.776 1.00 0.00 H new ATOM 1551 N THR A 102 5.240 -6.948 2.064 1.00 0.00 N ATOM 1552 CA THR A 102 3.996 -6.848 2.839 1.00 0.00 C ATOM 1553 C THR A 102 4.263 -5.759 3.881 1.00 0.00 C ATOM 1554 O THR A 102 3.383 -4.965 4.251 1.00 0.00 O ATOM 1555 CB THR A 102 3.595 -8.182 3.581 1.00 0.00 C ATOM 1556 OG1 THR A 102 2.389 -8.039 4.345 1.00 0.00 O ATOM 1557 CG2 THR A 102 4.699 -8.678 4.471 1.00 0.00 C ATOM 0 H THR A 102 5.751 -6.066 2.052 1.00 0.00 H new ATOM 0 HA THR A 102 3.167 -6.630 2.166 1.00 0.00 H new ATOM 0 HB THR A 102 3.417 -8.918 2.797 1.00 0.00 H new ATOM 0 HG1 THR A 102 1.659 -8.513 3.895 1.00 0.00 H new ATOM 0 HG21 THR A 102 4.384 -9.598 4.964 1.00 0.00 H new ATOM 0 HG22 THR A 102 5.589 -8.873 3.873 1.00 0.00 H new ATOM 0 HG23 THR A 102 4.927 -7.923 5.224 1.00 0.00 H new ATOM 1661 N ASP A 111 12.973 0.504 6.528 1.00 0.00 N ATOM 1662 CA ASP A 111 14.222 0.496 5.770 1.00 0.00 C ATOM 1663 C ASP A 111 14.187 -0.283 4.438 1.00 0.00 C ATOM 1664 O ASP A 111 14.484 0.297 3.367 1.00 0.00 O ATOM 1665 CB ASP A 111 15.376 -0.014 6.645 1.00 0.00 C ATOM 1666 CG ASP A 111 16.671 -0.131 5.870 1.00 0.00 C ATOM 1667 OD1 ASP A 111 17.396 0.871 5.757 1.00 0.00 O ATOM 1668 OD2 ASP A 111 16.984 -1.233 5.366 1.00 0.00 O ATOM 0 HA ASP A 111 14.380 1.537 5.487 1.00 0.00 H new ATOM 0 HB2 ASP A 111 15.518 0.663 7.487 1.00 0.00 H new ATOM 0 HB3 ASP A 111 15.113 -0.987 7.059 1.00 0.00 H new ATOM 1673 N ALA A 112 13.808 -1.562 4.476 1.00 0.00 N ATOM 1674 CA ALA A 112 13.930 -2.433 3.295 1.00 0.00 C ATOM 1675 C ALA A 112 13.184 -1.912 2.093 1.00 0.00 C ATOM 1676 O ALA A 112 13.734 -1.823 0.995 1.00 0.00 O ATOM 1677 CB ALA A 112 13.497 -3.838 3.600 1.00 0.00 C ATOM 0 H ALA A 112 13.417 -2.018 5.300 1.00 0.00 H new ATOM 0 HA ALA A 112 14.990 -2.435 3.041 1.00 0.00 H new ATOM 0 HB1 ALA A 112 13.600 -4.453 2.706 1.00 0.00 H new ATOM 0 HB2 ALA A 112 14.121 -4.246 4.395 1.00 0.00 H new ATOM 0 HB3 ALA A 112 12.455 -3.836 3.921 1.00 0.00 H new ATOM 1683 N GLN A 113 11.934 -1.577 2.288 1.00 0.00 N ATOM 1684 CA GLN A 113 11.131 -1.038 1.209 1.00 0.00 C ATOM 1685 C GLN A 113 11.545 0.376 0.911 1.00 0.00 C ATOM 1686 O GLN A 113 11.382 0.799 -0.193 1.00 0.00 O ATOM 1687 CB GLN A 113 9.618 -1.074 1.469 1.00 0.00 C ATOM 1688 CG GLN A 113 9.121 -2.295 2.215 1.00 0.00 C ATOM 1689 CD GLN A 113 9.151 -2.086 3.710 1.00 0.00 C ATOM 1690 OE1 GLN A 113 9.972 -1.143 4.175 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 8.388 -2.704 4.437 1.00 0.00 N flip ATOM 0 H GLN A 113 11.447 -1.666 3.180 1.00 0.00 H new ATOM 0 HA GLN A 113 11.317 -1.689 0.355 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.341 -0.185 2.035 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.100 -1.017 0.512 1.00 0.00 H new ATOM 0 HG2 GLN A 113 8.103 -2.525 1.900 1.00 0.00 H new ATOM 0 HG3 GLN A 113 9.737 -3.156 1.955 1.00 0.00 H new ATOM 0 HE21 GLN A 113 7.775 -3.418 4.044 1.00 0.00 H new ATOM 0 HE22 GLN A 113 8.364 -2.506 5.437 1.00 0.00 H new ATOM 1700 N MET A 114 12.075 1.119 1.924 1.00 0.00 N ATOM 1701 CA MET A 114 12.606 2.472 1.722 1.00 0.00 C ATOM 1702 C MET A 114 13.612 2.530 0.554 1.00 0.00 C ATOM 1703 O MET A 114 13.716 3.522 -0.143 1.00 0.00 O ATOM 1704 CB MET A 114 13.269 3.007 3.016 1.00 0.00 C ATOM 1705 CG MET A 114 14.353 4.049 2.808 