USER MOD reduce.3.24.130724 H: found=0, std=0, add=875, rem=0, adj=27 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 89 ASN : amide:sc= -5! C(o=-4.5!,f=-7.7!) USER MOD Set 1.2: A 94 ASN : amide:sc= 0.512 K(o=-4.5,f=-5.8) USER MOD Set 2.1: A 59 ASN : amide:sc= 0.209 K(o=1.7,f=-1.2) USER MOD Set 2.2: A 75 LYS NZ :NH3+ 149:sc= 1.53 (180deg=0.157) USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= -0.398 K(o=-0.4,f=-1.4) USER MOD Single : A 25 LYS NZ :NH3+ 160:sc= -0.089 (180deg=-0.482) USER MOD Single : A 28 LYS NZ :NH3+ -152:sc= 1.27 (180deg=0.229) USER MOD Single : A 29 THR OG1 : rot 71:sc= 0.873 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 THR OG1 : rot -5:sc= 1.05 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 180:sc= -0.0439 USER MOD Single : A 47 SER OG : rot 70:sc= 0.57 USER MOD Single : A 51 ASN : amide:sc= -2.16 X(o=-2.2,f=-1.9!) USER MOD Single : A 54 THR OG1 : rot 93:sc= 0.316 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 75:sc= 1.19 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS :FLIP no HE2:sc= 0.174 F(o=-0.66,f=0.17) USER MOD Single : A 76 SER OG : rot -91:sc= 1.27 USER MOD Single : A 81 ASN : amide:sc= -0.144 K(o=-0.14,f=-0.82) USER MOD Single : A 82 CYS SG : rot 160:sc= 0.362 USER MOD Single : A 85 THR OG1 : rot 100:sc= 1.27 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 GLN : amide:sc= 0.22 X(o=0.22,f=-0.23) USER MOD Single : A 91 GLN : amide:sc= -0.721! X(o=-0.72!,f=-0.7) USER MOD Single : A 100 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 102 THR OG1 : rot -69:sc= 1.9 USER MOD Single : A 113 GLN :FLIP amide:sc= -2.69! C(o=-6.8!,f=-2.7!) USER MOD Single : A 114 MET CE :methyl -161:sc= -0.077 (180deg=-0.523) USER MOD Single : A 115 GLN :FLIP amide:sc= -0.471 F(o=-2.8!,f=-0.47) USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.289 K(o=-0.29,f=-0.88) USER MOD Single : A 125 GLN : amide:sc= -0.036 X(o=-0.036,f=-0.47) USER MOD Single : A 129 THR OG1 : rot -120:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 166:sc= -0.0112 (180deg=-0.203) USER MOD Single : A 134 LYS NZ :NH3+ -158:sc= 1.23 (180deg=1.01) USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 4.615 11.783 -0.440 1.00 0.00 N ATOM 2 CA PRO A 1 4.704 11.266 0.906 1.00 0.00 C ATOM 3 C PRO A 1 6.124 11.409 1.410 1.00 0.00 C ATOM 4 O PRO A 1 6.461 12.413 1.967 1.00 0.00 O ATOM 5 CB PRO A 1 4.249 9.826 0.939 1.00 0.00 C ATOM 6 CG PRO A 1 4.094 9.470 -0.496 1.00 0.00 C ATOM 7 CD PRO A 1 4.051 10.768 -1.307 1.00 0.00 C ATOM 0 H2 PRO A 1 5.540 12.055 -0.773 1.00 0.00 H new ATOM 0 H3 PRO A 1 4.034 12.621 -0.456 1.00 0.00 H new ATOM 0 HA PRO A 1 4.048 11.837 1.563 1.00 0.00 H new ATOM 0 HB2 PRO A 1 4.981 9.187 1.433 1.00 0.00 H new ATOM 0 HB3 PRO A 1 3.311 9.715 1.482 1.00 0.00 H new ATOM 0 HG2 PRO A 1 4.923 8.844 -0.824 1.00 0.00 H new ATOM 0 HG3 PRO A 1 3.180 8.895 -0.649 1.00 0.00 H new ATOM 0 HD2 PRO A 1 4.626 10.675 -2.228 1.00 0.00 H new ATOM 0 HD3 PRO A 1 3.030 11.019 -1.593 1.00 0.00 H new ATOM 17 N VAL A 2 6.962 10.421 1.154 1.00 0.00 N ATOM 18 CA VAL A 2 8.363 10.466 1.554 1.00 0.00 C ATOM 19 C VAL A 2 9.103 11.324 0.545 1.00 0.00 C ATOM 20 O VAL A 2 8.701 11.365 -0.618 1.00 0.00 O ATOM 21 CB VAL A 2 8.945 9.003 1.546 1.00 0.00 C ATOM 22 CG1 VAL A 2 10.433 8.952 1.865 1.00 0.00 C ATOM 23 CG2 VAL A 2 8.184 8.134 2.527 1.00 0.00 C ATOM 0 H VAL A 2 6.695 9.566 0.665 1.00 0.00 H new ATOM 0 HA VAL A 2 8.473 10.884 2.555 1.00 0.00 H new ATOM 0 HB VAL A 2 8.821 8.624 0.532 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.774 7.917 1.844 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.984 9.531 1.124 1.00 0.00 H new ATOM 0 HG13 VAL A 2 10.607 9.372 2.856 1.00 0.00 H new ATOM 0 HG21 VAL A 2 8.595 7.124 2.513 1.00 0.00 H new ATOM 0 HG22 VAL A 2 8.277 8.550 3.530 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.132 8.102 2.244 1.00 0.00 H new ATOM 33 N THR A 3 10.148 12.012 0.940 1.00 0.00 N ATOM 34 CA THR A 3 10.918 12.786 0.028 1.00 0.00 C ATOM 35 C THR A 3 12.185 12.008 -0.262 1.00 0.00 C ATOM 36 O THR A 3 12.706 11.323 0.632 1.00 0.00 O ATOM 37 CB THR A 3 11.234 14.159 0.637 1.00 0.00 C ATOM 38 OG1 THR A 3 11.910 14.001 1.886 1.00 0.00 O ATOM 39 CG2 THR A 3 9.947 14.904 0.884 1.00 0.00 C ATOM 0 H THR A 3 10.479 12.043 1.904 1.00 0.00 H new ATOM 0 HA THR A 3 10.370 12.964 -0.897 1.00 0.00 H new ATOM 0 HB THR A 3 11.868 14.711 -0.056 1.00 0.00 H new ATOM 0 HG1 THR A 3 12.108 14.883 2.265 1.00 0.00 H new ATOM 0 HG21 THR A 3 10.169 15.880 1.317 1.00 0.00 H new ATOM 0 HG22 THR A 3 9.417 15.037 -0.059 1.00 0.00 H new ATOM 0 HG23 THR A 3 9.324 14.335 1.573 1.00 0.00 H new ATOM 228 N HIS A 16 11.775 10.839 5.609 1.00 0.00 N ATOM 229 CA HIS A 16 10.469 10.282 5.786 1.00 0.00 C ATOM 230 C HIS A 16 9.576 11.462 6.050 1.00 0.00 C ATOM 231 O HIS A 16 9.904 12.303 6.884 1.00 0.00 O ATOM 232 CB HIS A 16 10.463 9.301 6.973 1.00 0.00 C ATOM 233 CG HIS A 16 9.106 8.767 7.366 1.00 0.00 C ATOM 234 ND1 HIS A 16 8.596 8.881 8.642 1.00 0.00 N ATOM 235 CD2 HIS A 16 8.165 8.098 6.652 1.00 0.00 C ATOM 236 CE1 HIS A 16 7.419 8.314 8.695 1.00 0.00 C ATOM 237 NE2 HIS A 16 7.135 7.831 7.503 1.00 0.00 N ATOM 0 HA HIS A 16 10.136 9.714 4.917 1.00 0.00 H new ATOM 0 HB2 HIS A 16 11.109 8.458 6.729 1.00 0.00 H new ATOM 0 HB3 HIS A 16 10.902 9.800 7.837 1.00 0.00 H new ATOM 0 HD2 HIS A 16 8.222 7.829 5.608 1.00 0.00 H new ATOM 0 HE1 HIS A 16 6.787 8.252 9.568 1.00 0.00 H new ATOM 0 HE2 HIS A 16 6.279 7.335 7.256 1.00 0.00 H new ATOM 246 N ASN A 17 8.466 11.533 5.410 1.00 0.00 N ATOM 247 CA ASN A 17 7.620 12.683 5.486 1.00 0.00 C ATOM 248 C ASN A 17 6.173 12.200 5.505 1.00 0.00 C ATOM 249 O ASN A 17 5.940 10.980 5.439 1.00 0.00 O ATOM 250 CB ASN A 17 7.932 13.507 4.234 1.00 0.00 C ATOM 251 CG ASN A 17 7.357 14.878 4.207 1.00 0.00 C ATOM 252 OD1 ASN A 17 6.236 15.091 3.761 1.00 0.00 O ATOM 253 ND2 ASN A 17 8.118 15.817 4.654 1.00 0.00 N ATOM 0 H ASN A 17 8.109 10.789 4.810 1.00 0.00 H new ATOM 0 HA ASN A 17 7.779 13.289 6.378 1.00 0.00 H new ATOM 0 HB2 ASN A 17 9.014 13.584 4.132 1.00 0.00 H new ATOM 0 HB3 ASN A 17 7.568 12.963 3.363 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.794 16.784 4.645 1.00 0.00 H new ATOM 0 HD22 ASN A 17 9.045 15.593 5.016 1.00 0.00 H new ATOM 260 N GLY A 18 5.222 13.113 5.578 1.00 0.00 N ATOM 261 CA GLY A 18 3.837 12.740 5.689 1.00 0.00 C ATOM 262 C GLY A 18 3.098 12.751 4.370 1.00 0.00 C ATOM 263 O GLY A 18 3.652 13.127 3.326 1.00 0.00 O ATOM 0 H GLY A 18 5.391 14.119 5.562 1.00 0.00 H new ATOM 0 HA2 GLY A 18 3.772 11.743 6.124 1.00 0.00 H new ATOM 0 HA3 GLY A 18 3.340 13.422 6.380 1.00 0.00 H new ATOM 267 N PHE A 19 1.849 12.360 4.429 1.00 0.00 N ATOM 268 CA PHE A 19 0.988 12.241 3.269 1.00 0.00 C ATOM 269 C PHE A 19 0.088 13.440 3.174 1.00 0.00 C ATOM 270 O PHE A 19 -0.026 14.209 4.133 1.00 0.00 O ATOM 271 CB PHE A 19 0.110 10.976 3.395 1.00 0.00 C ATOM 272 CG PHE A 19 0.867 9.689 3.343 1.00 0.00 C ATOM 273 CD1 PHE A 19 1.574 9.254 4.442 1.00 0.00 C ATOM 274 CD2 PHE A 19 0.886 8.919 2.196 1.00 0.00 C ATOM 275 CE1 PHE A 19 2.281 8.088 4.410 1.00 0.00 C ATOM 276 CE2 PHE A 19 1.601 7.742 2.157 1.00 0.00 C ATOM 277 CZ PHE A 19 2.295 7.329 3.274 1.00 0.00 C ATOM 0 H PHE A 19 1.388 12.109 5.304 1.00 0.00 H new ATOM 0 HA PHE A 19 1.612 12.174 2.378 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -0.439 11.022 4.336 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -0.629 10.981 2.594 1.00 0.00 H new ATOM 0 HD1 PHE A 19 1.568 9.847 5.345 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.337 9.242 1.324 1.00 0.00 H new ATOM 0 HE1 PHE A 19 2.830 7.765 5.282 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.618 7.146 1.256 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.851 6.403 3.251 1.00 0.00 H new ATOM 287 N ASP A 20 -0.532 13.617 2.033 1.00 0.00 N ATOM 288 CA ASP A 20 -1.515 14.661 1.888 1.00 0.00 C ATOM 289 C ASP A 20 -2.823 14.044 2.239 1.00 0.00 C ATOM 290 O ASP A 20 -3.286 13.117 1.555 1.00 0.00 O ATOM 291 CB ASP A 20 -1.596 15.237 0.464 1.00 0.00 C ATOM 292 CG ASP A 20 -0.288 15.788 -0.050 1.00 0.00 C ATOM 293 OD1 ASP A 20 0.161 16.870 0.424 1.00 0.00 O ATOM 294 OD2 ASP A 20 0.315 15.156 -0.966 1.00 0.00 O ATOM 0 H ASP A 20 -0.375 13.055 1.196 1.00 0.00 H new ATOM 0 HA ASP A 20 -1.242 15.497 2.532 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.941 14.456 -0.214 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -2.345 16.029 0.445 1.00 0.00 H new ATOM 299 N PHE A 21 -3.426 14.515 3.300 1.00 0.00 N ATOM 300 CA PHE A 21 -4.632 13.910 3.815 1.00 0.00 C ATOM 301 C PHE A 21 -5.773 13.999 2.817 1.00 0.00 C ATOM 302 O PHE A 21 -6.654 13.159 2.824 1.00 0.00 O ATOM 303 CB PHE A 21 -5.020 14.474 5.195 1.00 0.00 C ATOM 304 CG PHE A 21 -6.122 13.688 5.854 1.00 0.00 C ATOM 305 CD1 PHE A 21 -5.912 12.364 6.221 1.00 0.00 C ATOM 306 CD2 PHE A 21 -7.361 14.257 6.090 1.00 0.00 C ATOM 307 CE1 PHE A 21 -6.919 11.627 6.812 1.00 0.00 C ATOM 308 CE2 PHE A 21 -8.371 13.525 6.683 1.00 0.00 C ATOM 309 CZ PHE A 21 -8.152 12.208 7.044 1.00 0.00 C ATOM 0 H PHE A 21 -3.100 15.323 3.830 1.00 0.00 H new ATOM 0 HA PHE A 21 -4.421 12.851 3.963 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -4.143 14.475 5.842 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -5.336 15.511 5.084 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -4.950 11.906 6.042 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -7.540 15.284 5.808 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -6.744 10.599 7.092 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -9.333 13.981 6.865 1.00 0.00 H new ATOM 0 HZ PHE A 21 -8.942 11.635 7.506 1.00 0.00 H new ATOM 319 N ALA A 22 -5.715 14.985 1.935 1.00 0.00 N ATOM 320 CA ALA A 22 -6.687 15.165 0.864 1.00 0.00 C ATOM 321 C ALA A 22 -6.969 13.871 0.081 1.00 0.00 C ATOM 322 O ALA A 22 -8.110 13.602 -0.242 1.00 0.00 O ATOM 323 CB ALA A 22 -6.256 16.268 -0.086 1.00 0.00 C ATOM 0 H ALA A 22 -4.981 15.694 1.942 1.00 0.00 H new ATOM 0 HA ALA A 22 -7.619 15.454 1.350 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -7.000 16.380 -0.875 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -6.165 17.205 0.462 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.294 16.011 -0.529 1.00 0.00 H new ATOM 329 N VAL A 23 -5.946 13.040 -0.173 1.00 0.00 N ATOM 330 CA VAL A 23 -6.176 11.822 -0.953 1.00 0.00 C ATOM 331 C VAL A 23 -6.856 10.718 -0.102 1.00 0.00 C ATOM 332 O VAL A 23 -7.707 9.969 -0.589 1.00 0.00 O ATOM 333 CB VAL A 23 -4.879 11.289 -1.668 1.00 0.00 C ATOM 334 CG1 VAL A 23 -3.818 10.811 -0.690 1.00 0.00 C ATOM 335 CG2 VAL A 23 -5.222 10.203 -2.680 1.00 0.00 C ATOM 0 H VAL A 23 -4.986 13.183 0.139 1.00 0.00 H new ATOM 0 HA VAL A 23 -6.866 12.100 -1.750 1.00 0.00 H new ATOM 0 HB VAL A 23 -4.447 12.136 -2.201 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -2.948 10.455 -1.242 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -3.524 11.636 -0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 23 -4.221 9.999 -0.085 1.00 0.00 H new ATOM 0 HG21 VAL A 23 -4.309 9.852 -3.160 1.00 0.00 H new ATOM 0 HG22 VAL A 23 -5.707 9.371 -2.170 1.00 0.00 H new ATOM 0 HG23 VAL A 23 -5.896 10.609 -3.435 1.00 0.00 H new ATOM 345 N ILE A 24 -6.509 10.671 1.178 1.00 0.00 N ATOM 346 CA ILE A 24 -7.104 9.706 2.118 1.00 0.00 C ATOM 347 C ILE A 24 -8.551 10.113 2.377 1.00 0.00 C ATOM 348 O ILE A 24 -9.465 9.286 2.501 1.00 0.00 O ATOM 349 CB ILE A 24 -6.314 9.712 3.458 1.00 0.00 C ATOM 350 CG1 ILE A 24 -4.829 9.440 3.195 1.00 0.00 C ATOM 351 CG2 ILE A 24 -6.880 8.678 4.428 1.00 0.00 C ATOM 352 CD1 ILE A 24 -3.951 9.509 4.421 1.00 0.00 C ATOM 0 H ILE A 24 -5.816 11.290 1.599 1.00 0.00 H new ATOM 0 HA ILE A 24 -7.064 8.703 1.692 1.00 0.00 H new ATOM 0 HB ILE A 24 -6.418 10.697 3.914 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -4.728 8.451 2.747 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -4.465 10.161 2.463 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -6.311 8.701 5.357 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -7.925 8.908 4.636 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -6.809 7.685 3.984 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -2.918 9.304 4.141 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -4.017 10.504 4.860 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -4.284 8.769 5.149 1.00 0.00 H new ATOM 364 N LYS A 25 -8.727 11.396 2.401 1.00 0.00 N ATOM 365 CA LYS A 25 -9.985 12.033 2.626 1.00 0.00 C ATOM 366 C LYS A 25 -10.881 11.823 1.388 1.00 0.00 C ATOM 367 O LYS A 25 -12.078 11.592 1.503 1.00 0.00 O ATOM 368 CB LYS A 25 -9.704 13.521 2.875 1.00 0.00 C ATOM 369 CG LYS A 25 -10.883 14.362 3.299 1.00 0.00 C ATOM 370 CD LYS A 25 -10.479 15.830 3.414 1.00 0.00 C ATOM 371 CE LYS A 25 -10.319 16.487 2.050 1.00 0.00 C ATOM 372 NZ LYS A 25 -11.599 16.499 1.303 1.00 0.00 N ATOM 0 H LYS A 25 -7.964 12.057 2.258 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.507 11.615 3.487 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.934 13.600 3.642 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -9.290 13.948 1.962 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.691 14.257 2.575 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -11.264 14.008 4.257 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -11.232 16.369 3.990 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.542 15.906 3.965 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.960 17.508 2.176 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -9.564 15.953 1.