1.00 0.00 C ATOM 1706 SD MET A 114 15.065 4.639 4.353 1.00 0.00 S ATOM 1707 CE MET A 114 16.340 5.729 3.713 1.00 0.00 C ATOM 0 H MET A 114 12.140 0.790 2.887 1.00 0.00 H new ATOM 0 HA MET A 114 11.758 3.108 1.467 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.494 3.435 3.651 1.00 0.00 H new ATOM 0 HB3 MET A 114 13.697 2.165 3.560 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.143 3.625 2.188 1.00 0.00 H new ATOM 0 HG3 MET A 114 13.937 4.894 2.260 1.00 0.00 H new ATOM 0 HE1 MET A 114 16.859 6.209 4.543 1.00 0.00 H new ATOM 0 HE2 MET A 114 17.053 5.150 3.126 1.00 0.00 H new ATOM 0 HE3 MET A 114 15.884 6.491 3.081 1.00 0.00 H new ATOM 1717 N GLN A 115 14.350 1.454 0.380 1.00 0.00 N ATOM 1718 CA GLN A 115 15.306 1.357 -0.712 1.00 0.00 C ATOM 1719 C GLN A 115 14.611 1.241 -2.077 1.00 0.00 C ATOM 1720 O GLN A 115 15.204 1.591 -3.096 1.00 0.00 O ATOM 1721 CB GLN A 115 16.258 0.206 -0.474 1.00 0.00 C ATOM 1722 CG GLN A 115 17.229 0.485 0.645 1.00 0.00 C ATOM 1723 CD GLN A 115 17.502 -0.707 1.480 1.00 0.00 C ATOM 1724 OE1 GLN A 115 18.412 -1.502 1.205 1.00 0.00 O ATOM 1725 NE2 GLN A 115 16.753 -0.815 2.527 1.00 0.00 N ATOM 0 H GLN A 115 14.309 0.630 0.980 1.00 0.00 H new ATOM 0 HA GLN A 115 15.883 2.282 -0.735 1.00 0.00 H new ATOM 0 HB2 GLN A 115 15.686 -0.692 -0.240 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.812 0.001 -1.390 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.166 0.850 0.224 1.00 0.00 H new ATOM 0 HG3 GLN A 115 16.831 1.281 1.275 1.00 0.00 H new ATOM 0 HE21 GLN A 115 16.018 -0.129 2.702 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.896 -1.586 3.179 1.00 0.00 H new ATOM 1734 N TYR A 116 13.366 0.752 -2.087 1.00 0.00 N ATOM 1735 CA TYR A 116 12.539 0.628 -3.284 1.00 0.00 C ATOM 1736 C TYR A 116 13.176 -0.152 -4.413 1.00 0.00 C ATOM 1737 O TYR A 116 13.400 0.379 -5.503 1.00 0.00 O ATOM 1738 CB TYR A 116 11.893 1.964 -3.760 1.00 0.00 C ATOM 1739 CG TYR A 116 10.898 2.522 -2.777 1.00 0.00 C ATOM 1740 CD1 TYR A 116 9.636 1.969 -2.676 1.00 0.00 C ATOM 1741 CD2 TYR A 116 11.219 3.568 -1.932 1.00 0.00 C ATOM 1742 CE1 TYR A 116 8.722 2.429 -1.768 1.00 0.00 C ATOM 1743 CE2 TYR A 116 10.308 4.048 -1.015 1.00 0.00 C ATOM 1744 CZ TYR A 116 9.059 3.468 -0.933 1.00 0.00 C ATOM 1745 OH TYR A 116 8.145 3.926 -0.006 1.00 0.00 O ATOM 0 H TYR A 116 12.898 0.425 -1.242 1.00 0.00 H new ATOM 0 HA TYR A 116 11.707 0.009 -2.947 1.00 0.00 H new ATOM 0 HB2 TYR A 116 12.679 2.700 -3.930 1.00 0.00 H new ATOM 0 HB3 TYR A 116 11.397 1.800 -4.717 1.00 0.00 H new ATOM 0 HD1 TYR A 116 9.364 1.154 -3.330 1.00 0.00 H new ATOM 0 HD2 TYR A 116 12.200 4.017 -1.991 1.00 0.00 H new ATOM 0 HE1 TYR A 116 7.742 1.979 -1.707 1.00 0.00 H new ATOM 0 HE2 TYR A 116 10.570 4.871 -0.367 1.00 0.00 H new ATOM 0 HH TYR A 116 8.539 4.663 0.506 1.00 0.00 H new ATOM 1755 N ASP A 117 13.508 -1.403 -4.124 1.00 0.00 N ATOM 1756 CA ASP A 117 14.026 -2.316 -5.138 1.00 0.00 C ATOM 1757 C ASP A 117 12.964 -2.515 -6.207 1.00 0.00 C ATOM 1758 O ASP A 117 11.790 -2.679 -5.872 1.00 0.00 O ATOM 1759 CB ASP A 117 14.341 -3.704 -4.553 1.00 0.00 C ATOM 1760 CG ASP A 117 15.432 -3.730 -3.541 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.611 -3.666 -3.929 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.137 -3.863 -2.352 1.00 0.00 O ATOM 0 H ASP A 117 13.428 -1.811 -3.193 1.00 0.00 H new ATOM 0 HA ASP A 117 14.940 -1.877 -5.538 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.435 -4.103 -4.098 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.609 -4.373 -5.370 1.00 0.00 H new ATOM 1767 N PRO A 118 13.348 -2.527 -7.495 1.00 0.00 N ATOM 1768 CA PRO A 118 12.407 -2.683 -8.643 1.00 0.00 C ATOM 1769 C PRO A 118 11.467 -3.909 -8.511 1.00 0.00 C ATOM 1770 O PRO A 118 10.283 -3.844 -8.851 1.00 0.00 O ATOM 1771 CB PRO A 118 13.352 -2.867 -9.836 1.00 0.00 C ATOM 1772 CG PRO A 118 14.582 -2.130 -9.439 1.00 0.00 C ATOM 1773 CD PRO A 118 14.739 -2.352 -7.964 1.00 0.00 C ATOM 0 HA PRO A 118 11.731 -1.832 -8.723 1.00 0.00 H new ATOM 0 HB2 PRO A 118 13.560 -3.921 -10.021 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.922 -2.462 -10.752 1.00 0.00 H new ATOM 0 HG2 PRO A 118 15.451 -2.499 -9.984 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.491 -1.068 -9.666 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.348 -3.231 -7.752 1.00 0.00 H new ATOM 0 HD3 PRO A 118 15.223 -1.504 -7.479 1.00 0.00 H new ATOM 1781 N GLY A 119 11.963 -4.979 -7.904 1.00 0.00 N ATOM 1782 CA GLY A 119 11.176 -6.197 -7.826 1.00 0.00 C ATOM 1783 C GLY A 119 10.298 -6.169 -6.605 1.00 0.00 C ATOM 1784 O GLY A 119 9.191 -6.710 -6.605 1.00 0.00 O ATOM 0 H GLY A 119 12.884 -5.028 -7.469 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.563 -6.301 -8.721 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.836 -7.064 -7.789 1.00 0.00 H new ATOM 1788 N LEU A 120 10.752 -5.447 -5.601 1.00 0.00 N ATOM 1789 CA LEU A 120 10.044 -5.371 -4.349 1.00 0.00 C ATOM 1790 C LEU A 120 8.897 -4.391 -4.526 1.00 0.00 C ATOM 1791 O LEU A 120 7.741 -4.742 -4.324 1.00 0.00 O ATOM 1792 CB LEU A 120 10.967 -4.867 -3.239 1.00 0.00 C ATOM 1793 CG LEU A 120 10.381 -4.825 -1.821 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.946 -6.223 -1.357 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.406 -4.235 -0.865 1.00 0.00 C ATOM 0 H LEU A 120 11.614 -4.903 -5.633 1.00 0.00 H new ATOM 0 HA LEU A 120 9.679 -6.360 -4.070 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.855 -5.499 -3.222 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.297 -3.862 -3.501 1.00 0.00 H new ATOM 0 HG LEU A 120 9.493 -4.193 -1.829 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.535 -6.160 -0.349 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.186 -6.611 -2.035 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.808 -6.891 -1.357 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.990 -4.205 0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.304 -4.853 -0.868 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.660 -3.224 -1.183 1.00 0.00 H new ATOM 1807 N PHE A 121 9.236 -3.177 -5.018 1.00 0.00 N ATOM 1808 CA PHE A 121 8.267 -2.092 -5.161 1.00 0.00 C ATOM 1809 C PHE A 121 7.196 -2.422 -6.201 1.00 0.00 C ATOM 1810 O PHE A 121 6.035 -2.059 -6.034 1.00 0.00 O ATOM 1811 CB PHE A 121 8.972 -0.756 -5.481 1.00 0.00 C ATOM 1812 CG PHE A 121 8.068 0.466 -5.539 1.00 0.00 C ATOM 1813 CD1 PHE A 121 7.082 0.691 -4.578 1.00 0.00 C ATOM 1814 CD2 PHE A 121 8.235 1.399 -6.540 1.00 0.00 C ATOM 1815 CE1 PHE A 121 6.285 1.828 -4.638 1.00 0.00 C