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.559 17.223 0.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.758 15.566 0.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.380 16.716 1.955 1.00 0.00 H new ATOM 386 N GLU A 26 -10.264 11.871 0.221 1.00 0.00 N ATOM 387 CA GLU A 26 -10.938 11.657 -1.047 1.00 0.00 C ATOM 388 C GLU A 26 -11.415 10.208 -1.187 1.00 0.00 C ATOM 389 O GLU A 26 -12.554 9.956 -1.632 1.00 0.00 O ATOM 390 CB GLU A 26 -10.001 12.032 -2.203 1.00 0.00 C ATOM 391 CG GLU A 26 -10.580 11.838 -3.584 1.00 0.00 C ATOM 392 CD GLU A 26 -9.645 12.333 -4.661 1.00 0.00 C ATOM 393 OE1 GLU A 26 -8.799 11.558 -5.154 1.00 0.00 O ATOM 394 OE2 GLU A 26 -9.740 13.520 -5.039 1.00 0.00 O ATOM 0 H GLU A 26 -9.267 12.062 0.126 1.00 0.00 H new ATOM 0 HA GLU A 26 -11.820 12.297 -1.080 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -9.711 13.077 -2.091 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -9.091 11.438 -2.120 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -10.791 10.781 -3.744 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -11.530 12.367 -3.657 1.00 0.00 H new ATOM 401 N LEU A 27 -10.581 9.260 -0.779 1.00 0.00 N ATOM 402 CA LEU A 27 -10.954 7.860 -0.889 1.00 0.00 C ATOM 403 C LEU A 27 -12.038 7.526 0.145 1.00 0.00 C ATOM 404 O LEU A 27 -12.903 6.710 -0.111 1.00 0.00 O ATOM 405 CB LEU A 27 -9.737 6.921 -0.789 1.00 0.00 C ATOM 406 CG LEU A 27 -9.995 5.438 -1.104 1.00 0.00 C ATOM 407 CD1 LEU A 27 -10.636 5.300 -2.455 1.00 0.00 C ATOM 408 CD2 LEU A 27 -8.703 4.645 -1.073 1.00 0.00 C ATOM 0 H LEU A 27 -9.660 9.432 -0.377 1.00 0.00 H new ATOM 0 HA LEU A 27 -11.370 7.694 -1.883 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -8.966 7.286 -1.468 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -9.332 6.991 0.221 1.00 0.00 H new ATOM 0 HG LEU A 27 -10.666 5.043 -0.341 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.814 4.246 -2.667 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -11.584 5.837 -2.464 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.976 5.717 -3.215 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.912 3.599 -1.299 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.012 5.045 -1.815 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.254 4.719 -0.083 1.00 0.00 H new ATOM 420 N LYS A 28 -11.998 8.212 1.289 1.00 0.00 N ATOM 421 CA LYS A 28 -13.053 8.103 2.307 1.00 0.00 C ATOM 422 C LYS A 28 -14.393 8.559 1.709 1.00 0.00 C ATOM 423 O LYS A 28 -15.441 7.933 1.915 1.00 0.00 O ATOM 424 CB LYS A 28 -12.725 8.965 3.542 1.00 0.00 C ATOM 425 CG LYS A 28 -13.846 8.984 4.597 1.00 0.00 C ATOM 426 CD LYS A 28 -13.586 9.993 5.717 1.00 0.00 C ATOM 427 CE LYS A 28 -12.443 9.579 6.640 1.00 0.00 C ATOM 428 NZ LYS A 28 -12.747 8.341 7.397 1.00 0.00 N ATOM 0 H LYS A 28 -11.244 8.853 1.537 1.00 0.00 H new ATOM 0 HA LYS A 28 -13.118 7.061 2.621 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -11.811 8.591 4.003 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -12.525 9.986 3.219 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -14.792 9.222 4.111 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -13.951 7.988 5.028 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -13.357 10.964 5.278 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -14.495 10.116 6.306 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -11.539 9.428 6.049 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -12.234 10.388 7.340 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -12.226 8.348 8.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -13.768 8.293 7.588 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -12.460 7.513 6.837 1.00 0.00 H new ATOM 442 N THR A 29 -14.331 9.637 0.944 1.00 0.00 N ATOM 443 CA THR A 29 -15.494 10.172 0.289 1.00 0.00 C ATOM 444 C THR A 29 -16.046 9.160 -0.724 1.00 0.00 C ATOM 445 O THR A 29 -17.245 8.855 -0.704 1.00 0.00 O ATOM 446 CB THR A 29 -15.181 11.526 -0.377 1.00 0.00 C ATOM 447 OG1 THR A 29 -14.677 12.411 0.625 1.00 0.00 O ATOM 448 CG2 THR A 29 -16.428 12.139 -1.006 1.00 0.00 C ATOM 0 H THR A 29 -13.472 10.158 0.766 1.00 0.00 H new ATOM 0 HA THR A 29 -16.263 10.352 1.040 1.00 0.00 H new ATOM 0 HB THR A 29 -14.448 11.369 -1.168 1.00 0.00 H new ATOM 0 HG1 THR A 29 -13.776 12.129 0.888 1.00 0.00 H new ATOM 0 HG21 THR A 29 -16.172 13.093 -1.467 1.00 0.00 H new ATOM 0 HG22 THR A 29 -16.822 11.464 -1.765 1.00 0.00 H new ATOM 0 HG23 THR A 29 -17.183 12.299 -0.236 1.00 0.00 H new ATOM 456 N ALA A 30 -15.168 8.611 -1.585 1.00 0.00 N ATOM 457 CA ALA A 30 -15.527 7.606 -2.526 1.00 0.00 C ATOM 458 C ALA A 30 -16.134 6.409 -1.814 1.00 0.00 C ATOM 459 O ALA A 30 -17.089 5.887 -2.246 1.00 0.00 O ATOM 460 CB ALA A 30 -14.307 7.189 -3.331 1.00 0.00 C ATOM 0 H ALA A 30 -14.184 8.876 -1.624 1.00 0.00 H new ATOM 0 HA ALA A 30 -16.273 8.011 -3.210 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -14.590 6.419 -4.049 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -13.910 8.053 -3.863 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -13.545 6.795 -2.659 1.00 0.00 H new ATOM 466 N ALA A 31 -15.578 6.039 -0.697 1.00 0.00 N ATOM 467 CA ALA A 31 -16.071 4.911 0.092 1.00 0.00 C ATOM 468 C ALA A 31 -17.488 5.131 0.605 1.00 0.00 C ATOM 469 O ALA A 31 -18.299 4.204 0.615 1.00 0.00 O ATOM 470 CB ALA A 31 -15.157 4.681 1.247 1.00 0.00 C ATOM 0 H ALA A 31 -14.765 6.504 -0.293 1.00 0.00 H new ATOM 0 HA ALA A 31 -16.094 4.040 -0.562 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -15.521 3.841 1.838 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -14.155 4.459 0.880 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -15.125 5.575 1.869 1.00 0.00 H new ATOM 476 N SER A 32 -17.781 6.335 1.022 1.00 0.00 N ATOM 477 CA SER A 32 -19.076 6.643 1.585 1.00 0.00 C ATOM 478 C SER A 32 -20.146 6.774 0.479 1.00 0.00 C ATOM 479 O SER A 32 -21.286 6.353 0.652 1.00 0.00 O ATOM 480 CB SER A 32 -18.980 7.938 2.429 1.00 0.00 C ATOM 481 OG SER A 32 -20.185 8.221 3.141 1.00 0.00 O ATOM 0 H SER A 32 -17.138 7.125 0.983 1.00 0.00 H new ATOM 0 HA SER A 32 -19.383 5.823 2.234 1.00 0.00 H new ATOM 0 HB2 SER A 32 -18.157 7.845 3.138 1.00 0.00 H new ATOM 0 HB3 SER A 32 -18.744 8.777 1.774 1.00 0.00 H new ATOM 0 HG SER A 32 -20.073 9.046 3.659 1.00 0.00 H new ATOM 487 N GLN A 33 -19.766 7.335 -0.646 1.00 0.00 N ATOM 488 CA GLN A 33 -20.691 7.606 -1.754 1.00 0.00 C ATOM 489 C GLN A 33 -20.760 6.432 -2.758 1.00 0.00 C ATOM 490 O GLN A 33 -21.831 5.896 -3.071 1.00 0.00 O ATOM 491 CB GLN A 33 -20.166 8.837 -2.513 1.00 0.00 C ATOM 492 CG GLN A 33 -20.072 10.095 -1.705 1.00 0.00 C ATOM 493 CD GLN A 33 -21.384 10.747 -1.589 1.00 0.00 C ATOM 494 OE1 GLN A 33 -22.142 10.498 -0.662 1.00 0.00 O ATOM 495 NE2 GLN A 33 -21.683 11.547 -2.550 1.00 0.00 N ATOM 0 H GLN A 33 -18.805 7.622 -0.832 1.00 0.00 H new ATOM 0 HA GLN A 33 -21.686 7.760 -1.337 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -19.178 8.605 -2.909 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -20.817 9.021 -3.368 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -19.687 9.865 -0.711 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -19.362 10.779 -2.171 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -21.012 11.718 -3.298 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -22.592 12.010 -2.564 1.00 0.00 H new ATOM 504 N TYR A 34 -19.607 6.049 -3.201 1.00 0.00 N ATOM 505 CA TYR A 34 -19.374 5.116 -4.292 1.00 0.00 C ATOM 506 C TYR A 34 -19.133 3.694 -3.780 1.00 0.00 C ATOM 507 O TYR A 34 -19.618 2.726 -4.354 1.00 0.00 O ATOM 508 CB TYR A 34 -18.158 5.656 -5.080 1.00 0.00 C ATOM 509 CG TYR A 34 -18.462 6.895 -5.914 1.00 0.00 C ATOM 510 CD1 TYR A 34 -18.926 6.787 -7.215 1.00 0.00 C ATOM 511 CD2 TYR A 34 -18.297 8.176 -5.388 1.00 0.00 C ATOM 512 CE1 TYR A 34 -19.212 7.905 -7.971 1.00 0.00 C ATOM 513 CE2 TYR A 34 -18.582 9.306 -6.132 1.00 0.00 C ATOM 514 CZ TYR A 34 -19.037 9.162 -7.431 1.00 0.00 C ATOM 515 OH TYR A 34 -19.335 10.279 -8.190 1.00 0.00 O ATOM 0 H TYR A 34 -18.737 6.393 -2.794 1.00 0.00 H new ATOM 0 HA TYR A 34 -20.251 5.047 -4.936 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -17.358 5.890 -4.378 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -17.786 4.870 -5.737 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -19.067 5.807 -7.646 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -17.938 8.288 -4.376 1.00 0.00 H new ATOM 0 HE1 TYR A 34 -19.572 7.796 -8.983 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -18.451 10.289 -5.705 1.00 0.00 H new ATOM 0 HH TYR A 34 -19.159 11.088 -7.665 1.00 0.00 H new ATOM 525 N GLY A 35 -18.440 3.589 -2.673 1.00 0.00 N ATOM 526 CA GLY A 35 -18.079 2.310 -2.150 1.00 0.00 C ATOM 527 C GLY A 35 -17.080 1.634 -3.053 1.00 0.00 C ATOM 528 O GLY A 35 -16.342 2.288 -3.753 1.00 0.00 O ATOM 0 H GLY A 35 -18.117 4.383 -2.120 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -17.657 2.425 -1.152 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -18.968 1.687 -2.050 1.00 0.00 H new ATOM 532 N ALA A 36 -17.060 0.343 -3.010 1.00 0.00 N ATOM 533 CA ALA A 36 -16.203 -0.479 -3.836 1.00 0.00 C ATOM 534 C ALA A 36 -16.777 -0.723 -5.198 1.00 0.00 C ATOM 535 O ALA A 36 -17.965 -0.569 -5.437 1.00 0.00 O ATOM 536 CB ALA A 36 -16.023 -1.776 -3.173 1.00 0.00 C ATOM 0 H ALA A 36 -17.655 -0.198 -2.382 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.259 0.051 -3.962 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -15.379 -2.410 -3.782 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -15.564 -1.625 -2.196 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -16.992 -2.258 -3.048 1.00 0.00 H new ATOM 542 N THR A 37 -15.880 -1.042 -6.103 1.00 0.00 N ATOM 543 CA THR A 37 -16.141 -1.459 -7.479 1.00 0.00 C ATOM 544 C THR A 37 -16.563 -0.337 -8.429 1.00 0.00 C ATOM 545 O THR A 37 -16.502 -0.503 -9.655 1.00 0.00 O ATOM 546 CB THR A 37 -17.000 -2.742 -7.622 1.00 0.00 C ATOM 547 OG1 THR A 37 -18.347 -2.552 -7.179 1.00 0.00 O ATOM 548 CG2 THR A 37 -16.370 -3.855 -6.811 1.00 0.00 C ATOM 0 H THR A 37 -14.882 -1.018 -5.893 1.00 0.00 H new ATOM 0 HA THR A 37 -15.150 -1.750 -7.826 1.00 0.00 H new ATOM 0 HB THR A 37 -17.032 -2.997 -8.681 1.00 0.00 H new ATOM 0 HG1 THR A 37 -18.441 -1.657 -6.792 1.00 0.00 H new ATOM 0 HG21 THR A 37 -16.970 -4.760 -6.908 1.00 0.00 H new ATOM 0 HG22 THR A 37 -15.362 -4.047 -7.178 1.00 0.00 H new ATOM 0 HG23 THR A 37 -16.324 -3.560 -5.763 1.00 0.00 H new ATOM 556 N ALA A 38 -16.983 0.789 -7.877 1.00 0.00 N ATOM 557 CA ALA A 38 -17.188 1.978 -8.656 1.00 0.00 C ATOM 558 C ALA A 38 -15.811 2.408 -9.183 1.00 0.00 C ATOM 559 O ALA A 38 -14.880 2.580 -8.392 1.00 0.00 O ATOM 560 CB ALA A 38 -17.800 3.061 -7.793 1.00 0.00 C ATOM 0 H ALA A 38 -17.187 0.895 -6.883 1.00 0.00 H new ATOM 0 HA ALA A 38 -17.872 1.798 -9.485 1.00 0.00 H new ATOM 0 HB1 ALA A 38 -17.953 3.960 -8.391 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -18.758 2.718 -7.403 1.00 0.00 H new ATOM 0 HB3 ALA A 38 -17.130 3.287 -6.963 1.00 0.00 H new ATOM 566 N PRO A 39 -15.660 2.579 -10.517 1.00 0.00 N ATOM 567 CA PRO A 39 -14.348 2.838 -11.190 1.00 0.00 C ATOM 568 C PRO A 39 -13.539 4.017 -10.624 1.00 0.00 C ATOM 569 O PRO A 39 -12.334 4.119 -10.855 1.00 0.00 O ATOM 570 CB PRO A 39 -14.738 3.107 -12.649 1.00 0.00 C ATOM 571 CG PRO A 39 -16.214 3.341 -12.632 1.00 0.00 C ATOM 572 CD PRO A 39 -16.750 2.529 -11.498 1.00 0.00 C ATOM 0 HA PRO A 39 -13.681 1.989 -11.043 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -14.208 3.974 -13.043 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -14.482 2.260 -13.286 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -16.439 4.399 -12.494 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -16.667 3.039 -13.576 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -17.672 2.951 -11.099 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -16.973 1.507 -11.803 1.00 0.00 H new ATOM 580 N TYR A 40 -14.196 4.869 -9.899 1.00 0.00 N ATOM 581 CA TYR A 40 -13.570 6.010 -9.282 1.00 0.00 C ATOM 582 C TYR A 40 -12.691 5.589 -8.085 1.00 0.00 C ATOM 583 O TYR A 40 -11.476 5.832 -8.086 1.00 0.00 O ATOM 584 CB TYR A 40 -14.655 7.023 -8.868 1.00 0.00 C ATOM 585 CG TYR A 40 -14.167 8.247 -8.127 1.00 0.00 C ATOM 586 CD1 TYR A 40 -13.374 9.198 -8.753 1.00 0.00 C ATOM 587 CD2 TYR A 40 -14.529 8.462 -6.807 1.00 0.00 C ATOM 588 CE1 TYR A 40 -12.954 10.322 -8.079 1.00 0.00 C ATOM 589 CE2 TYR A 40 -14.115 9.585 -6.128 1.00 0.00 C ATOM 590 CZ TYR A 40 -13.325 10.512 -6.769 1.00 0.00 C ATOM 591 OH TYR A 40 -12.903 11.634 -6.091 1.00 0.00 O ATOM 0 H TYR A 40 -15.196 4.795 -9.713 1.00 0.00 H new ATOM 0 HA TYR A 40 -12.904 6.487 -10.002 1.00 0.00 H new ATOM 0 HB2 TYR A 40 -15.180 7.351 -9.765 1.00 0.00 H new ATOM 0 HB3 TYR A 40 -15.384 6.509 -8.241 1.00 0.00 H new ATOM 0 HD1 TYR A 40 -13.082 9.054 -9.783 1.00 0.00 H new ATOM 0 HD2 TYR A 40 -15.147 7.735 -6.302 1.00 0.00 H new ATOM 0 HE1 TYR A 40 -12.335 11.053 -8.578 1.00 0.00 H new ATOM 0 HE2 TYR A 40 -14.408 9.738 -5.100 1.00 0.00 H new ATOM 0 HH TYR A 40 -13.254 11.615 -5.176 1.00 0.00 H new ATOM 601 N THR A 41 -13.300 4.926 -7.080 1.00 0.00 N ATOM 602 CA THR A 41 -12.645 4.570 -5.828 1.00 0.00 C ATOM 603 C THR A 41 -11.344 3.772 -6.036 1.00 0.00 C ATOM 604 O THR A 41 -10.297 4.143 -5.514 1.00 0.00 O ATOM 605 CB THR A 41 -13.634 3.812 -4.868 1.00 0.00 C ATOM 606 OG1 THR A 41 -13.061 3.620 -3.589 1.00 0.00 O ATOM 607 CG2 THR A 41 -14.013 2.461 -5.421 1.00 0.00 C ATOM 0 H THR A 41 -14.273 4.624 -7.127 1.00 0.00 H new ATOM 0 HA THR A 41 -12.355 5.507 -5.352 1.00 0.00 H new ATOM 0 HB THR A 41 -14.523 4.437 -4.785 1.00 0.00 H new ATOM 0 HG1 THR A 41 -13.698 3.148 -3.013 1.00 0.00 H new ATOM 0 HG21 THR A 41 -14.697 1.965 -4.732 1.00 0.00 H new ATOM 0 HG22 THR A 41 -14.500 2.587 -6.388 1.00 0.00 H new ATOM 0 HG23 THR A 41 -13.116 1.853 -5.543 1.00 0.00 H new ATOM 615 N LEU A 42 -11.377 2.737 -6.866 1.00 0.00 N ATOM 616 CA LEU A 42 -10.195 1.937 -7.032 1.00 0.00 C ATOM 617 C LEU A 42 -9.113 2.605 -7.820 1.00 0.00 C ATOM 618 O LEU A 42 -7.963 2.262 -7.665 1.00 0.00 O ATOM 619 CB LEU A 42 -10.401 0.432 -7.369 1.00 0.00 C ATOM 620 CG LEU A 42 -11.461 0.003 -8.417 1.00 0.00 C ATOM 621 CD1 LEU A 42 -12.839 0.001 -7.802 1.00 0.00 C ATOM 622 CD2 LEU A 42 -11.422 0.874 -9.669 1.00 0.00 C ATOM 0 H LEU A 42 -12.187 2.447 -7.414 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.818 1.878 -6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -9.440 0.042 -7.704 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -10.645 -0.077 -6.437 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.216 -1.011 -8.732 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -13.571 -0.302 -8.551 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -12.863 -0.698 -6.966 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -13.079 1.002 -7.444 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -12.182 0.534 -10.372 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.617 1.911 -9.397 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.439 0.800 -10.134 1.00 0.00 H new ATOM 634 N ALA A 43 -9.475 3.594 -8.636 1.00 0.00 N ATOM 635 CA ALA A 43 -8.476 4.375 -9.342 1.00 0.00 C ATOM 636 C ALA A 43 -7.645 5.134 -8.318 1.00 0.00 C ATOM 637 O ALA A 43 -6.408 5.213 -8.412 1.00 0.00 O ATOM 638 CB ALA A 43 -9.118 5.312 -10.344 1.00 0.00 C ATOM 0 H ALA A 43 -10.441 3.866 -8.819 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.827 3.711 -9.913 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -8.344 5.883 -10.856 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -9.684 4.732 -11.073 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -9.789 5.996 -9.824 1.00 0.00 H new ATOM 644 N ILE A 44 -8.329 5.610 -7.306 1.00 0.00 N ATOM 645 CA ILE A 44 -7.706 6.296 -6.190 1.00 0.00 C ATOM 646 C ILE A 44 -6.878 5.293 -5.355 1.00 0.00 C ATOM 647 O ILE A 44 -5.797 5.631 -4.867 1.00 0.00 O ATOM 648 CB ILE A 44 -8.784 6.926 -5.312 1.00 0.00 C ATOM 649 CG1 ILE A 44 -9.691 7.807 -6.155 1.00 0.00 C ATOM 650 CG2 ILE A 44 -8.158 7.740 -4.176 1.00 0.00 C ATOM 651 CD1 ILE A 44 -10.942 8.217 -5.437 1.00 0.00 C ATOM 0 H ILE A 44 -9.343 5.534 -7.229 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.046 7.076 -6.571 1.00 0.00 H new ATOM 0 HB ILE A 44 -9.377 6.127 -4.868 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -9.143 8.699 -6.457 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -9.960 7.274 -7.067 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -8.947 8.178 -3.565 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -7.541 7.088 -3.558 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -7.540 8.534 -4.595 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -11.548 8.844 -6.091 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -11.509 7.329 -5.158 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -10.679 8.776 -4.539 1.00 0.00 H new ATOM 663 N VAL A 45 -7.385 4.051 -5.217 1.00 0.00 N ATOM 664 CA VAL A 45 -6.660 2.980 -4.509 1.00 0.00 C ATOM 665 C VAL A 45 -5.300 2.744 -5.204 1.00 0.00 C ATOM 666 O VAL A 45 -4.267 2.542 -4.558 1.00 0.00 O ATOM 667 CB VAL A 45 -7.487 1.624 -4.432 1.00 0.00 C ATOM 668 CG1 VAL A 45 -6.687 0.497 -3.775 1.00 0.00 C ATOM 669 CG2 VAL A 45 -8.781 1.810 -3.644 1.00 0.00 C ATOM 0 H VAL A 45 -8.292 3.767 -5.586 1.00 0.00 H new ATOM 0 HA VAL A 45 -6.506 3.306 -3.480 1.00 0.00 H new ATOM 0 HB VAL A 45 -7.711 1.350 -5.463 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.292 -0.409 -3.745 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -5.782 0.309 -4.352 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -6.417 0.787 -2.760 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -9.324 0.866 -3.609 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.546 2.132 -2.629 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.398 2.566 -4.130 1.00 0.00 H new ATOM 679 N GLU A 46 -5.302 2.839 -6.520 1.00 0.00 N ATOM 680 CA GLU A 46 -4.089 2.658 -7.300 1.00 0.00 C ATOM 681 C GLU A 46 -3.158 3.854 -7.108 1.00 0.00 C ATOM 682 O GLU A 46 -1.935 3.702 -7.113 1.00 0.00 O ATOM 683 CB GLU A 46 -4.409 2.480 -8.780 1.00 0.00 C ATOM 684 CG GLU A 46 -5.468 1.431 -9.044 1.00 0.00 C ATOM 685 CD GLU A 46 -5.680 1.171 -10.499 1.00 0.00 C ATOM 686 OE1 GLU A 46 -5.885 2.139 -11.278 1.00 0.00 O ATOM 687 OE2 GLU A 46 -5.637 -0.003 -10.912 1.00 0.00 O ATOM 0 H GLU A 46 -6.134 3.041 -7.075 1.00 0.00 H new ATOM 0 HA GLU A 46 -3.592 1.754 -6.948 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -4.743 3.434 -9.189 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -3.497 2.207 -9.311 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -5.182 0.501 -8.552 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -6.409 1.752 -8.597 1.00 0.00 H new ATOM 694 N SER A 47 -3.739 5.036 -6.863 1.00 0.00 N ATOM 695 CA SER A 47 -2.969 6.249 -6.648 1.00 0.00 C ATOM 696 C SER A 47 -2.323 6.261 -5.247 1.00 0.00 C ATOM 697 O SER A 47 -1.198 6.706 -5.096 1.00 0.00 O ATOM 698 CB SER A 47 -3.847 7.487 -6.878 1.00 0.00 C ATOM 699 OG SER A 47 -4.457 7.426 -8.163 1.00 0.00 O ATOM 0 H SER A 47 -4.749 5.169 -6.810 1.00 0.00 H new ATOM 0 HA SER A 47 -2.156 6.274 -7.374 1.00 0.00 H new ATOM 0 HB2 SER A 47 -4.614 7.546 -6.106 1.00 0.00 H new ATOM 0 HB3 SER A 47 -3.243 8.390 -6.797 1.00 0.00 H new ATOM 0 HG SER A 47 -5.135 6.719 -8.170 1.00 0.00 H new ATOM 705 N VAL A 48 -3.018 5.737 -4.234 1.00 0.00 N ATOM 706 CA VAL A 48 -2.437 5.673 -2.892 1.00 0.00 C ATOM 707 C VAL A 48 -1.344 4.611 -2.834 1.00 0.00 C ATOM 708 O VAL A 48 -0.418 4.697 -2.043 1.00 0.00 O ATOM 709 CB VAL A 48 -3.494 5.466 -1.764 1.00 0.00 C ATOM 710 CG1 VAL A 48 -4.505 6.597 -1.758 1.00 0.00 C ATOM 711 CG2 VAL A 48 -4.185 4.120 -1.865 1.00 0.00 C ATOM 0 H VAL A 48 -3.962 5.359 -4.314 1.00 0.00 H new ATOM 0 HA VAL A 48 -1.992 6.649 -2.699 1.00 0.00 H new ATOM 0 HB VAL A 48 -2.957 5.477 -0.815 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -5.232 6.431 -0.963 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -3.991 7.543 -1.588 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -5.019 6.631 -2.719 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -4.912 4.023 -1.058 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.696 4.044 -2.825 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -3.445 3.324 -1.784 1.00 0.00 H new ATOM 721 N ALA A 49 -1.434 3.639 -3.717 1.00 0.00 N ATOM 722 CA ALA A 49 -0.427 2.611 -3.826 1.00 0.00 C ATOM 723 C ALA A 49 0.737 3.092 -4.686 1.00 0.00 C ATOM 724 O ALA A 49 1.757 2.449 -4.781 1.00 0.00 O ATOM 725 CB ALA A 49 -1.044 1.343 -4.377 1.00 0.00 C ATOM 0 H ALA A 49 -2.206 3.541 -4.377 1.00 0.00 H new ATOM 0 HA ALA A 49 -0.029 2.390 -2.835 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -0.279 0.571 -4.457 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -1.834 1.003 -3.708 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -1.464 1.541 -5.363 1.00 0.00 H new ATOM 731 N ASP A 50 0.579 4.269 -5.261 1.00 0.00 N ATOM 732 CA ASP A 50 1.589 4.879 -6.139 1.00 0.00 C ATOM 733 C ASP A 50 2.484 5.804 -5.298 1.00 0.00 C ATOM 734 O ASP A 50 3.245 6.626 -5.790 1.00 0.00 O ATOM 735 CB ASP A 50 0.861 5.639 -7.273 1.00 0.00 C ATOM 736 CG ASP A 50 1.768 6.294 -8.302 1.00 0.00 C ATOM 737 OD1 ASP A 50 2.528 5.595 -8.985 1.00 0.00 O ATOM 738 OD2 ASP A 50 1.660 7.511 -8.501 1.00 0.00 O ATOM 0 H ASP A 50 -0.256 4.842 -5.138 1.00 0.00 H new ATOM 0 HA ASP A 50 2.229 4.124 -6.596 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.198 4.943 -7.787 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.231 6.408 -6.826 1.00 0.00 H new ATOM 743 N ASN A 51 2.368 5.629 -4.015 1.00 0.00 N ATOM 744 CA ASN A 51 3.124 6.372 -3.027 1.00 0.00 C ATOM 745 C ASN A 51 4.182 5.476 -2.439 1.00 0.00 C ATOM 746 O ASN A 51 4.020 4.267 -2.420 1.00 0.00 O ATOM 747 CB ASN A 51 2.218 6.833 -1.852 1.00 0.00 C ATOM 748 CG ASN A 51 1.267 8.010 -2.132 1.00 0.00 C ATOM 749 OD1 ASN A 51 0.980 8.815 -1.233 1.00 0.00 O ATOM 750 ND2 ASN A 51 0.763 8.116 -3.317 1.00 0.00 N ATOM 0 H ASN A 51 1.729 4.948 -3.606 1.00 0.00 H new ATOM 0 HA ASN A 51 3.555 7.241 -3.525 1.00 0.00 H new ATOM 0 HB2 ASN A 51 1.619 5.981 -1.530 1.00 0.00 H new ATOM 0 HB3 ASN A 51 2.860 7.106 -1.015 1.00 0.00 H new ATOM 0 HD21 ASN A 51 0.114 8.874 -3.529 1.00 0.00 H new ATOM 0 HD22 ASN A 51 1.014 7.442 -4.040 1.00 0.00 H new ATOM 757 N TRP A 52 5.270 6.064 -1.991 1.00 0.00 N ATOM 758 CA TRP A 52 6.267 5.347 -1.212 1.00 0.00 C ATOM 759 C TRP A 52 5.767 5.352 0.220 1.00 0.00 C ATOM 760 O TRP A 52 5.795 6.398 0.887 1.00 0.00 O ATOM 761 CB TRP A 52 7.655 6.036 -1.273 1.00 0.00 C ATOM 762 CG TRP A 52 8.352 5.996 -2.606 1.00 0.00 C ATOM 763 CD1 TRP A 52 7.802 5.788 -3.837 1.00 0.00 C ATOM 764 CD2 TRP A 52 9.752 6.193 -2.824 1.00 0.00 C ATOM 765 NE1 TRP A 52 8.775 5.832 -4.803 1.00 0.00 N ATOM 766 CE2 TRP A 52 9.983 6.083 -4.206 1.00 0.00 C ATOM 767 CE3 TRP A 52 10.833 6.452 -1.979 1.00 0.00 C ATOM 768 CZ2 TRP A 52 11.251 6.218 -4.758 1.00 0.00 C ATOM 769 CZ3 TRP A 52 12.087 6.585 -2.530 1.00 0.00 C ATOM 770 CH2 TRP A 52 12.286 6.472 -3.908 1.00 0.00 C ATOM 0 H TRP A 52 5.492 7.046 -2.153 1.00 0.00 H new ATOM 0 HA TRP A 52 6.396 4.339 -1.607 1.00 0.00 H new ATOM 0 HB2 TRP A 52 7.534 7.079 -0.979 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.304 5.569 -0.532 1.00 0.00 H new ATOM 0 HD1 TRP A 52 6.753 5.614 -4.024 1.00 0.00 H new ATOM 0 HE1 TRP A 52 8.624 5.699 -5.803 1.00 0.00 H new ATOM 0 HE3 TRP A 52 10.688 6.546 -0.913 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 11.411 6.125 -5.822 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 12.932 6.780 -1.886 1.00 0.00 H new ATOM 0 HH2 TRP A 52 13.282 6.588 -4.309 1.00 0.00 H new ATOM 781 N LEU A 53 5.239 4.246 0.675 1.00 0.00 N ATOM 782 CA LEU A 53 4.633 4.194 1.982 1.00 0.00 C ATOM 783 C LEU A 53 5.025 2.938 2.739 1.00 0.00 C ATOM 784 O LEU A 53 5.531 1.983 2.157 1.00 0.00 O ATOM 785 CB LEU A 53 3.081 4.373 1.909 1.00 0.00 C ATOM 786 CG LEU A 53 2.171 3.272 1.301 1.00 0.00 C ATOM 787 CD1 LEU A 53 0.754 3.805 1.198 1.00 0.00 C ATOM 788 CD2 LEU A 53 2.634 2.769 -0.062 1.00 0.00 C ATOM 0 H LEU A 53 5.216 3.366 0.159 1.00 0.00 H new ATOM 0 HA LEU A 53 5.024 5.039 2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.733 4.547 2.927 1.00 0.00 H new ATOM 0 HB3 LEU A 53 2.892 5.288 1.347 1.00 0.00 