ATOM 1816 CE2 PHE A 121 7.444 2.526 -6.604 1.00 0.00 C ATOM 1817 CZ PHE A 121 6.469 2.741 -5.659 1.00 0.00 C ATOM 0 H PHE A 121 10.179 -2.934 -5.321 1.00 0.00 H new ATOM 0 HA PHE A 121 7.759 -1.979 -4.203 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.741 -0.582 -4.728 1.00 0.00 H new ATOM 0 HB3 PHE A 121 9.481 -0.855 -6.440 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.937 -0.024 -3.781 1.00 0.00 H new ATOM 0 HD2 PHE A 121 8.999 1.244 -7.287 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.525 1.997 -3.890 1.00 0.00 H new ATOM 0 HE2 PHE A 121 7.591 3.242 -7.399 1.00 0.00 H new ATOM 0 HZ PHE A 121 5.847 3.622 -5.714 1.00 0.00 H new ATOM 1827 N ALA A 122 7.569 -3.109 -7.274 1.00 0.00 N ATOM 1828 CA ALA A 122 6.581 -3.507 -8.259 1.00 0.00 C ATOM 1829 C ALA A 122 5.629 -4.549 -7.698 1.00 0.00 C ATOM 1830 O ALA A 122 4.422 -4.427 -7.867 1.00 0.00 O ATOM 1831 CB ALA A 122 7.234 -3.996 -9.534 1.00 0.00 C ATOM 0 H ALA A 122 8.526 -3.395 -7.479 1.00 0.00 H new ATOM 0 HA ALA A 122 5.996 -2.622 -8.507 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.464 -4.286 -10.249 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.843 -3.199 -9.960 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.866 -4.856 -9.313 1.00 0.00 H new ATOM 1837 N GLN A 123 6.160 -5.559 -6.998 1.00 0.00 N ATOM 1838 CA GLN A 123 5.294 -6.603 -6.461 1.00 0.00 C ATOM 1839 C GLN A 123 4.424 -6.117 -5.317 1.00 0.00 C ATOM 1840 O GLN A 123 3.236 -6.448 -5.260 1.00 0.00 O ATOM 1841 CB GLN A 123 6.062 -7.872 -6.102 1.00 0.00 C ATOM 1842 CG GLN A 123 6.634 -8.606 -7.307 1.00 0.00 C ATOM 1843 CD GLN A 123 5.551 -9.017 -8.313 1.00 0.00 C ATOM 1844 OE1 GLN A 123 4.970 -10.094 -8.223 1.00 0.00 O ATOM 1845 NE2 GLN A 123 5.301 -8.180 -9.290 1.00 0.00 N ATOM 0 H GLN A 123 7.154 -5.671 -6.797 1.00 0.00 H new ATOM 0 HA GLN A 123 4.613 -6.869 -7.269 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.877 -7.613 -5.426 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.399 -8.546 -5.559 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.364 -7.967 -7.804 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.166 -9.495 -6.968 1.00 0.00 H new ATOM 0 HE21 GLN A 123 5.799 -7.291 -9.340 1.00 0.00 H new ATOM 0 HE22 GLN A 123 4.608 -8.417 -10.000 1.00 0.00 H new ATOM 1854 N ILE A 124 4.976 -5.298 -4.433 1.00 0.00 N ATOM 1855 CA ILE A 124 4.196 -4.803 -3.309 1.00 0.00 C ATOM 1856 C ILE A 124 3.035 -3.906 -3.768 1.00 0.00 C ATOM 1857 O ILE A 124 1.933 -4.003 -3.229 1.00 0.00 O ATOM 1858 CB ILE A 124 5.052 -4.093 -2.199 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.725 -2.809 -2.727 1.00 0.00 C ATOM 1860 CG2 ILE A 124 6.069 -5.058 -1.618 1.00 0.00 C ATOM 1861 CD1 ILE A 124 6.529 -2.031 -1.692 1.00 0.00 C ATOM 0 H ILE A 124 5.940 -4.968 -4.470 1.00 0.00 H new ATOM 0 HA ILE A 124 3.778 -5.695 -2.841 1.00 0.00 H new ATOM 0 HB ILE A 124 4.378 -3.786 -1.399 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.385 -3.076 -3.552 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.955 -2.154 -3.134 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.654 -4.551 -0.851 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.552 -5.910 -1.177 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.733 -5.407 -2.409 