H new ATOM 0 HG LEU A 53 2.223 2.414 1.971 1.00 0.00 H new ATOM 0 HD11 LEU A 53 0.107 3.038 0.772 1.00 0.00 H new ATOM 0 HD12 LEU A 53 0.393 4.073 2.191 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.743 4.687 0.557 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.947 2.002 -0.419 1.00 0.00 H new ATOM 0 HD22 LEU A 53 2.652 3.598 -0.769 1.00 0.00 H new ATOM 0 HD23 LEU A 53 3.635 2.346 0.027 1.00 0.00 H new ATOM 800 N THR A 54 4.798 2.961 4.025 1.00 0.00 N ATOM 801 CA THR A 54 5.134 1.874 4.892 1.00 0.00 C ATOM 802 C THR A 54 3.855 1.024 5.098 1.00 0.00 C ATOM 803 O THR A 54 2.748 1.548 4.982 1.00 0.00 O ATOM 804 CB THR A 54 5.553 2.467 6.254 1.00 0.00 C ATOM 805 OG1 THR A 54 6.413 3.596 6.049 1.00 0.00 O ATOM 806 CG2 THR A 54 6.266 1.464 7.136 1.00 0.00 C ATOM 0 H THR A 54 4.367 3.752 4.504 1.00 0.00 H new ATOM 0 HA THR A 54 5.938 1.267 4.475 1.00 0.00 H new ATOM 0 HB THR A 54 4.636 2.765 6.762 1.00 0.00 H new ATOM 0 HG1 THR A 54 5.877 4.416 6.031 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.537 1.937 8.080 1.00 0.00 H new ATOM 0 HG22 THR A 54 5.607 0.617 7.330 1.00 0.00 H new ATOM 0 HG23 THR A 54 7.168 1.114 6.634 1.00 0.00 H new ATOM 814 N PRO A 55 3.966 -0.298 5.350 1.00 0.00 N ATOM 815 CA PRO A 55 2.810 -1.146 5.681 1.00 0.00 C ATOM 816 C PRO A 55 1.932 -0.590 6.837 1.00 0.00 C ATOM 817 O PRO A 55 0.698 -0.796 6.852 1.00 0.00 O ATOM 818 CB PRO A 55 3.442 -2.460 6.094 1.00 0.00 C ATOM 819 CG PRO A 55 4.710 -2.519 5.328 1.00 0.00 C ATOM 820 CD PRO A 55 5.197 -1.101 5.198 1.00 0.00 C ATOM 0 HA PRO A 55 2.127 -1.218 4.834 1.00 0.00 H new ATOM 0 HB2 PRO A 55 3.625 -2.492 7.168 1.00 0.00 H new ATOM 0 HB3 PRO A 55 2.795 -3.304 5.856 1.00 0.00 H new ATOM 0 HG2 PRO A 55 5.446 -3.136 5.843 1.00 0.00 H new ATOM 0 HG3 PRO A 55 4.550 -2.966 4.347 1.00 0.00 H new ATOM 0 HD2 PRO A 55 5.932 -0.857 5.965 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.673 -0.927 4.233 1.00 0.00 H new ATOM 828 N THR A 56 2.552 0.086 7.809 1.00 0.00 N ATOM 829 CA THR A 56 1.792 0.731 8.881 1.00 0.00 C ATOM 830 C THR A 56 0.947 1.908 8.310 1.00 0.00 C ATOM 831 O THR A 56 -0.160 2.186 8.779 1.00 0.00 O ATOM 832 CB THR A 56 2.715 1.203 10.064 1.00 0.00 C ATOM 833 OG1 THR A 56 1.932 1.639 11.175 1.00 0.00 O ATOM 834 CG2 THR A 56 3.656 2.325 9.649 1.00 0.00 C ATOM 0 H THR A 56 3.564 0.199 7.875 1.00 0.00 H new ATOM 0 HA THR A 56 1.112 -0.011 9.300 1.00 0.00 H new ATOM 0 HB THR A 56 3.316 0.340 10.350 1.00 0.00 H new ATOM 0 HG1 THR A 56 2.525 1.927 11.900 1.00 0.00 H new ATOM 0 HG21 THR A 56 4.272 2.616 10.500 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.297 1.981 8.837 1.00 0.00 H new ATOM 0 HG23 THR A 56 3.073 3.183 9.312 1.00 0.00 H new ATOM 842 N ASP A 57 1.443 2.544 7.244 1.00 0.00 N ATOM 843 CA ASP A 57 0.702 3.603 6.563 1.00 0.00 C ATOM 844 C ASP A 57 -0.432 3.009 5.812 1.00 0.00 C ATOM 845 O ASP A 57 -1.510 3.566 5.785 1.00 0.00 O ATOM 846 CB ASP A 57 1.579 4.434 5.622 1.00 0.00 C ATOM 847 CG ASP A 57 2.642 5.211 6.359 1.00 0.00 C ATOM 848 OD1 ASP A 57 2.289 6.154 7.121 1.00 0.00 O ATOM 849 OD2 ASP A 57 3.846 4.882 6.221 1.00 0.00 O ATOM 0 H ASP A 57 2.356 2.341 6.836 1.00 0.00 H new ATOM 0 HA ASP A 57 0.332 4.285 7.329 1.00 0.00 H new ATOM 0 HB2 ASP A 57 2.054 3.774 4.896 1.00 0.00 H new ATOM 0 HB3 ASP A 57 0.951 5.126 5.061 1.00 0.00 H new ATOM 854 N TRP A 58 -0.184 1.847 5.209 1.00 0.00 N ATOM 855 CA TRP A 58 -1.221 1.069 4.558 1.00 0.00 C ATOM 856 C TRP A 58 -2.387 0.814 5.519 1.00 0.00 C ATOM 857 O TRP A 58 -3.538 1.116 5.204 1.00 0.00 O ATOM 858 CB TRP A 58 -0.682 -0.274 4.048 1.00 0.00 C ATOM 859 CG TRP A 58 -0.174 -0.306 2.635 1.00 0.00 C ATOM 860 CD1 TRP A 58 -0.478 0.553 1.609 1.00 0.00 C ATOM 861 CD2 TRP A 58 0.661 -1.322 2.071 1.00 0.00 C ATOM 862 NE1 TRP A 58 0.155 0.145 0.457 1.00 0.00 N ATOM 863 CE2 TRP A 58 0.854 -1.004 0.717 1.00 0.00 C ATOM 864 CE3 TRP A 58 1.278 -2.468 2.591 1.00 0.00 C ATOM 865 CZ2 TRP A 58 1.628 -1.790 -0.126 1.00 0.00 C ATOM 866 CZ3 TRP A 58 2.039 -3.247 1.746 1.00 0.00 C ATOM 867 CH2 TRP A 58 2.209 -2.904 0.402 1.00 0.00 C ATOM 0 H TRP A 58 0.743 1.424 5.162 1.00 0.00 H new ATOM 0 HA TRP A 58 -1.571 1.649 3.704 1.00 0.00 H new ATOM 0 HB2 TRP A 58 0.127 -0.588 4.707 1.00 0.00 H new ATOM 0 HB3 TRP A 58 -1.475 -1.016 4.141 1.00 0.00 H new ATOM 0 HD1 TRP A 58 -1.118 1.419 1.693 1.00 0.00 H new ATOM 0 HE1 TRP A 58 0.111 0.621 -0.444 1.00 0.00 H new ATOM 0 HE3 TRP A 58 1.160 -2.735 3.631 1.00 0.00 H new ATOM 0 HZ2 TRP A 58 1.765 -1.528 -1.165 1.00 0.00 H new ATOM 0 HZ3 TRP A 58 2.512 -4.139 2.130 1.00 0.00 H new ATOM 0 HH2 TRP A 58 2.814 -3.535 -0.232 1.00 0.00 H new ATOM 878 N ASN A 59 -2.099 0.275 6.696 1.00 0.00 N ATOM 879 CA ASN A 59 -3.153 -0.022 7.683 1.00 0.00 C ATOM 880 C ASN A 59 -3.916 1.235 8.070 1.00 0.00 C ATOM 881 O ASN A 59 -5.113 1.192 8.262 1.00 0.00 O ATOM 882 CB ASN A 59 -2.597 -0.731 8.917 1.00 0.00 C ATOM 883 CG ASN A 59 -2.109 -2.135 8.629 1.00 0.00 C ATOM 884 OD1 ASN A 59 -2.607 -2.821 7.715 1.00 0.00 O ATOM 885 ND2 ASN A 59 -1.151 -2.587 9.398 1.00 0.00 N ATOM 0 H ASN A 59 -1.155 0.033 6.998 1.00 0.00 H new ATOM 0 HA ASN A 59 -3.854 -0.707 7.206 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -1.774 -0.144 9.325 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.371 -0.772 9.684 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -0.787 -3.530 9.259 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.768 -1.996 10.136 1.00 0.00 H new ATOM 892 N THR A 60 -3.205 2.344 8.086 1.00 0.00 N ATOM 893 CA THR A 60 -3.811 3.639 8.381 1.00 0.00 C ATOM 894 C THR A 60 -4.714 4.100 7.204 1.00 0.00 C ATOM 895 O THR A 60 -5.798 4.667 7.409 1.00 0.00 O ATOM 896 CB THR A 60 -2.703 4.685 8.642 1.00 0.00 C ATOM 897 OG1 THR A 60 -1.843 4.200 9.678 1.00 0.00 O ATOM 898 CG2 THR A 60 -3.288 6.024 9.067 1.00 0.00 C ATOM 0 H THR A 60 -2.203 2.381 7.898 1.00 0.00 H new ATOM 0 HA THR A 60 -4.431 3.542 9.272 1.00 0.00 H new ATOM 0 HB THR A 60 -2.148 4.835 7.716 1.00 0.00 H new ATOM 0 HG1 THR A 60 -1.268 3.491 9.321 1.00 0.00 H new ATOM 0 HG21 THR A 60 -2.480 6.735 9.242 1.00 0.00 H new ATOM 0 HG22 THR A 60 -3.940 6.402 8.280 1.00 0.00 H new ATOM 0 HG23 THR A 60 -3.863 5.895 9.984 1.00 0.00 H new ATOM 906 N LEU A 61 -4.273 3.791 5.996 1.00 0.00 N ATOM 907 CA LEU A 61 -4.966 4.120 4.774 1.00 0.00 C ATOM 908 C LEU A 61 -6.314 3.400 4.764 1.00 0.00 C ATOM 909 O LEU A 61 -7.336 4.049 4.844 1.00 0.00 O ATOM 910 CB LEU A 61 -4.058 3.737 3.548 1.00 0.00 C ATOM 911 CG LEU A 61 -4.437 4.221 2.111 1.00 0.00 C ATOM 912 CD1 LEU A 61 -5.696 3.579 1.583 1.00 0.00 C ATOM 913 CD2 LEU A 61 -4.540 5.734 2.040 1.00 0.00 C ATOM 0 H LEU A 61 -3.398 3.290 5.840 1.00 0.00 H new ATOM 0 HA LEU A 61 -5.165 5.189 4.705 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -3.055 4.107 3.760 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -3.997 2.649 3.518 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.621 3.898 1.465 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -5.905 3.957 0.582 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -5.564 2.498 1.543 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -6.530 3.818 2.242 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -4.805 6.033 1.026 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -5.307 6.079 2.733 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -3.581 6.177 2.310 1.00 0.00 H new ATOM 925 N VAL A 62 -6.297 2.056 4.807 1.00 0.00 N ATOM 926 CA VAL A 62 -7.541 1.245 4.707 1.00 0.00 C ATOM 927 C VAL A 62 -8.505 1.604 5.836 1.00 0.00 C ATOM 928 O VAL A 62 -9.716 1.683 5.654 1.00 0.00 O ATOM 929 CB VAL A 62 -7.251 -0.314 4.673 1.00 0.00 C ATOM 930 CG1 VAL A 62 -6.409 -0.777 5.854 1.00 0.00 C ATOM 931 CG2 VAL A 62 -8.544 -1.133 4.588 1.00 0.00 C ATOM 0 H VAL A 62 -5.446 1.504 4.909 1.00 0.00 H new ATOM 0 HA VAL A 62 -8.011 1.491 3.755 1.00 0.00 H new ATOM 0 HB VAL A 62 -6.672 -0.491 3.766 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -6.240 -1.851 5.782 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.451 -0.258 5.843 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -6.932 -0.554 6.784 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -8.301 -2.195 4.567 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -9.167 -0.920 5.457 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -9.085 -0.866 3.680 1.00 0.00 H new ATOM 941 N ARG A 63 -7.902 1.877 6.962 1.00 0.00 N ATOM 942 CA ARG A 63 -8.568 2.311 8.193 1.00 0.00 C ATOM 943 C ARG A 63 -9.438 3.553 7.989 1.00 0.00 C ATOM 944 O ARG A 63 -10.582 3.612 8.435 1.00 0.00 O ATOM 945 CB ARG A 63 -7.489 2.626 9.205 1.00 0.00 C ATOM 946 CG ARG A 63 -7.950 3.197 10.500 1.00 0.00 C ATOM 947 CD ARG A 63 -6.768 3.545 11.355 1.00 0.00 C ATOM 948 NE ARG A 63 -7.212 4.193 12.594 1.00 0.00 N ATOM 949 CZ ARG A 63 -6.446 4.569 13.621 1.00 0.00 C ATOM 950 NH1 ARG A 63 -5.129 4.440 13.567 1.00 0.00 N ATOM 951 NH2 ARG A 63 -7.023 5.075 14.708 1.00 0.00 N ATOM 0 H ARG A 63 -6.890 1.805 7.066 1.00 0.00 H new ATOM 0 HA ARG A 63 -9.229 1.512 8.529 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -6.935 1.710 9.412 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -6.788 3.327 8.752 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -8.554 4.086 10.321 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -8.586 2.479 11.018 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -6.202 2.644 11.590 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -6.098 4.209 10.809 1.00 0.00 H new ATOM 0 HE ARG A 63 -8.212 4.376 12.680 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -4.689 4.050 12.734 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -4.555 4.731 14.358 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -8.038 5.171 14.749 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -6.451 5.367 15.500 1.00 0.00 H new ATOM 965 N ALA A 64 -8.906 4.527 7.326 1.00 0.00 N ATOM 966 CA ALA A 64 -9.586 5.782 7.191 1.00 0.00 C ATOM 967 C ALA A 64 -10.425 5.815 5.927 1.00 0.00 C ATOM 968 O ALA A 64 -11.550 6.341 5.916 1.00 0.00 O ATOM 969 CB ALA A 64 -8.559 6.902 7.173 1.00 0.00 C ATOM 0 H ALA A 64 -7.997 4.481 6.865 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.260 5.914 8.038 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -9.068 7.861 7.071 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -7.991 6.890 8.103 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -7.880 6.760 6.332 1.00 0.00 H new ATOM 975 N VAL A 65 -9.890 5.258 4.910 1.00 0.00 N ATOM 976 CA VAL A 65 -10.515 5.340 3.614 1.00 0.00 C ATOM 977 C VAL A 65 -11.870 4.614 3.495 1.00 0.00 C ATOM 978 O VAL A 65 -12.854 5.248 3.199 1.00 0.00 O ATOM 979 CB VAL A 65 -9.584 5.005 2.436 1.00 0.00 C ATOM 980 CG1 VAL A 65 -8.390 5.937 2.428 1.00 0.00 C ATOM 981 CG2 VAL A 65 -9.129 3.561 2.456 1.00 0.00 C ATOM 0 H VAL A 65 -9.016 4.733 4.932 1.00 0.00 H new ATOM 0 HA VAL A 65 -10.743 6.403 3.534 1.00 0.00 H new ATOM 0 HB VAL A 65 -10.157 5.148 1.520 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -7.740 5.688 1.589 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -8.733 6.967 2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.837 5.827 3.361 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.474 3.374 1.605 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -8.587 3.363 3.381 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.997 2.905 2.397 1.00 0.00 H new ATOM 991 N LEU A 66 -11.950 3.337 3.798 1.00 0.00 N ATOM 992 CA LEU A 66 -13.186 2.628 3.544 1.00 0.00 C ATOM 993 C LEU A 66 -13.620 1.900 4.819 1.00 0.00 C ATOM 994 O LEU A 66 -12.817 1.712 5.726 1.00 0.00 O ATOM 995 CB LEU A 66 -13.011 1.711 2.283 1.00 0.00 C ATOM 996 CG LEU A 66 -14.295 1.291 1.482 1.00 0.00 C ATOM 997 CD1 LEU A 66 -13.926 1.009 0.053 1.00 0.00 C ATOM 998 CD2 LEU A 66 -14.936 0.049 2.057 1.00 0.00 C ATOM 0 H LEU A 66 -11.199 2.781 4.208 1.00 0.00 H new ATOM 0 HA LEU A 66 -14.001 3.309 3.300 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -12.340 2.221 1.592 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -12.506 0.799 2.603 1.00 0.00 H new ATOM 0 HG LEU A 66 -15.005 2.115 1.549 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -14.818 0.718 -0.502 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -13.496 1.905 -0.395 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -13.196 0.200 0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -15.821 -0.207 1.474 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -14.226 -0.777 2.021 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -15.225 0.234 3.092 1.00 0.00 H new ATOM 1010 N SER A 67 -14.857 1.547 4.884 1.00 