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.963 -1.146 -2.158 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.874 -1.727 -0.876 1.00 0.00 H new ATOM 0 HD13 ILE A 124 7.326 -2.663 -1.301 1.00 0.00 H new ATOM 1873 N GLN A 125 3.273 -3.091 -4.804 1.00 0.00 N ATOM 1874 CA GLN A 125 2.254 -2.197 -5.325 1.00 0.00 C ATOM 1875 C GLN A 125 1.114 -2.999 -5.953 1.00 0.00 C ATOM 1876 O GLN A 125 -0.079 -2.749 -5.676 1.00 0.00 O ATOM 1877 CB GLN A 125 2.842 -1.251 -6.366 1.00 0.00 C ATOM 1878 CG GLN A 125 1.846 -0.229 -6.849 1.00 0.00 C ATOM 1879 CD GLN A 125 2.388 0.771 -7.846 1.00 0.00 C ATOM 1880 OE1 GLN A 125 3.585 1.095 -7.862 1.00 0.00 O ATOM 1881 NE2 GLN A 125 1.511 1.294 -8.651 1.00 0.00 N ATOM 0 H GLN A 125 4.167 -3.039 -5.292 1.00 0.00 H new ATOM 0 HA GLN A 125 1.867 -1.609 -4.493 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.705 -0.739 -5.940 1.00 0.00 H new ATOM 0 HB3 GLN A 125 3.203 -1.831 -7.216 1.00 0.00 H new ATOM 0 HG2 GLN A 125 1.003 -0.751 -7.302 1.00 0.00 H new ATOM 0 HG3 GLN A 125 1.458 0.314 -5.987 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.536 0.999 -8.604 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.798 2.000 -9.329 1.00 0.00 H new ATOM 1890 N ALA A 126 1.492 -3.982 -6.771 1.00 0.00 N ATOM 1891 CA ALA A 126 0.543 -4.816 -7.478 1.00 0.00 C ATOM 1892 C ALA A 126 -0.353 -5.542 -6.497 1.00 0.00 C ATOM 1893 O ALA A 126 -1.593 -5.408 -6.544 1.00 0.00 O ATOM 1894 CB ALA A 126 1.285 -5.825 -8.349 1.00 0.00 C ATOM 0 H ALA A 126 2.467 -4.216 -6.956 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.075 -4.181 -8.113 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.564 -6.449 -8.878 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.905 -5.295 -9.072 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.916 -6.453 -7.721 1.00 0.00 H new ATOM 1900 N ALA A 127 0.276 -6.243 -5.555 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.436 -7.033 -4.577 1.00 0.00 C ATOM 1902 C ALA A 127 -1.343 -6.164 -3.724 1.00 0.00 C ATOM 1903 O ALA A 127 -2.443 -6.602 -3.362 1.00 0.00 O ATOM 1904 CB ALA A 127 0.535 -7.794 -3.689 1.00 0.00 C ATOM 0 H ALA A 127 1.291 -6.273 -5.456 1.00 0.00 H new ATOM 0 HA ALA A 127 -1.054 -7.748 -5.120 1.00 0.00 H new ATOM 0 HB1 ALA A 127 -0.023 -8.382 -2.960 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.144 -8.459 -4.302 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.181 -7.088 -3.167 1.00 0.00 H new ATOM 1910 N ALA A 128 -0.896 -4.918 -3.427 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.667 -4.009 -2.597 1.00 0.00 C ATOM 1912 C ALA A 128 -2.998 -3.717 -3.224 1.00 0.00 C ATOM 1913 O ALA A 128 -3.968 -4.086 -2.691 1.00 0.00 O ATOM 1914 CB ALA A 128 -0.918 -2.715 -2.365 1.00 0.00 C ATOM 0 H ALA A 128 -0.009 -4.538 -3.756 1.00 0.00 H new ATOM 0 HA ALA A 128 -1.826 -4.497 -1.635 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.519 -2.054 -1.741 1.00 0.00 H new ATOM 0 HB2 ALA A 128 0.027 -2.926 -1.865 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.722 -2.231 -3.322 1.00 0.00 H new ATOM 1920 N THR A 129 -3.012 -3.128 -4.387 1.00 0.00 N ATOM 1921 CA THR A 129 -4.297 -2.821 -5.067 1.00 0.00 C ATOM 1922 C THR A 129 -5.215 -4.097 -5.252 1.00 0.00 C ATOM 1923 O THR A 129 -6.479 -4.069 -5.016 1.00 0.00 O ATOM 1924 CB THR A 129 -4.014 -2.146 -6.430 1.00 0.00 C ATOM 1925 OG1 THR A 129 -3.039 -2.912 -7.181 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.481 -0.743 -6.236 1.00 0.00 C ATOM 0 H THR A 129 -2.177 -2.844 -4.900 1.00 0.00 H new ATOM 0 HA THR A 129 -4.852 -2.137 -4.426 1.00 0.00 H new ATOM 0 HB THR A 129 -4.955 -2.104 -6.979 1.00 0.00 H new ATOM 0 HG1 THR A 129 -2.860 -3.757 -6.718 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.290 -0.289 -7.208 1.00 0.00 H new ATOM 0 HG22 THR A 129 -4.215 -0.146 -5.695 1.00 0.00 H new ATOM 0 HG23 THR A 129 -2.553 -0.782 -5.665 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.530 -5.227 -5.480 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.152 -6.511 -5.826 1.00 0.00 C ATOM 1936 C LYS A 130 -5.873 -7.029 -4.605 1.00 0.00 C ATOM 1937 O LYS A 130 -6.675 -7.893 -4.669 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.051 -7.482 -6.289 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.494 -8.781 -6.966 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.278 -9.590 -7.429 1.00 0.00 C ATOM 1941 CE LYS A 130 -2.456 -8.828 -8.484 1.00 0.00 C ATOM 1942 NZ LYS A 130 -1.229 -9.543 -8.877 1.00 0.00 N ATOM 0 H LYS A 130 -3.512 -5.274 -5.428 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.873 -6.403 -6.636 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.400 -6.947 -6.981 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.447 -7.744 -5.421 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.089 -9.374 -6.272 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -5.132 -8.553 -7.820 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.646 -9.820 -6.571 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -3.610 -10.541 -7.844 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -3.072 -8.661 -9.367 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -2.189 -7.847 -8.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -0.715 -8.985 -9.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -0.625 -9.680 -8.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -1.480 -10.469 -9.278 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.448 -6.550 -3.508 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.072 -6.698 -2.261 1.00 0.00 C ATOM 1958 C ALA A 131 -7.119 -5.610 -2.091 1.00 0.00 C ATOM 1959 O ALA A 131 -8.315 -5.895 -2.087 1.00 0.00 O ATOM 1960 CB ALA A 131 -4.982 -6.567 -1.272 1.00 0.00 C ATOM 0 H ALA A 131 -4.589 -6.002 -3.454 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.589 -7.651 -2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.389 -6.671 -0.266 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.238 -7.345 -1.445 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.514 -5.588 -1.374 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.639 -4.363 -2.130 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.355 -3.119 -1.778 1.00 0.00 C ATOM 1968 C TRP A 132 -8.444 -2.695 -2.770 1.00 0.00 C ATOM 1969 O TRP A 132 -8.705 -1.511 -2.959 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.394 -1.932 -1.511 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.405 -2.170 -0.424 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -4.894 -3.336 -0.119 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -4.818 -1.236 0.497 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -3.966 -3.238 0.796 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -3.888 -1.969 1.225 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -4.940 0.138 0.771 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.082 -1.409 2.180 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.140 0.673 1.734 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.219 -0.106 2.416 1.00 0.00 C ATOM 0 H TRP A 132 -5.681 -4.177 -2.426 1.00 0.00 H new ATOM 0 HA TRP A 132 -7.867 -3.379 -0.852 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -5.856 -1.703 -2.431 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -6.986 -1.052 -1.260 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.202 -4.268 -0.570 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.389 -4.009 1.133 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -5.648 0.751 0.233 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.361 -2.003 2.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.225 1.723 1.971 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -2.592 0.359 3.163 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.029 -3.624 -3.433 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.229 -3.309 -4.186 1.00 0.00 C ATOM 1992 C ARG A 133 -11.545 -4.002 -3.706 1.00 0.00 C ATOM 1993 O ARG A 133 -12.564 -3.350 -3.594 1.00 0.00 O ATOM 1994 CB ARG A 133 -10.028 -3.424 -5.726 1.00 0.00 C ATOM 1995 CG ARG A 133 -11.298 -3.131 -6.580 1.00 0.00 C ATOM 1996 CD ARG A 133 -12.276 -4.307 -6.582 1.00 0.00 C ATOM 1997 NE ARG A 133 -13.670 -3.950 -6.942 1.00 0.00 N ATOM 1998 CZ ARG A 133 -14.343 -4.488 -7.980 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -13.704 -5.229 -8.874 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -15.643 -4.268 -8.132 1.00 0.00 N ATOM 0 H ARG A 133 -8.720 -4.595 -3.483 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.392 -2.257 -3.953 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -9.239 -2.734 -6.027 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -9.677 -4.430 -5.957 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.799 -2.245 -6.191 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -11.001 -2.906 -7.604 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -11.916 -5.061 -7.282 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -12.276 -4.764 -5.593 1.00 0.00 H new ATOM 0 HE ARG A 133 -14.149 -3.255 -6.370 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -12.702 -5.393 -8.778 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -14.214 -5.635 -9.658 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -16.144 -3.687 -7.460 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -16.141 -4.680 -8.921 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.473 -5.287 -3.402 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.668 -6.237 -3.420 1.00 0.00 C ATOM 2016 C LYS A 134 -13.923 -6.049 -2.564 1.00 0.00 C ATOM 2017 O LYS A 134 -14.409 -7.013 -1.998 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.329 -7.708 -3.576 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.936 -8.108 -4.978 1.00 0.00 C ATOM 2020 CD LYS A 134 -10.711 -7.393 -5.458 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.542 -7.731 -4.609 1.00 0.00 C ATOM 2022 NZ LYS A 134 -9.088 -9.122 -4.828 1.00 0.00 N ATOM 0 H LYS A 134 -10.601 -5.741 -3.130 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.036 -5.794 -4.345 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -11.512 -7.955 -2.898 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -13.190 -8.302 -3.269 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.760 -9.183 -5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.763 -7.900 -5.657 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.506 -7.666 -6.493 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -10.881 -6.317 -5.440 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -8.724 -7.043 -4.826 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.803 -7.595 -3.560 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -8.049 -9.147 -4.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.424 -9.724 -4.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.472 -9.475 -5.728 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.411 -4.883 -2.422 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.644 -4.714 -1.683 1.00 0.00 C ATOM 2038 C LEU A 135 -16.837 -4.859 -2.590 1.00 0.00 C ATOM 2039 O LEU A 135 -16.945 -4.172 -3.598 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.673 -3.407 -0.918 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.937 -3.379 0.441 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.667 -4.190 0.424 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.543 -1.993 0.731 1.00 0.00 C ATOM 0 H LEU A 135 -14.001 -4.026 -2.793 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.693 -5.509 -0.939 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -15.244 -2.632 -1.553 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.715 -3.137 -0.746 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.618 -3.794 1.184 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -13.189 -4.137 1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -13.902 -5.228 0.190 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -12.991 -3.792 -0.333 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -14.022 -1.955 1.688 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.883 -1.630 -0.057 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -15.432 -1.364 0.777 1.00 0.00 H new ATOM 2055 N PRO A 136 -17.715 -5.821 -2.298 1.00 0.00 N ATOM 2056 CA PRO A 136 -18.915 -6.020 -3.079 1.00 0.00 C ATOM 2057 C PRO A 136 -19.849 -4.816 -2.998 1.00 0.00 C ATOM 2058 O PRO A 136 -20.327 -4.315 -4.015 1.00 0.00 O ATOM 2059 CB PRO A 136 -19.584 -7.241 -2.424 1.00 0.00 C ATOM 2060 CG PRO A 136 -18.519 -7.910 -1.637 1.00 0.00 C ATOM 2061 CD PRO A 136 -17.581 -6.822 -1.213 1.00 0.00 C ATOM 0 HA PRO A 136 -18.690 -6.158 -4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -20.412 -6.937 -1.783 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -19.995 -7.913 -3.177 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -18.937 -8.425 -0.772 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -18.003 -8.660 -2.236 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.858 -6.406 -0.244 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -16.557 -7.185 -1.123 1.00 0.00 H new