0.00 N ATOM 1011 CA SER A 67 -15.391 0.909 6.063 1.00 0.00 C ATOM 1012 C SER A 67 -16.539 -0.040 5.747 1.00 0.00 C ATOM 1013 O SER A 67 -17.405 0.249 4.891 1.00 0.00 O ATOM 1014 CB SER A 67 -15.782 1.946 7.125 1.00 0.00 C ATOM 1015 OG SER A 67 -16.481 3.048 6.542 1.00 0.00 O ATOM 0 H SER A 67 -15.533 1.686 4.133 1.00 0.00 H new ATOM 0 HA SER A 67 -14.594 0.292 6.478 1.00 0.00 H new ATOM 0 HB2 SER A 67 -16.408 1.475 7.883 1.00 0.00 H new ATOM 0 HB3 SER A 67 -14.887 2.307 7.631 1.00 0.00 H new ATOM 0 HG SER A 67 -16.719 3.692 7.242 1.00 0.00 H new ATOM 1021 N GLY A 68 -16.514 -1.177 6.396 1.00 0.00 N ATOM 1022 CA GLY A 68 -17.546 -2.146 6.271 1.00 0.00 C ATOM 1023 C GLY A 68 -17.042 -3.377 5.587 1.00 0.00 C ATOM 1024 O GLY A 68 -16.690 -4.372 6.231 1.00 0.00 O ATOM 0 H GLY A 68 -15.763 -1.448 7.031 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -17.929 -2.405 7.258 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -18.378 -1.726 5.706 1.00 0.00 H new ATOM 1028 N GLY A 69 -16.985 -3.305 4.293 1.00 0.00 N ATOM 1029 CA GLY A 69 -16.541 -4.402 3.483 1.00 0.00 C ATOM 1030 C GLY A 69 -15.048 -4.421 3.329 1.00 0.00 C ATOM 1031 O GLY A 69 -14.473 -5.456 3.012 1.00 0.00 O ATOM 0 H GLY A 69 -17.248 -2.475 3.762 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -16.871 -5.340 3.930 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -17.006 -4.337 2.499 1.00 0.00 H new ATOM 1035 N ASP A 70 -14.433 -3.269 3.577 1.00 0.00 N ATOM 1036 CA ASP A 70 -13.006 -2.988 3.304 1.00 0.00 C ATOM 1037 C ASP A 70 -12.121 -4.147 3.722 1.00 0.00 C ATOM 1038 O ASP A 70 -11.459 -4.776 2.881 1.00 0.00 O ATOM 1039 CB ASP A 70 -12.560 -1.685 4.045 1.00 0.00 C ATOM 1040 CG ASP A 70 -12.659 -1.774 5.574 1.00 0.00 C ATOM 1041 OD1 ASP A 70 -13.775 -1.719 6.121 1.00 0.00 O ATOM 1042 OD2 ASP A 70 -11.634 -1.984 6.227 1.00 0.00 O ATOM 0 H ASP A 70 -14.920 -2.472 3.987 1.00 0.00 H new ATOM 0 HA ASP A 70 -12.896 -2.849 2.229 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -11.530 -1.457 3.770 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -13.174 -0.854 3.699 1.00 0.00 H new ATOM 1047 N HIS A 71 -12.250 -4.502 4.963 1.00 0.00 N ATOM 1048 CA HIS A 71 -11.468 -5.496 5.602 1.00 0.00 C ATOM 1049 C HIS A 71 -11.636 -6.842 4.954 1.00 0.00 C ATOM 1050 O HIS A 71 -10.655 -7.470 4.581 1.00 0.00 O ATOM 1051 CB HIS A 71 -11.844 -5.545 7.077 1.00 0.00 C ATOM 1052 CG HIS A 71 -10.742 -5.093 7.987 1.00 0.00 C ATOM 1053 ND1 HIS A 71 -10.069 -3.920 8.034 1.00 0.00 N flip ATOM 1054 CD2 HIS A 71 -10.195 -5.879 8.976 1.00 0.00 C flip ATOM 1055 CE1 HIS A 71 -9.144 -4.025 9.021 1.00 0.00 C flip ATOM 1056 NE2 HIS A 71 -9.235 -5.207 9.576 1.00 0.00 N flip ATOM 0 H HIS A 71 -12.941 -4.080 5.583 1.00 0.00 H new ATOM 0 HA HIS A 71 -10.415 -5.234 5.502 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -12.721 -4.919 7.242 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -12.126 -6.565 7.339 1.00 0.00 H new ATOM 0 HD1 HIS A 71 -10.228 -3.108 7.438 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -10.504 -6.885 9.220 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -8.443 -3.254 9.304 1.00 0.00 H new ATOM 1065 N LEU A 72 -12.864 -7.246 4.769 1.00 0.00 N ATOM 1066 CA LEU A 72 -13.129 -8.546 4.248 1.00 0.00 C ATOM 1067 C LEU A 72 -12.516 -8.818 2.880 1.00 0.00 C ATOM 1068 O LEU A 72 -11.687 -9.715 2.767 1.00 0.00 O ATOM 1069 CB LEU A 72 -14.580 -9.034 4.481 1.00 0.00 C ATOM 1070 CG LEU A 72 -15.764 -8.094 4.155 1.00 0.00 C ATOM 1071 CD1 LEU A 72 -16.032 -7.959 2.672 1.00 0.00 C ATOM 1072 CD2 LEU A 72 -17.005 -8.560 4.872 1.00 0.00 C ATOM 0 H LEU A 72 -13.693 -6.688 4.974 1.00 0.00 H new ATOM 0 HA LEU A 72 -12.558 -9.232 4.874 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -14.716 -9.944 3.897 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -14.665 -9.314 5.531 1.00 0.00 H new ATOM 0 HG LEU A 72 -15.482 -7.102 4.507 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -16.875 -7.286 2.514 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -15.148 -7.556 2.178 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -16.267 -8.938 2.254 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -17.834 -7.892 4.637 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -17.252 -9.572 4.551 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -16.828 -8.553 5.948 1.00 0.00 H new ATOM 1084 N LEU A 73 -12.797 -8.013 1.872 1.00 0.00 N ATOM 1085 CA LEU A 73 -12.176 -8.311 0.579 1.00 0.00 C ATOM 1086 C LEU A 73 -10.779 -7.747 0.410 1.00 0.00 C ATOM 1087 O LEU A 73 -9.858 -8.523 0.216 1.00 0.00 O ATOM 1088 CB LEU A 73 -13.042 -8.071 -0.646 1.00 0.00 C ATOM 1089 CG LEU A 73 -13.943 -9.234 -1.135 1.00 0.00 C ATOM 1090 CD1 LEU A 73 -13.144 -10.495 -1.443 1.00 0.00 C ATOM 1091 CD2 LEU A 73 -15.039 -9.535 -0.152 1.00 0.00 C ATOM 0 H LEU A 73 -13.409 -7.198 1.905 1.00 0.00 H new ATOM 0 HA LEU A 73 -12.069 -9.394 0.631 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -13.684 -7.215 -0.440 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -12.386 -7.787 -1.469 1.00 0.00 H new ATOM 0 HG LEU A 73 -14.399 -8.897 -2.066 1.00 0.00 H new ATOM 0 HD11 LEU A 73 -13.820 -11.280 -1.782 1.00 0.00 H new ATOM 0 HD12 LEU A 73 -12.415 -10.282 -2.225 1.00 0.00 H new ATOM 0 HD13 LEU A 73 -12.625 -10.826 -0.543 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -15.650 -10.355 -0.528 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -14.601 -9.818 0.805 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -15.662 -8.650 -0.019 1.00 0.00 H new ATOM 1103 N TRP A 74 -10.606 -6.401 0.502 1.00 0.00 N ATOM 1104 CA TRP A 74 -9.304 -5.769 0.386 1.00 0.00 C ATOM 1105 C TRP A 74 -8.251 -6.476 1.253 1.00 0.00 C ATOM 1106 O TRP A 74 -7.144 -6.739 0.844 1.00 0.00 O ATOM 1107 CB TRP A 74 -9.355 -4.319 0.878 1.00 0.00 C ATOM 1108 CG TRP A 74 -10.044 -3.222 0.055 1.00 0.00 C ATOM 1109 CD1 TRP A 74 -10.946 -3.286 -0.999 1.00 0.00 C ATOM 1110 CD2 TRP A 74 -9.776 -1.845 0.255 1.00 0.00 C ATOM 1111 NE1 TRP A 74 -11.276 -1.983 -1.409 1.00 0.00 N ATOM 1112 CE2 TRP A 74 -10.573 -1.089 -0.625 1.00 0.00 C ATOM 1113 CE3 TRP A 74 -8.923 -1.209 1.113 1.00 0.00 C ATOM 1114 CZ2 TRP A 74 -10.554 0.310 -0.627 1.00 0.00 C ATOM 1115 CZ3 TRP A 74 -8.882 0.182 1.122 1.00 0.00 C ATOM 1116 CH2 TRP A 74 -9.701 0.927 0.256 1.00 0.00 C ATOM 0 H TRP A 74 -11.372 -5.745 0.658 1.00 0.00 H new ATOM 0 HA TRP A 74 -9.037 -5.825 -0.669 1.00 0.00 H new ATOM 0 HB2 TRP A 74 -9.836 -4.332 1.856 1.00 0.00 H new ATOM 0 HB3 TRP A 74 -8.325 -4.000 1.034 1.00 0.00 H new ATOM 0 HD1 TRP A 74 -11.333 -4.195 -1.435 1.00 0.00 H new ATOM 0 HE1 TRP A 74 -11.924 -1.739 -2.158 1.00 0.00 H new ATOM 0 HE3 TRP A 74 -8.289 -1.779 1.776 1.00 0.00 H new ATOM 0 HZ2 TRP A 74 -11.183 0.881 -1.294 1.00 0.00 H new ATOM 0 HZ3 TRP A 74 -8.215 0.694 1.800 1.00 0.00 H new ATOM 0 HH2 TRP A 74 -9.659 2.006 0.285 1.00 0.00 H new ATOM 1127 N LYS A 75 -8.618 -6.748 2.433 1.00 0.00 N ATOM 1128 CA LYS A 75 -7.687 -7.231 3.396 1.00 0.00 C ATOM 1129 C LYS A 75 -7.440 -8.718 3.435 1.00 0.00 C ATOM 1130 O LYS A 75 -6.295 -9.107 3.628 1.00 0.00 O ATOM 1131 CB LYS A 75 -7.829 -6.554 4.733 1.00 0.00 C ATOM 1132 CG LYS A 75 -7.731 -5.041 4.585 1.00 0.00 C ATOM 1133 CD LYS A 75 -6.326 -4.571 4.173 1.00 0.00 C ATOM 1134 CE LYS A 75 -5.382 -4.626 5.387 1.00 0.00 C ATOM 1135 NZ LYS A 75 -4.063 -3.995 5.164 1.00 0.00 N ATOM 0 H LYS A 75 -9.573 -6.647 2.776 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.723 -6.906 3.004 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -8.787 -6.819 5.180 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -7.052 -6.909 5.410 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -8.454 -4.706 3.841 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -8.004 -4.570 5.529 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -5.941 -5.203 3.372 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -6.372 -3.554 3.782 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.867 -4.137 6.232 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -5.230 -5.668 5.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -3.711 -3.601 6.060 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -3.392 -4.708 4.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -4.157 -3.232 4.464 1.00 0.00 H new ATOM 1149 N SER A 76 -8.458 -9.574 3.219 1.00 0.00 N ATOM 1150 CA SER A 76 -8.145 -11.010 3.190 1.00 0.00 C ATOM 1151 C SER A 76 -7.223 -11.280 2.008 1.00 0.00 C ATOM 1152 O SER A 76 -6.242 -12.036 2.091 1.00 0.00 O ATOM 1153 CB SER A 76 -9.400 -11.881 3.120 1.00 0.00 C ATOM 1154 OG SER A 76 -10.142 -11.650 1.920 1.00 0.00 O ATOM 0 H SER A 76 -9.435 -9.320 3.072 1.00 0.00 H new ATOM 0 HA SER A 76 -7.647 -11.277 4.122 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.116 -12.932 3.175 1.00 0.00 H new ATOM 0 HB3 SER A 76 -10.033 -11.676 3.983 1.00 0.00 H new ATOM 0 HG SER A 76 -10.811 -10.952 2.079 1.00 0.00 H new ATOM 1160 N GLU A 77 -7.498 -10.563 0.942 1.00 0.00 N ATOM 1161 CA GLU A 77 -6.734 -10.628 -0.255 1.00 0.00 C ATOM 1162 C GLU A 77 -5.381 -10.003 -0.079 1.00 0.00 C ATOM 1163 O GLU A 77 -4.468 -10.359 -0.788 1.00 0.00 O ATOM 1164 CB GLU A 77 -7.488 -9.975 -1.380 1.00 0.00 C ATOM 1165 CG GLU A 77 -8.737 -10.713 -1.774 1.00 0.00 C ATOM 1166 CD GLU A 77 -8.420 -11.970 -2.495 1.00 0.00 C ATOM 1167 OE1 GLU A 77 -8.187 -11.892 -3.709 1.00 0.00 O ATOM 1168 OE2 GLU A 77 -8.409 -13.048 -1.882 1.00 0.00 O ATOM 0 H GLU A 77 -8.279 -9.908 0.895 1.00 0.00 H new ATOM 0 HA GLU A 77 -6.573 -11.677 -0.502 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -7.753 -8.959 -1.087 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.833 -9.896 -2.248 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -9.323 -10.941 -0.883 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -9.354 -10.075 -2.407 1.00 0.00 H new ATOM 1175 N PHE A 78 -5.244 -9.058 0.848 1.00 0.00 N ATOM 1176 CA PHE A 78 -3.941 -8.491 1.126 1.00 0.00 C ATOM 1177 C PHE A 78 -3.035 -9.576 1.627 1.00 0.00 C ATOM 1178 O PHE A 78 -1.923 -9.735 1.164 1.00 0.00 O ATOM 1179 CB PHE A 78 -4.037 -7.350 2.152 1.00 0.00 C ATOM 1180 CG PHE A 78 -2.707 -6.767 2.542 1.00 0.00 C ATOM 1181 CD1 PHE A 78 -2.064 -5.881 1.704 1.00 0.00 C ATOM 1182 CD2 PHE A 78 -2.104 -7.108 3.746 1.00 0.00 C ATOM 1183 CE1 PHE A 78 -0.851 -5.344 2.040 1.00 0.00 C ATOM 1184 CE2 PHE A 78 -0.888 -6.575 4.092 1.00 0.00 C ATOM 1185 CZ PHE A 78 -0.259 -5.692 3.236 1.00 0.00 C ATOM 0 H PHE A 78 -6.008 -8.679 1.407 1.00 0.00 H new ATOM 0 HA PHE A 78 -3.534 -8.068 0.207 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -4.664 -6.558 1.742 1.00 0.00 H new ATOM 0 HB3 PHE A 78 -4.537 -7.721 3.047 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -2.525 -5.606 0.767 1.00 0.00 H new ATOM 0 HD2 PHE A 78 -2.596 -7.798 4.415 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -0.360 -4.652 1.372 1.00 0.00 H new ATOM 0 HE2 PHE A 78 -0.425 -6.845 5.030 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.700 -5.273 3.504 1.00 0.00 H new ATOM 1195 N PHE A 79 -3.544 -10.353 2.521 1.00 0.00 N ATOM 1196 CA PHE A 79 -2.794 -11.433 3.073 1.00 0.00 C ATOM 1197 C PHE A 79 -2.498 -12.519 2.040 1.00 0.00 C ATOM 1198 O PHE A 79 -1.353 -13.000 1.935 1.00 0.00 O ATOM 1199 CB PHE A 79 -3.512 -11.985 4.283 1.00 0.00 C ATOM 1200 CG PHE A 79 -3.501 -11.016 5.446 1.00 0.00 C ATOM 1201 CD1 PHE A 79 -2.333 -10.773 6.154 1.00 0.00 C ATOM 1202 CD2 PHE A 79 -4.648 -10.342 5.815 1.00 0.00 C ATOM 1203 CE1 PHE A 79 -2.316 -9.878 7.204 1.00 0.00 C ATOM 1204 CE2 PHE A 79 -4.638 -9.444 6.864 1.00 0.00 C ATOM 1205 CZ PHE A 79 -3.473 -9.212 7.559 1.00 0.00 C ATOM 0 H PHE A 79 -4.490 -10.259 2.891 1.00 0.00 H new ATOM 0 HA PHE A 79 -1.824 -11.050 3.389 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -4.543 -12.218 4.017 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -3.042 -12.920 4.587 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -1.426 -11.291 5.880 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -5.566 -10.520 5.275 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -1.400 -9.699 7.747 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -5.544 -8.924 7.139 1.00 0.00 H new ATOM 0 HZ PHE A 79 -3.463 -8.511 8.380 1.00 0.00 H new ATOM 1215 N GLU A 80 -3.494 -12.869 1.257 1.00 0.00 N ATOM 1216 CA GLU A 80 -3.355 -13.925 0.271 1.00 0.00 C ATOM 1217 C GLU A 80 -2.487 -13.531 -0.934 1.00 0.00 C ATOM 1218 O GLU A 80 -1.574 -14.266 -1.307 1.00 0.00 O ATOM 1219 CB GLU A 80 -4.723 -14.475 -0.161 1.00 0.00 C ATOM 1220 CG GLU A 80 -5.471 -15.191 0.960 1.00 0.00 C ATOM 1221 CD GLU A 80 -4.752 -16.436 1.438 1.00 0.00 C ATOM 1222 OE1 GLU A 80 -3.654 -16.324 2.027 1.00 0.00 O ATOM 1223 OE2 GLU A 80 -5.271 -17.554 1.273 1.00 0.00 O ATOM 0 H GLU A 80 -4.417 -12.436 1.282 1.00 0.00 H new ATOM 0 HA GLU A 80 -2.813 -14.730 0.768 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -5.337 -13.653 -0.530 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -4.582 -15.166 -0.993 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.602 -14.507 1.799 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.467 -15.463 0.611 1.00 0.00 H new ATOM 1230 N ASN A 81 -2.741 -12.374 -1.512 1.00 0.00 N ATOM 1231 CA ASN A 81 -1.993 -11.900 -2.690 1.00 0.00 C ATOM 1232 C ASN A 81 -0.575 -11.562 -2.351 1.00 0.00 C ATOM 1233 O ASN A 81 0.346 -11.962 -3.058 1.00 0.00 O ATOM 1234 CB ASN A 81 -2.664 -10.681 -3.345 1.00 0.00 C ATOM 1235 CG ASN A 81 -3.997 -11.005 -3.984 1.00 0.00 C ATOM 1236 OD1 ASN A 81 -4.212 -12.114 -4.473 1.00 0.00 O ATOM 1237 ND2 ASN A 81 -4.900 -10.064 -3.977 1.00 0.00 N ATOM 0 H ASN A 81 -3.464 -11.730 -1.191 1.00 0.00 H new ATOM 0 HA ASN A 81 -1.997 -12.726 -3.401 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -2.808 -9.906 -2.592 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -1.996 -10.270 -4.102 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -5.819 -10.236 -4.385 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -4.688 -9.156 -3.563 1.00 0.00 H new ATOM 1244 N CYS A 82 -0.380 -10.859 -1.265 1.00 0.00 N ATOM 1245 CA CYS A 82 0.936 -10.438 -0.878 1.00 0.00 C ATOM 1246 C CYS A 82 1.851 -11.613 -0.507 1.00 0.00 C ATOM 1247 O CYS A 82 2.963 -11.692 -0.984 1.00 0.00 O ATOM 1248 CB CYS A 82 0.858 -9.387 0.215 1.00 0.00 C ATOM 1249 SG CYS A 82 0.068 -7.843 -0.290 1.00 0.00 S ATOM 0 H CYS A 82 -1.123 -10.566 -0.631 1.00 0.00 H new ATOM 0 HA CYS A 82 1.404 -9.977 -1.748 1.00 0.00 H new ATOM 0 HB2 CYS A 82 0.311 -9.801 1.062 1.00 0.00 H new ATOM 0 HB3 CYS A 82 1.867 -9.168 0.564 1.00 0.00 H new ATOM 0 HG CYS A 82 -0.334 -7.196 0.764 1.00 0.00 H new ATOM 1255 N ARG A 83 1.369 -12.552 0.291 1.00 0.00 N ATOM 1256 CA ARG A 83 2.198 -13.715 0.651 1.00 0.00 C ATOM 1257 C ARG A 83 2.374 -14.669 -0.535 1.00 0.00 C ATOM 1258 O ARG A 83 3.364 -15.411 -0.605 1.00 0.00 O ATOM 1259 CB ARG A 83 1.695 -14.411 1.922 1.00 0.00 C ATOM 1260 CG ARG A 83 2.031 -13.659 3.214 1.00 0.00 C ATOM 1261 CD ARG A 83 3.527 -13.749 3.511 1.00 0.00 C ATOM 1262 NE ARG A 83 3.994 -12.836 4.575 1.00 0.00 N ATOM 1263 CZ ARG A 83 4.477 -13.228 5.744 1.00 0.00 C ATOM 1264 NH1 ARG A 83 4.115 -14.404 6.253 1.00 0.00 N ATOM 1265 NH2 ARG A 83 5.254 -12.409 6.445 1.00 0.00 N ATOM 0 H ARG A 83 0.434 -12.544 0.698 1.00 0.00 H new ATOM 0 HA ARG A 83 3.194 -13.347 0.895 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.614 -14.533 1.854 1.00 0.00 H new ATOM 0 HB3 ARG A 83 2.126 -15.411 1.972 1.00 0.00 H new ATOM 0 HG2 ARG A 83 1.735 -12.614 3.121 1.00 0.00 H new ATOM 0 HG3 ARG A 83 1.463 -14.079 4.044 1.00 0.00 H new ATOM 0 HD2 ARG A 83 3.767 -14.773 3.796 1.00 0.00 H new ATOM 0 HD3 ARG A 83 4.080 -13.535 2.597 1.00 0.00 H new ATOM 0 HE ARG A 83 3.941 -11.833 4.396 1.00 0.00 H new ATOM 0 HH11 ARG A 83 3.466 -15.003 5.742 1.00 0.00 H new ATOM 0 HH12 ARG A 83 4.487 -14.706 7.153 1.00 0.00 H new ATOM 0 HH21 ARG A 83 5.476 -11.482 6.082 1.00 0.00 H new ATOM 0 HH22 ARG A 83 5.628 -12.707 7.346 1.00 0.00 H new ATOM 1279 N ASP A 84 1.431 -14.626 -1.473 1.00 0.00 N ATOM 1280 CA ASP A 84 1.531 -15.385 -2.741 1.00 0.00 C ATOM 1281 C ASP A 84 2.746 -14.913 -3.478 1.00 0.00 C ATOM 1282 O ASP A 84 3.588 -15.685 -3.936 1.00 0.00 O ATOM 1283 CB ASP A 84 0.360 -15.063 -3.634 1.00 0.00 C ATOM 1284 CG ASP A 84 0.325 -15.910 -4.895 1.00 0.00 C ATOM 1285 OD1 ASP A 84 -0.246 -17.029 -4.874 1.00 0.00 O ATOM 1286 OD2 ASP A 84 0.866 -15.469 -5.925 1.00 0.00 O ATOM 0 H ASP A 84 0.579 -14.072 -1.388 1.00 0.00 H new ATOM 0 HA ASP A 84 1.565 -16.449 -2.507 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -0.566 -15.211 -3.078 1.00 0.00 H new ATOM 0 HB3 ASP A 84 0.400 -14.010 -3.911 1.00 0.00 H new ATOM 1291 N THR A 85 2.813 -13.636 -3.556 1.00 0.00 N ATOM 1292 CA THR A 85 3.852 -12.938 -4.197 1.00 0.00 C ATOM 1293 C THR A 85 5.161 -13.164 -3.434 1.00 0.00 C ATOM 1294 O THR A 85 6.202 -13.421 -4.033 1.00 0.00 O ATOM 1295 CB THR A 85 3.436 -11.463 -4.231 1.00 0.00 C ATOM 1296 OG1 THR A 85 2.154 -11.366 -4.909 1.00 0.00 O ATOM 1297 CG2 THR A 85 4.461 -10.594 -4.920 1.00 0.00 C ATOM 0 H THR A 85 2.106 -13.022 -3.152 1.00 0.00 H new ATOM 0 HA THR A 85 4.022 -13.286 -5.216 1.00 0.00 H new ATOM 0 HB THR A 85 3.359 -11.099 -3.207 1.00 0.00 H new ATOM 0 HG1 THR A 85 1.438 -11.290 -4.245 1.00 0.00 H new ATOM 0 HG21 THR A 85 4.120 -9.559 -4.918 1.00 0.00 H new ATOM 0 HG22 THR A 85 5.412 -10.664 -4.392 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.592 -10.931 -5.948 1.00 0.00 H new ATOM 1305 N ALA A 86 5.070 -13.146 -2.106 1.00 0.00 N ATOM 1306 CA ALA A 86 6.182 -13.415 -1.228 1.00 0.00 C ATOM 1307 C ALA A 86 6.832 -14.741 -1.538 1.00 0.00 C ATOM 1308 O ALA A 86 8.023 -14.795 -1.761 1.00 0.00 O ATOM 1309 CB ALA A 86 5.731 -13.390 0.207 1.00 0.00 C ATOM 0 H ALA A 86 4.202 -12.939 -1.612 1.00 0.00 H new ATOM 0 HA ALA A 86 6.923 -12.632 -1.390 1.00 0.00 H new ATOM 0 HB1 ALA A 86 6.580 -13.595 0.859 1.00 0.00 H new ATOM 0 HB2 ALA A 86 5.321 -12.408 0.443 1.00 0.00 H new ATOM 0 HB3 ALA A 86 4.964 -14.149 0.361 1.00 0.00 H new ATOM 1315 N LYS A 87 6.041 -15.818 -1.585 1.00 0.00 N ATOM 1316 CA LYS A 87 6.592 -17.143 -1.872 1.00 0.00 C ATOM 1317 C LYS A 87 7.156 -17.212 -3.304 1.00 0.00 C ATOM 1318 O LYS A 87 8.073 -17.996 -3.588 1.00 0.00 O ATOM 1319 CB LYS A 87 5.585 -18.278 -1.577 1.00 0.00 C ATOM 1320 CG LYS A 87 4.297 -18.190 -2.358 1.00 0.00 C ATOM 1321 CD LYS A 87 3.338 -19.318 -2.029 1.00 0.00 C ATOM 1322 CE LYS A 87 2.075 -19.187 -2.859 1.00 0.00 C ATOM 1323 NZ LYS A 87 1.097 -20.255 -2.611 1.00 0.00 N ATOM 0 H LYS A 87 5.033 -15.799 -1.430 1.00 0.00 H new ATOM 0 HA LYS A 87 7.426 -17.302 -1.188 1.00 0.00 H new ATOM 0 HB2 LYS A 87 6.061 -19.234 -1.793 1.00 0.00 H new ATOM 0 HB3 LYS A 87 5.351 -18.271 -0.512 1.00 0.00 H new ATOM 0 HG2 LYS A 87 3.814 -17.235 -2.150 1.00 0.00 H new ATOM 0 HG3 LYS A 87 4.521 -18.208 -3.425 1.00 0.00 H new ATOM 0 HD2 LYS A 87 3.814 -20.279 -2.225 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.089 -19.296 -0.968 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.610 -18.224 -2.649 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.342 -19.188 -3.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 0.260 -20.105 -3.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 1.524 -21.176 -2.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 0.814 -20.241 -1.610 1.00 0.00 H new ATOM 1337 N ARG A 88 6.643 -16.369 -4.198 1.00 0.00 N ATOM 1338 CA ARG A 88 7.191 -16.284 -5.555 1.00 0.00 C ATOM 1339 C ARG A 88 8.521 -15.565 -5.553 1.00 0.00 C ATOM 1340 O ARG A 88 9.406 -15.869 -6.352 1.00 0.00 O ATOM 1341 CB ARG A 88 6.224 -15.620 -6.564 1.00 0.00 C ATOM 1342 CG ARG A 88 5.384 -16.605 -7.367 1.00 0.00 C ATOM 1343 CD ARG A 88 4.416 -17.371 -6.502 1.00 0.00 C ATOM 1344 NE ARG A 88 3.832 -18.497 -7.231 1.00 0.00 N ATOM 1345 CZ ARG A 88 2.533 -18.747 -7.403 1.00 0.00 C ATOM 1346 NH1 ARG A 88 1.617 -17.875 -7.029 1.00 0.00 N ATOM 1347 NH2 ARG A 88 2.162 -19.864 -8.000 1.00 0.00 N ATOM 0 H ARG A 88 5.860 -15.742 -4.014 1.00 0.00 H new ATOM 0 HA ARG A 88 7.336 -17.312 -5.889 1.00 0.00 H new ATOM 0 HB2 ARG A 88 5.557 -14.949 -6.023 1.00 0.00 H new ATOM 0 HB3 ARG A 88 6.803 -15.006 -7.254 1.00 0.00 H new ATOM 0 HG2 ARG A 88 4.832 -16.065 -8.136 1.00 0.00 H new ATOM 0 HG3 ARG A 88 6.042 -17.306 -7.880 1.00 0.00 H new ATOM 0 HD2 ARG A 88 4.930 -17.737 -5.613 1.00 0.00 H new ATOM 0 HD3 ARG A 88 3.624 -16.705 -6.161 1.00 0.00 H new ATOM 0 HE ARG A 88 4.485 -19.159 -7.651 1.00 0.00 H new ATOM 0 HH11 ARG A 88 1.897 -16.993 -6.601 1.00 0.00 H new ATOM 0 HH12 ARG A 88 0.628 -18.083 -7.168 1.00 0.00 H new ATOM 0 HH21 ARG A 88 2.866 -20.527 -8.325 1.00 0.00 H new ATOM 0 HH22 ARG A 88 1.171 -20.065 -8.136 1.00 0.00 H new ATOM 1361 N ASN A 89 8.680 -14.636 -4.665 1.00 0.00 N ATOM 1362 CA ASN A 89 9.906 -13.887 -4.603 1.00 0.00 C ATOM 1363 C ASN A 89 10.954 -14.668 -3.772 1.00 0.00 C ATOM 1364 O ASN A 89 12.170 -14.555 -4.001 1.00 0.00 O ATOM 1365 CB ASN A 89 9.632 -12.470 -4.044 1.00 0.00 C ATOM 1366 CG ASN A 89 10.614 -11.433 -4.548 1.00 0.00 C ATOM 1367 OD1 ASN A 89 11.742 -11.727 -4.821 1.00 0.00 O ATOM 1368 ND2 ASN A 89 10.158 -10.213 -4.691 1.00 0.00 N ATOM 0 H ASN A 89 7.980 -14.374 -3.971 1.00 0.00 H new ATOM 0 HA ASN A 89 10.319 -13.759 -5.603 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.621 -12.167 -4.317 1.00 0.00 H new ATOM 0 HB3 ASN A 89 9.672 -12.501 -2.955 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.770 -9.478 -5.045 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.191 -9.998 -4.448 1.00 0.00 H new ATOM 1375 N GLN A 90 10.477 -15.507 -2.835 1.00 0.00 N ATOM 1376 CA GLN A 90 11.375 -16.340 -2.016 1.00 0.00 C ATOM 1377 C GLN A 90 12.033 -17.413 -2.843 1.00 0.00 C ATOM 1378 O GLN A 90 13.217 -17.681 -2.678 1.00 0.00 O ATOM 1379 CB GLN A 90 10.674 -17.019 -0.834 1.00 0.00 C ATOM 1380 CG GLN A 90 9.960 -16.108 0.143 1.00 0.00 C ATOM 1381 CD GLN A 90 10.730 -14.859 0.476 1.00 0.00 C ATOM 1382 OE1 GLN A 90 11.558 -14.842 1.376 1.00 0.00 O ATOM 1383 NE2 GLN A 90 10.400 -13.795 -0.201 1.00 0.00 N ATOM 0 H GLN A 90 9.485 -15.626 -2.628 1.00 0.00 H new ATOM 0 HA GLN A 90 12.117 -15.645 -1.623 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.949 -17.730 -1.230 1.00 0.00 H new ATOM 0 HB3 GLN A 90 11.417 -17.596 -0.282 1.00 0.00 H new ATOM 0 HG2 GLN A 90 8.993 -15.828 -0.275 1.00 0.00 H new ATOM 0 HG3 GLN A 90 9.763 -16.659 1.063 1.00 0.00 H new ATOM 0 HE21 GLN A 90 9.703 -13.859 -0.943 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.838 -12.899 0.012 1.00 0.00 H new ATOM 1392 N GLN A 91 11.285 -18.017 -3.742 1.00 0.00 N ATOM 1393 CA GLN A 91 11.823 -19.078 -4.585 1.00 0.00 C ATOM 1394 C GLN A 91 12.883 -18.545 -5.565 1.00 0.00 C ATOM 1395 O GLN A 91 13.727 -19.300 -6.057 1.00 0.00 O ATOM 1396 CB GLN A 91 10.706 -19.814 -5.302 1.00 0.00 C ATOM 1397 CG GLN A 91 9.875 -18.945 -6.207 1.00 0.00 C ATOM 1398 CD GLN A 91 8.634 -19.642 -6.692 1.00 0.00 C ATOM 1399 OE1 GLN A 91 8.640 -20.279 -7.739 1.00 0.00 O ATOM 1400 NE2 GLN A 91 7.584 -19.594 -5.910 1.00 0.00 N ATOM 0 H GLN A 91 10.304 -17.796 -3.912 1.00 0.00 H new ATOM 0 HA GLN A 91 12.329 -19.795 -3.939 1.00 0.00 H new ATOM 0 HB2 GLN A 91 11.139 -20.623 -5.891 1.00 0.00 H new ATOM 0 HB3 GLN A 91 10.054 -20.274 -4.559 1.00 0.00 H new ATOM 0 HG2 GLN A 91 9.593 -18.036 -5.675 1.00 0.00 H new ATOM 0 HG3 GLN A 91 10.475 -18.640 -7.064 1.00 0.00 H new ATOM 0 HE21 GLN A 91 7.616 -19.053 -5.046 1.00 0.00 H new ATOM 0 HE22 GLN A 91 6.735 -20.098 -6.165 1.00 0.00 H new ATOM 1409 N ALA A 92 12.845 -17.247 -5.819 1.00 0.00 N ATOM 1410 CA ALA A 92 13.833 -16.601 -6.657 1.00 0.00 C ATOM 1411 C ALA A 92 15.035 -16.189 -5.794 1.00 0.00 C ATOM 1412 O ALA A 92 16.134 -15.938 -6.298 1.00 0.00 O ATOM 1413 CB ALA A 92 13.218 -15.391 -7.338 1.00 0.00 C ATOM 0 H ALA A 92 12.132 -16.618 -5.451 1.00 0.00 H new ATOM 0 HA ALA A 92 14.173 -17.291 -7.429 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.966 -14.909 -7.967 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.376 -15.709 -7.953 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.870 -14.686 -6.583 1.00 0.00 H new ATOM 1419 N GLY A 93 14.800 -16.128 -4.489 1.00 0.00 N ATOM 1420 CA GLY A 93 15.825 -15.790 -3.532 1.00 0.00 C ATOM 1421 C GLY A 93 16.234 -14.349 -3.604 1.00 0.00 C ATOM 1422 O GLY A 93 17.416 -14.027 -3.506 1.00 0.00 O ATOM 0 H GLY A 93 13.888 -16.314 -4.072 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.465 -16.011 -2.527 1.00 0.00 H new ATOM 0 HA3 GLY A 93 16.698 -16.420 -3.704 1.00 0.00 H new ATOM 1426 N ASN A 94 15.274 -13.475 -3.823 1.00 0.00 N ATOM 1427 CA ASN A 94 15.556 -12.031 -3.890 1.00 0.00 C ATOM 1428 C ASN A 94 15.457 -11.372 -2.518 1.00 0.00 C ATOM 1429 O ASN A 94 16.042 -10.314 -2.291 1.00 0.00 O ATOM 1430 CB ASN A 94 14.608 -11.325 -4.853 1.00 0.00 C ATOM 1431 CG ASN A 94 14.747 -11.762 -6.295 1.00 0.00 C ATOM 1432 OD1 ASN A 94 15.832 -12.057 -6.774 1.00 0.00 O ATOM 1433 ND2 ASN A 94 13.641 -11.850 -6.979 1.00 0.00 N ATOM 0 H ASN A 94 14.294 -13.723 -3.959 1.00 0.00 H new ATOM 0 HA ASN A 94 16.578 -11.932 -4.255 1.00 0.00 H new ATOM 0 HB2 ASN A 94 13.582 -11.501 -4.529 1.00 0.00 H new ATOM 0 HB3 ASN A 94 14.781 -10.251 -4.793 1.00 0.00 H new ATOM 0 HD21 ASN A 94 13.664 -12.174 -7.946 1.00 0.00 H new ATOM 0 HD22 ASN A 94 12.753 -11.595 -6.547 1.00 0.00 H new ATOM 1440 N GLY A 95 14.717 -11.986 -1.610 1.00 0.00 N ATOM 1441 CA GLY A 95 14.569 -11.435 -0.270 1.00 0.00 C ATOM 1442 C GLY A 95 13.549 -10.295 -0.163 1.00 0.00 C ATOM 1443 O GLY A 95 13.616 -9.477 0.762 1.00 0.00 O ATOM 0 H GLY A 95 14.213 -12.858 -1.772 1.00 0.00 H new ATOM 0 HA2 GLY A 95 14.273 -12.235 0.408 1.00 0.00 H new ATOM 0 HA3 GLY A 95 15.539 -11.071 0.069 1.00 0.00 H new ATOM 1447 N TRP A 96 12.604 -10.246 -1.064 1.00 0.00 N ATOM 1448 CA TRP A 96 11.582 -9.231 -1.011 1.00 0.00 C ATOM 1449 C TRP A 96 10.269 -9.896 -0.796 1.00 0.00 C ATOM 1450 O TRP A 96 10.199 -11.124 -0.759 1.00 0.00 O ATOM 1451 CB TRP A 96 11.480 -8.413 -2.304 1.00 0.00 C ATOM 1452 CG TRP A 96 12.628 -7.526 -2.616 1.00 0.00 C ATOM 1453 CD1 TRP A 96 13.171 -6.582 -1.802 1.00 0.00 C ATOM 1454 CD2 TRP A 96 13.331 -7.443 -3.858 1.00 0.00 C ATOM 1455 NE1 TRP A 96 14.187 -5.943 -2.443 1.00 0.00 N ATOM 1456 CE2 TRP A 96 14.308 -6.456 -3.708 1.00 0.00 C ATOM 1457 CE3 TRP A 96 13.246 -8.127 -5.073 1.00 0.00 C ATOM 1458 CZ2 TRP A 96 15.181 -6.117 -4.724 1.00 0.00 C ATOM 1459 CZ3 TRP A 96 14.119 -7.781 -6.083 1.00 0.00 C ATOM 1460 CH2 TRP A 96 15.080 -6.790 -5.898 1.00 0.00 C ATOM 0 H TRP A 96 12.519 -10.897 -1.845 1.00 0.00 H new ATOM 0 HA TRP A 96 11.846 -8.551 -0.201 1.00 0.00 H new ATOM 0 HB2 TRP A 96 11.347 -9.104 -3.136 1.00 0.00 H new ATOM 0 HB3 TRP A 96 10.580 -7.801 -2.251 1.00 0.00 H new ATOM 0 HD1 TRP A 96 12.844 -6.370 -0.795 1.00 0.00 H new ATOM 0 HE1 TRP A 96 14.765 -5.202 -2.046 1.00 0.00 H new ATOM 0 HE3 TRP A 96 12.514 -8.908 -5.218 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 15.920 -5.341 -4.588 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 14.056 -8.288 -7.035 1.00 0.00 H new ATOM 0 HH2 TRP A 96 15.758 -6.553 -6.705 1.00 0.00 H new ATOM 1471 N ASP A 97 9.258 -9.092 -0.616 1.00 0.00 N ATOM 1472 CA ASP A 97 7.854 -9.509 -0.594 1.00 0.00 C ATOM 1473 C ASP A 97 7.376 -10.246 0.665 1.00 0.00 C ATOM 1474 O ASP A 97 6.212 -10.170 1.020 1.00 0.00 O ATOM 1475 CB ASP A 97 7.453 -10.259 -1.864 1.00 0.00 C ATOM 1476 CG ASP A 97 7.462 -9.385 -3.092 1.00 0.00 C ATOM 1477 OD1 ASP A 97 7.322 -8.168 -2.958 1.00 0.00 O ATOM 1478 OD2 ASP A 97 7.625 -9.933 -4.211 1.00 0.00 O ATOM 0 H ASP A 97 9.377 -8.089 -0.474 1.00 0.00 H new ATOM 0 HA ASP A 97 7.321 -8.559 -0.558 1.00 0.00 H new ATOM 0 HB2 ASP A 97 8.135 -11.096 -2.016 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.456 -10.680 -1.731 1.00 0.00 H new ATOM 1483 N PHE A 98 8.228 -10.968 1.309 1.00 0.00 N ATOM 1484 CA PHE A 98 7.834 -11.688 2.491 1.00 0.00 C ATOM 1485 C PHE A 98 7.757 -10.782 3.738 1.00 0.00 C ATOM 1486 O PHE A 98 6.693 -10.663 4.352 1.00 0.00 O ATOM 1487 CB PHE A 98 8.716 -12.925 2.680 1.00 0.00 C ATOM 1488 CG PHE A 98 8.315 -13.806 3.810 1.00 0.00 C ATOM 1489 CD1 PHE A 98 7.233 -14.643 3.672 1.00 0.00 C ATOM 1490 CD2 PHE A 98 9.022 -13.813 4.997 1.00 0.00 C ATOM 1491 CE1 PHE A 98 6.852 -15.476 4.688 1.00 0.00 C ATOM 1492 CE2 PHE A 98 8.649 -14.645 6.032 1.00 0.00 C ATOM 1493 CZ PHE A 98 7.559 -15.479 5.875 1.00 0.00 C ATOM 0 H PHE A 98 9.206 -11.081 1.043 1.00 0.00 H new ATOM 0 HA PHE A 98 6.814 -12.044 2.351 1.00 0.00 H new ATOM 0 HB2 PHE A 98 8.703 -13.508 1.759 1.00 0.00 H new ATOM 0 HB3 PHE A 98 9.745 -12.601 2.837 1.00 0.00 H new ATOM 0 HD1 PHE A 98 6.675 -14.643 2.747 1.00 0.00 H new ATOM 0 HD2 PHE A 98 9.875 -13.161 5.116 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.001 -16.129 4.563 1.00 0.00 H new ATOM 0 HE2 PHE A 98 9.205 -14.644 6.958 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.259 -16.133 6.680 1.00 0.00 H new ATOM 1503 N ASP A 99 8.872 -10.178 4.114 1.00 0.00 N ATOM 1504 CA ASP A 99 8.898 -9.222 5.243 1.00 0.00 C ATOM 1505 C ASP A 99 8.351 -7.886 4.807 1.00 0.00 C ATOM 1506 O ASP A 99 7.429 -7.346 5.421 1.00 0.00 O ATOM 1507 CB ASP A 99 10.358 -8.962 5.720 1.00 0.00 C ATOM 1508 CG ASP A 99 11.026 -10.067 6.509 1.00 0.00 C ATOM 1509 OD1 ASP A 99 11.321 -11.140 5.947 1.00 0.00 O ATOM 1510 OD2 ASP A 99 11.317 -9.847 7.703 1.00 0.00 O ATOM 0 H ASP A 99 9.776 -10.322 3.665 1.00 0.00 H new ATOM 0 HA ASP A 99 8.300 -9.658 6.043 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.970 -8.754 4.842 1.00 0.00 H new ATOM 0 HB3 ASP A 99 10.360 -8.059 6.331 1.00 0.00 H new ATOM 1515 N MET A 100 8.958 -7.348 3.754 1.00 0.00 N ATOM 1516 CA MET A 100 8.669 -5.986 3.263 1.00 0.00 C ATOM 1517 C MET A 100 7.225 -5.852 2.806 1.00 0.00 C ATOM 1518 O MET A 100 6.467 -5.046 3.345 1.00 0.00 O ATOM 1519 CB MET A 100 9.651 -5.613 2.151 1.00 0.00 C ATOM 1520 CG MET A 100 11.099 -5.619 2.600 1.00 0.00 C ATOM 1521 SD MET A 100 12.221 -5.389 1.222 1.00 0.00 S ATOM 1522 CE MET A 100 13.807 -5.438 2.046 1.00 0.00 C ATOM 0 H MET A 100 9.668 -7.838 3.209 1.00 0.00 H new ATOM 0 HA MET A 100 8.802 -5.285 4.087 1.00 0.00 H new ATOM 0 HB2 MET A 100 9.532 -6.311 1.322 1.00 0.00 H new ATOM 0 HB3 MET A 100 9.400 -4.622 1.772 1.00 0.00 H new ATOM 0 HG2 MET A 100 11.256 -4.828 3.333 1.00 0.00 H new ATOM 0 HG3 MET A 100 11.322 -6.563 3.097 1.00 0.00 H new ATOM 0 HE1 MET A 100 14.602 -5.308 1.312 1.00 0.00 H new ATOM 0 HE2 MET A 100 13.859 -4.637 2.783 1.00 0.00 H new ATOM 0 HE3 MET A 100 13.928 -6.399 2.545 1.00 0.00 H new ATOM 1532 N LEU A 101 6.839 -6.646 1.831 1.00 0.00 N ATOM 1533 CA LEU A 101 5.456 -6.704 1.411 1.00 0.00 C ATOM 1534 C LEU A 101 4.737 -7.501 2.505 1.00 0.00 C ATOM 1535 O LEU A 101 5.405 -8.199 3.245 1.00 0.00 O ATOM 1536 CB LEU A 101 5.371 -7.459 0.094 1.00 0.00 C ATOM 1537 CG LEU A 101 4.002 -7.670 -0.498 1.00 0.00 C ATOM 1538 CD1 LEU A 101 3.386 -6.360 -0.843 1.00 0.00 C ATOM 1539 CD2 LEU A 101 4.086 -8.563 -1.710 1.00 0.00 C ATOM 0 H LEU A 101 7.466 -7.262 1.313 1.00 0.00 H new ATOM 0 HA LEU A 101 5.019 -5.715 1.271 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.976 -6.926 -0.639 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.831 -8.437 0.236 1.00 0.00 H new ATOM 0 HG LEU A 101 3.369 -8.162 0.241 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.397 -6.524 -1.270 1.00 0.00 H new ATOM 0 HD12 LEU A 101 3.296 -5.752 0.057 1.00 0.00 H new ATOM 0 HD13 LEU A 101 4.013 -5.843 -1.569 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.089 -8.706 -2.126 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.729 -8.101 -2.459 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.501 -9.529 -1.422 1.00 0.00 H new ATOM 1551 N THR A 102 3.420 -7.352 2.667 1.00 0.00 N ATOM 1552 CA THR A 102 2.586 -8.053 3.705 1.00 0.00 C ATOM 1553 C THR A 102 2.665 -7.291 5.024 1.00 0.00 C ATOM 1554 O THR A 102 1.701 -7.229 5.788 1.00 0.00 O ATOM 1555 CB THR A 102 2.883 -9.608 3.943 1.00 0.00 C ATOM 1556 OG1 THR A 102 4.083 -9.850 4.694 1.00 0.00 O ATOM 1557 CG2 THR A 102 2.982 -10.364 2.640 1.00 0.00 C ATOM 0 H THR A 102 2.869 -6.729 2.076 1.00 0.00 H new ATOM 0 HA THR A 102 1.577 -8.045 3.293 1.00 0.00 H new ATOM 0 HB THR A 102 2.033 -9.967 4.524 1.00 0.00 H new ATOM 0 HG1 THR A 102 4.863 -9.607 4.152 1.00 0.00 H new ATOM 0 HG21 THR A 102 3.184 -11.415 2.844 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.042 -10.274 2.095 1.00 0.00 H new ATOM 0 HG23 THR A 102 3.791 -9.949 2.039 1.00 0.00 H new ATOM 1661 N ASP A 111 12.274 1.755 6.153 1.00 0.00 N ATOM 1662 CA ASP A 111 13.631 1.628 5.600 1.00 0.00 C ATOM 1663 C ASP A 111 13.630 0.962 4.259 1.00 0.00 C ATOM 1664 O ASP A 111 14.095 1.548 3.263 1.00 0.00 O ATOM 1665 CB ASP A 111 14.547 0.816 6.523 1.00 0.00 C ATOM 1666 CG ASP A 111 14.860 1.490 7.816 1.00 0.00 C ATOM 1667 OD1 ASP A 111 15.852 2.229 7.886 1.00 0.00 O ATOM 1668 OD2 ASP A 111 14.125 1.274 8.795 1.00 0.00 O ATOM 0 HA ASP A 111 14.005 2.647 5.505 1.00 0.00 H new ATOM 0 HB2 ASP A 111 14.076 -0.145 6.731 1.00 0.00 H new ATOM 0 HB3 ASP A 111 15.480 0.607 5.999 1.00 0.00 H new ATOM 1673 N ALA A 112 13.004 -0.208 4.209 1.00 0.00 N ATOM 1674 CA ALA A 112 12.990 -1.080 3.043 1.00 0.00 C ATOM 1675 C ALA A 112 12.515 -0.359 1.801 1.00 0.00 C ATOM 1676 O ALA A 112 13.077 -0.517 0.714 1.00 0.00 O ATOM 1677 CB ALA A 112 12.111 -2.281 3.325 1.00 0.00 C ATOM 0 H ALA A 112 12.479 -0.585 4.998 1.00 0.00 H new ATOM 0 HA ALA A 112 14.012 -1.407 2.851 1.00 0.00 H new ATOM 0 HB1 ALA A 112 12.099 -2.936 2.454 1.00 0.00 H new ATOM 0 HB2 ALA A 112 12.504 -2.826 4.183 1.00 0.00 H new ATOM 0 HB3 ALA A 112 11.096 -1.946 3.542 1.00 0.00 H new ATOM 1683 N GLN A 113 11.502 0.458 1.952 1.00 0.00 N ATOM 1684 CA GLN A 113 11.019 1.171 0.831 1.00 0.00 C ATOM 1685 C GLN A 113 11.714 2.445 0.528 1.00 0.00 C ATOM 1686 O GLN A 113 11.715 2.898 -0.616 1.00 0.00 O ATOM 1687 CB GLN A 113 9.523 1.207 0.658 1.00 0.00 C ATOM 1688 CG GLN A 113 9.129 0.239 -0.431 1.00 0.00 C ATOM 1689 CD GLN A 113 9.686 0.697 -1.779 1.00 0.00 C ATOM 1690 OE1 GLN A 113 10.961 0.435 -2.045 1.00 0.00 O flip ATOM 1691 NE2 GLN A 113 9.020 1.365 -2.532 1.00 0.00 N flip ATOM 0 H GLN A 113 11.013 0.634 2.830 1.00 0.00 H new ATOM 0 HA GLN A 113 11.333 0.519 0.016 1.00 0.00 H new ATOM 0 HB2 GLN A 113 9.030 0.942 1.593 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.198 2.215 0.401 1.00 0.00 H new ATOM 0 HG2 GLN A 113 9.505 -0.757 -0.195 1.00 0.00 H new ATOM 0 HG3 GLN A 113 8.043 0.165 -0.485 1.00 0.00 H new ATOM 0 HE21 GLN A 113 8.042 1.558 -2.314 1.00 0.00 H new ATOM 0 HE22 GLN A 113 9.435 1.737 -3.386 1.00 0.00 H new ATOM 1700 N MET A 114 12.332 3.009 1.496 1.00 0.00 N ATOM 1701 CA MET A 114 13.089 4.202 1.279 1.00 0.00 C ATOM 1702 C MET A 114 14.248 4.010 0.303 1.00 0.00 C ATOM 1703 O MET A 114 14.478 4.875 -0.544 1.00 0.00 O ATOM 1704 CB MET A 114 13.576 4.777 2.591 1.00 0.00 C ATOM 1705 CG MET A 114 14.602 5.887 2.426 1.00 0.00 C ATOM 1706 SD MET A 114 15.140 6.617 3.986 1.00 0.00 S ATOM 1707 CE MET A 114 13.603 7.316 4.596 1.00 0.00 C ATOM 0 H MET A 114 12.334 2.668 2.457 1.00 0.00 H new ATOM 0 HA MET A 114 12.411 4.916 0.812 1.00 0.00 H new ATOM 0 HB2 MET A 114 12.722 5.163 3.148 1.00 0.00 H new ATOM 0 HB3 MET A 114 14.012 3.977 3.189 1.00 0.00 H new ATOM 0 HG2 MET A 114 15.472 5.491 1.902 1.00 0.00 H new ATOM 0 HG3 MET A 114 14.179 6.669 1.796 1.00 0.00 H new ATOM 0 HE1 MET A 114 13.821 8.070 5.352 1.00 0.00 H new ATOM 0 HE2 MET A 114 13.060 7.776 3.771 1.00 0.00 H new ATOM 0 HE3 MET A 114 12.994 6.527 5.036 1.00 0.00 H new ATOM 1717 N GLN A 115 14.992 2.906 0.413 1.00 0.00 N ATOM 1718 CA GLN A 115 16.129 2.754 -0.522 1.00 0.00 C ATOM 1719 C GLN A 115 15.701 2.427 -1.946 1.00 0.00 C ATOM 1720 O GLN A 115 16.531 2.463 -2.861 1.00 0.00 O ATOM 1721 CB GLN A 115 17.262 1.818 -0.055 1.00 0.00 C ATOM 1722 CG GLN A 115 17.960 2.227 1.242 1.00 0.00 C ATOM 1723 CD GLN A 115 17.168 1.868 2.463 1.00 0.00 C ATOM 1724 OE1 GLN A 115 16.475 0.765 2.393 1.00 0.00 O flip ATOM 1725 NE2 GLN A 115 17.202 2.555 3.483 1.00 0.00 N flip ATOM 0 H GLN A 115 14.852 2.151 1.084 1.00 0.00 H new ATOM 0 HA GLN A 115 16.566 3.753 -0.521 1.00 0.00 H new ATOM 0 HB2 GLN A 115 16.852 0.816 0.073 1.00 0.00 H new ATOM 0 HB3 GLN A 115 18.009 1.758 -0.846 1.00 0.00 H new ATOM 0 HG2 GLN A 115 18.936 1.745 1.292 1.00 0.00 H new ATOM 0 HG3 GLN A 115 18.136 3.303 1.231 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.755 3.412 3.502 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.678 2.268 4.309 1.00 0.00 H new ATOM 1734 N TYR A 116 14.418 2.083 -2.132 1.00 0.00 N ATOM 1735 CA TYR A 116 13.804 1.910 -3.437 1.00 0.00 C ATOM 1736 C TYR A 116 14.384 0.811 -4.317 1.00 0.00 C ATOM 1737 O TYR A 116 15.412 0.971 -5.004 1.00 0.00 O ATOM 1738 CB TYR A 116 13.682 3.234 -4.190 1.00 0.00 C ATOM 1739 CG TYR A 116 12.980 3.138 -5.539 1.00 0.00 C ATOM 1740 CD1 TYR A 116 11.628 2.827 -5.615 1.00 0.00 C ATOM 1741 CD2 TYR A 116 13.668 3.365 -6.731 1.00 0.00 C ATOM 1742 CE1 TYR A 116 10.983 2.749 -6.831 1.00 0.00 C ATOM 1743 CE2 TYR A 116 13.020 3.286 -7.953 1.00 0.00 C ATOM 1744 CZ TYR A 116 11.681 2.977 -7.993 1.00 0.00 C ATOM 1745 OH TYR A 116 11.034 2.895 -9.203 1.00 0.00 O ATOM 0 H TYR A 116 13.774 1.916 -1.359 1.00 0.00 H new ATOM 0 HA TYR A 116 12.805 1.546 -3.199 1.00 0.00 H new ATOM 0 HB2 TYR A 116 13.141 3.944 -3.564 1.00 0.00 H new ATOM 0 HB3 TYR A 116 14.681 3.642 -4.344 1.00 0.00 H new ATOM 0 HD1 TYR A 116 11.073 2.643 -4.707 1.00 0.00 H new ATOM 0 HD2 TYR A 116 14.720 3.606 -6.701 1.00 0.00 H new ATOM 0 HE1 TYR A 116 9.931 2.509 -6.871 1.00 0.00 H new ATOM 0 HE2 TYR A 116 13.564 3.466 -8.869 1.00 0.00 H new ATOM 0 HH TYR A 116 11.668 3.084 -9.926 1.00 0.00 H new ATOM 1755 N ASP A 117 13.731 -0.309 -4.278 1.00 0.00 N ATOM 1756 CA ASP A 117 13.983 -1.388 -5.200 1.00 0.00 C ATOM 1757 C ASP A 117 12.821 -1.405 -6.147 1.00 0.00 C ATOM 1758 O ASP A 117 11.675 -1.425 -5.674 1.00 0.00 O ATOM 1759 CB ASP A 117 14.056 -2.738 -4.484 1.00 0.00 C ATOM 1760 CG ASP A 117 15.239 -2.877 -3.573 1.00 0.00 C ATOM 1761 OD1 ASP A 117 16.368 -3.008 -4.073 1.00 0.00 O ATOM 1762 OD2 ASP A 117 15.063 -2.839 -2.342 1.00 0.00 O ATOM 0 H ASP A 117 12.997 -0.508 -3.598 1.00 0.00 H new ATOM 0 HA ASP A 117 14.937 -1.234 -5.703 1.00 0.00 H new ATOM 0 HB2 ASP A 117 13.144 -2.881 -3.904 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.088 -3.533 -5.229 1.00 0.00 H new ATOM 1767 N PRO A 118 13.059 -1.310 -7.473 1.00 0.00 N ATOM 1768 CA PRO A 118 11.977 -1.317 -8.480 1.00 0.00 C ATOM 1769 C PRO A 118 11.009 -2.481 -8.277 1.00 0.00 C ATOM 1770 O PRO A 118 9.813 -2.263 -8.087 1.00 0.00 O ATOM 1771 CB PRO A 118 12.746 -1.481 -9.800 1.00 0.00 C ATOM 1772 CG PRO A 118 14.057 -0.839 -9.535 1.00 0.00 C ATOM 1773 CD PRO A 118 14.388 -1.132 -8.098 1.00 0.00 C ATOM 0 HA PRO A 118 11.357 -0.422 -8.433 1.00 0.00 H new ATOM 0 HB2 PRO A 118 12.863 -2.532 -10.066 1.00 0.00 H new ATOM 0 HB3 PRO A 118 12.226 -0.999 -10.627 1.00 0.00 H new ATOM 0 HG2 PRO A 118 14.825 -1.235 -10.199 1.00 0.00 H new ATOM 0 HG3 PRO A 118 14.006 0.236 -9.711 1.00 0.00 H new ATOM 0 HD2 PRO A 118 15.002 -2.028 -8.001 1.00 0.00 H new ATOM 0 HD3 PRO A 118 14.943 -0.314 -7.638 1.00 0.00 H new ATOM 1781 N GLY A 119 11.539 -3.711 -8.308 1.00 0.00 N ATOM 1782 CA GLY A 119 10.758 -4.905 -7.987 1.00 0.00 C ATOM 1783 C GLY A 119 9.929 -4.807 -6.727 1.00 0.00 C ATOM 1784 O GLY A 119 8.772 -5.206 -6.723 1.00 0.00 O ATOM 0 H GLY A 119 12.510 -3.902 -8.554 1.00 0.00 H new ATOM 0 HA2 GLY A 119 10.095 -5.123 -8.824 1.00 0.00 H new ATOM 0 HA3 GLY A 119 11.439 -5.751 -7.891 1.00 0.00 H new ATOM 1788 N LEU A 120 10.492 -4.230 -5.699 1.00 0.00 N ATOM 1789 CA LEU A 120 9.801 -4.123 -4.432 1.00 0.00 C ATOM 1790 C LEU A 120 8.614 -3.156 -4.546 1.00 0.00 C ATOM 1791 O LEU A 120 7.468 -3.531 -4.276 1.00 0.00 O ATOM 1792 CB LEU A 120 10.770 -3.657 -3.358 1.00 0.00 C ATOM 1793 CG LEU A 120 10.206 -3.489 -1.958 1.00 0.00 C ATOM 1794 CD1 LEU A 120 9.626 -4.812 -1.423 1.00 0.00 C ATOM 1795 CD2 LEU A 120 11.285 -2.942 -1.048 1.00 0.00 C ATOM 0 H LEU A 120 11.428 -3.825 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 120 9.412 -5.103 -4.156 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.593 -4.370 -3.310 1.00 0.00 H new ATOM 0 HB3 LEU A 120 11.192 -2.702 -3.672 1.00 0.00 H new ATOM 0 HG LEU A 120 9.380 -2.779 -1.989 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.231 -4.656 -0.419 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.825 -5.150 -2.080 1.00 0.00 H new ATOM 0 HD13 LEU A 120 10.412 -5.567 -1.391 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.885 -2.820 -0.042 1.00 0.00 H new ATOM 0 HD22 LEU A 120 12.125 -3.636 -1.022 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.623 -1.976 -1.424 1.00 0.00 H new ATOM 1807 N PHE A 121 8.915 -1.922 -4.963 1.00 0.00 N ATOM 1808 CA PHE A 121 7.870 -0.887 -5.142 1.00 0.00 C ATOM 1809 C PHE A 121 6.764 -1.371 -6.106 1.00 0.00 C ATOM 1810 O PHE A 121 5.586 -1.023 -5.946 1.00 0.00 O ATOM 1811 CB PHE A 121 8.479 0.433 -5.633 1.00 0.00 C ATOM 1812 CG PHE A 121 7.485 1.561 -5.743 1.00 0.00 C ATOM 1813 CD1 PHE A 121 6.706 1.908 -4.657 1.00 0.00 C ATOM 1814 CD2 PHE A 121 7.334 2.269 -6.920 1.00 0.00 C ATOM 1815 CE1 PHE A 121 5.792 2.931 -4.736 1.00 0.00 C ATOM 1816 CE2 PHE A 121 6.417 3.303 -7.007 1.00 0.00 C ATOM 1817 CZ PHE A 121 5.644 3.633 -5.913 1.00 0.00 C ATOM 0 H PHE A 121 9.861 -1.609 -5.183 1.00 0.00 H new ATOM 0 HA PHE A 121 7.413 -0.708 -4.169 1.00 0.00 H new ATOM 0 HB2 PHE A 121 9.276 0.730 -4.951 1.00 0.00 H new ATOM 0 HB3 PHE A 121 8.938 0.270 -6.608 1.00 0.00 H new ATOM 0 HD1 PHE A 121 6.817 1.366 -3.729 1.00 0.00 H new ATOM 0 HD2 PHE A 121 7.936 2.014 -7.779 1.00 0.00 H new ATOM 0 HE1 PHE A 121 5.190 3.185 -3.876 1.00 0.00 H new ATOM 0 HE2 PHE A 121 6.307 3.851 -7.931 1.00 0.00 H new ATOM 0 HZ PHE A 121 4.926 4.437 -5.978 1.00 0.00 H new ATOM 1827 N ALA A 122 7.145 -2.162 -7.082 1.00 0.00 N ATOM 1828 CA ALA A 122 6.202 -2.720 -8.030 1.00 0.00 C ATOM 1829 C ALA A 122 5.285 -3.726 -7.363 1.00 0.00 C ATOM 1830 O ALA A 122 4.054 -3.582 -7.433 1.00 0.00 O ATOM 1831 CB ALA A 122 6.915 -3.357 -9.217 1.00 0.00 C ATOM 0 H ALA A 122 8.114 -2.438 -7.243 1.00 0.00 H new ATOM 0 HA ALA A 122 5.594 -1.896 -8.403 1.00 0.00 H new ATOM 0 HB1 ALA A 122 6.178 -3.765 -9.908 1.00 0.00 H new ATOM 0 HB2 ALA A 122 7.514 -2.604 -9.729 1.00 0.00 H new ATOM 0 HB3 ALA A 122 7.564 -4.158 -8.864 1.00 0.00 H new ATOM 1837 N GLN A 123 5.862 -4.719 -6.675 1.00 0.00 N ATOM 1838 CA GLN A 123 5.060 -5.759 -6.076 1.00 0.00 C ATOM 1839 C GLN A 123 4.187 -5.231 -4.957 1.00 0.00 C ATOM 1840 O GLN A 123 3.027 -5.629 -4.842 1.00 0.00 O ATOM 1841 CB GLN A 123 5.911 -6.928 -5.601 1.00 0.00 C ATOM 1842 CG GLN A 123 6.704 -7.607 -6.705 1.00 0.00 C ATOM 1843 CD GLN A 123 5.845 -8.068 -7.869 1.00 0.00 C ATOM 1844 OE1 GLN A 123 4.663 -8.395 -7.719 1.00 0.00 O ATOM 1845 NE2 GLN A 123 6.434 -8.120 -9.036 1.00 0.00 N ATOM 0 H GLN A 123 6.867 -4.812 -6.528 1.00 0.00 H new ATOM 0 HA GLN A 123 4.398 -6.129 -6.859 1.00 0.00 H new ATOM 0 HB2 GLN A 123 6.603 -6.573 -4.837 1.00 0.00 H new ATOM 0 HB3 GLN A 123 5.264 -7.666 -5.127 1.00 0.00 H new ATOM 0 HG2 GLN A 123 7.463 -6.917 -7.074 1.00 0.00 H new ATOM 0 HG3 GLN A 123 7.230 -8.466 -6.289 1.00 0.00 H new ATOM 0 HE21 GLN A 123 7.411 -7.843 -9.127 1.00 0.00 H new ATOM 0 HE22 GLN A 123 5.916 -8.437 -9.855 1.00 0.00 H new ATOM 1854 N ILE A 124 4.718 -4.320 -4.142 1.00 0.00 N ATOM 1855 CA ILE A 124 3.923 -3.748 -3.064 1.00 0.00 C ATOM 1856 C ILE A 124 2.738 -2.978 -3.589 1.00 0.00 C ATOM 1857 O ILE A 124 1.646 -3.092 -3.047 1.00 0.00 O ATOM 1858 CB ILE A 124 4.732 -2.906 -2.006 1.00 0.00 C ATOM 1859 CG1 ILE A 124 5.354 -1.678 -2.625 1.00 0.00 C ATOM 1860 CG2 ILE A 124 5.828 -3.756 -1.364 1.00 0.00 C ATOM 1861 CD1 ILE A 124 5.915 -0.704 -1.617 1.00 0.00 C ATOM 0 H ILE A 124 5.674 -3.970 -4.207 1.00 0.00 H new ATOM 0 HA ILE A 124 3.560 -4.614 -2.510 1.00 0.00 H new ATOM 0 HB ILE A 124 4.022 -2.587 -1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 124 6.152 -1.988 -3.300 1.00 0.00 H new ATOM 0 HG13 ILE A 124 4.604 -1.168 -3.230 1.00 0.00 H new ATOM 0 HG21 ILE A 124 6.375 -3.156 -0.637 1.00 0.00 H new ATOM 0 HG22 ILE A 124 5.377 -4.612 -0.862 1.00 0.00 H new ATOM 0 HG23 ILE A 124 6.515 -4.107 -2.134 1.00 0.00 H new ATOM 0 HD11 ILE A 124 6.344 0.152 -2.138 1.00 0.00 H new ATOM 0 HD12 ILE A 124 5.117 -0.364 -0.957 1.00 0.00 H new ATOM 0 HD13 ILE A 124 6.689 -1.196 -1.028 1.00 0.00 H new ATOM 1873 N GLN A 125 2.926 -2.259 -4.673 1.00 0.00 N ATOM 1874 CA GLN A 125 1.848 -1.496 -5.238 1.00 0.00 C ATOM 1875 C GLN A 125 0.778 -2.421 -5.798 1.00 0.00 C ATOM 1876 O GLN A 125 -0.398 -2.347 -5.400 1.00 0.00 O ATOM 1877 CB GLN A 125 2.329 -0.595 -6.341 1.00 0.00 C ATOM 1878 CG GLN A 125 1.231 0.312 -6.814 1.00 0.00 C ATOM 1879 CD GLN A 125 1.588 1.158 -7.995 1.00 0.00 C ATOM 1880 OE1 GLN A 125 2.406 0.780 -8.849 1.00 0.00 O ATOM 1881 NE2 GLN A 125 0.977 2.296 -8.063 1.00 0.00 N ATOM 0 H GLN A 125 3.811 -2.190 -5.175 1.00 0.00 H new ATOM 0 HA GLN A 125 1.433 -0.885 -4.436 1.00 0.00 H new ATOM 0 HB2 GLN A 125 3.170 0.001 -5.987 1.00 0.00 H new ATOM 0 HB3 GLN A 125 2.692 -1.197 -7.174 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.361 -0.294 -7.067 1.00 0.00 H new ATOM 0 HG3 GLN A 125 0.937 0.964 -5.992 1.00 0.00 H new ATOM 0 HE21 GLN A 125 0.313 2.562 -7.336 1.00 0.00 H new ATOM 0 HE22 GLN A 125 1.159 2.927 -8.843 1.00 0.00 H new ATOM 1890 N ALA A 126 1.207 -3.311 -6.687 1.00 0.00 N ATOM 1891 CA ALA A 126 0.319 -4.218 -7.383 1.00 0.00 C ATOM 1892 C ALA A 126 -0.444 -5.118 -6.428 1.00 0.00 C ATOM 1893 O ALA A 126 -1.666 -5.257 -6.548 1.00 0.00 O ATOM 1894 CB ALA A 126 1.087 -5.041 -8.405 1.00 0.00 C ATOM 0 H ALA A 126 2.189 -3.419 -6.942 1.00 0.00 H new ATOM 0 HA ALA A 126 -0.418 -3.610 -7.907 1.00 0.00 H new ATOM 0 HB1 ALA A 126 0.402 -5.716 -8.917 1.00 0.00 H new ATOM 0 HB2 ALA A 126 1.552 -4.376 -9.132 1.00 0.00 H new ATOM 0 HB3 ALA A 126 1.858 -5.622 -7.899 1.00 0.00 H new ATOM 1900 N ALA A 127 0.247 -5.673 -5.440 1.00 0.00 N ATOM 1901 CA ALA A 127 -0.388 -6.605 -4.537 1.00 0.00 C ATOM 1902 C ALA A 127 -1.380 -5.900 -3.640 1.00 0.00 C ATOM 1903 O ALA A 127 -2.476 -6.430 -3.380 1.00 0.00 O ATOM 1904 CB ALA A 127 0.637 -7.362 -3.720 1.00 0.00 C ATOM 0 H ALA A 127 1.233 -5.493 -5.251 1.00 0.00 H new ATOM 0 HA ALA A 127 -0.934 -7.330 -5.140 1.00 0.00 H new ATOM 0 HB1 ALA A 127 0.128 -8.055 -3.050 1.00 0.00 H new ATOM 0 HB2 ALA A 127 1.295 -7.919 -4.387 1.00 0.00 H new ATOM 0 HB3 ALA A 127 1.227 -6.658 -3.133 1.00 0.00 H new ATOM 1910 N ALA A 128 -1.018 -4.694 -3.185 1.00 0.00 N ATOM 1911 CA ALA A 128 -1.880 -3.932 -2.320 1.00 0.00 C ATOM 1912 C ALA A 128 -3.184 -3.631 -3.002 1.00 0.00 C ATOM 1913 O ALA A 128 -4.168 -4.099 -2.574 1.00 0.00 O ATOM 1914 CB ALA A 128 -1.226 -2.652 -1.840 1.00 0.00 C ATOM 0 H ALA A 128 -0.133 -4.239 -3.410 1.00 0.00 H new ATOM 0 HA ALA A 128 -2.073 -4.546 -1.441 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -1.916 -2.112 -1.191 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -0.319 -2.893 -1.286 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -0.973 -2.029 -2.698 1.00 0.00 H new ATOM 1920 N THR A 129 -3.170 -2.919 -4.098 1.00 0.00 N ATOM 1921 CA THR A 129 -4.432 -2.549 -4.754 1.00 0.00 C ATOM 1922 C THR A 129 -5.288 -3.801 -5.166 1.00 0.00 C ATOM 1923 O THR A 129 -6.564 -3.793 -5.061 1.00 0.00 O ATOM 1924 CB THR A 129 -4.193 -1.589 -5.969 1.00 0.00 C ATOM 1925 OG1 THR A 129 -5.433 -1.257 -6.609 1.00 0.00 O ATOM 1926 CG2 THR A 129 -3.240 -2.189 -6.986 1.00 0.00 C ATOM 0 H THR A 129 -2.326 -2.581 -4.561 1.00 0.00 H new ATOM 0 HA THR A 129 -5.016 -2.003 -4.013 1.00 0.00 H new ATOM 0 HB THR A 129 -3.739 -0.682 -5.571 1.00 0.00 H new ATOM 0 HG1 THR A 129 -5.407 -1.550 -7.544 1.00 0.00 H new ATOM 0 HG21 THR A 129 -3.102 -1.491 -7.812 1.00 0.00 H new ATOM 0 HG22 THR A 129 -2.278 -2.385 -6.512 1.00 0.00 H new ATOM 0 HG23 THR A 129 -3.654 -3.123 -7.366 1.00 0.00 H new ATOM 1934 N LYS A 130 -4.582 -4.914 -5.471 1.00 0.00 N ATOM 1935 CA LYS A 130 -5.176 -6.154 -5.979 1.00 0.00 C ATOM 1936 C LYS A 130 -6.051 -6.746 -4.891 1.00 0.00 C ATOM 1937 O LYS A 130 -7.033 -7.427 -5.146 1.00 0.00 O ATOM 1938 CB LYS A 130 -4.044 -7.118 -6.337 1.00 0.00 C ATOM 1939 CG LYS A 130 -4.453 -8.364 -7.071 1.00 0.00 C ATOM 1940 CD LYS A 130 -3.240 -9.219 -7.364 1.00 0.00 C ATOM 1941 CE LYS A 130 -3.584 -10.431 -8.199 1.00 0.00 C ATOM 1942 NZ LYS A 130 -4.105 -10.062 -9.543 1.00 0.00 N ATOM 0 H LYS A 130 -3.569 -4.968 -5.366 1.00 0.00 H new ATOM 0 HA LYS A 130 -5.783 -5.967 -6.865 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -3.316 -6.583 -6.946 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -3.537 -7.411 -5.418 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.169 -8.928 -6.474 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -4.954 -8.099 -8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -2.493 -8.621 -7.886 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -2.790 -9.542 -6.425 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -2.697 -11.054 -8.314 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -4.328 -11.031 -7.675 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -4.103 -10.900 -10.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -5.076 -9.702 -9.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -3.500 -9.326 -9.960 1.00 0.00 H new ATOM 1956 N ALA A 131 -5.638 -6.485 -3.697 1.00 0.00 N ATOM 1957 CA ALA A 131 -6.338 -6.775 -2.506 1.00 0.00 C ATOM 1958 C ALA A 131 -7.351 -5.678 -2.274 1.00 0.00 C ATOM 1959 O ALA A 131 -8.555 -5.917 -2.379 1.00 0.00 O ATOM 1960 CB ALA A 131 -5.286 -6.807 -1.436 1.00 0.00 C ATOM 0 H ALA A 131 -4.741 -6.033 -3.523 1.00 0.00 H new ATOM 0 HA ALA A 131 -6.884 -7.718 -2.530 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -5.751 -7.027 -0.475 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.553 -7.579 -1.670 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -4.789 -5.838 -1.385 1.00 0.00 H new ATOM 1966 N TRP A 132 -6.848 -4.462 -2.149 1.00 0.00 N ATOM 1967 CA TRP A 132 -7.566 -3.267 -1.735 1.00 0.00 C ATOM 1968 C TRP A 132 -8.546 -2.722 -2.790 1.00 0.00 C ATOM 1969 O TRP A 132 -8.775 -1.537 -2.877 1.00 0.00 O ATOM 1970 CB TRP A 132 -6.616 -2.143 -1.293 1.00 0.00 C ATOM 1971 CG TRP A 132 -5.721 -2.515 -0.157 1.00 0.00 C ATOM 1972 CD1 TRP A 132 -5.234 -3.715 0.059 1.00 0.00 C ATOM 1973 CD2 TRP A 132 -5.225 -1.705 0.905 1.00 0.00 C ATOM 1974 NE1 TRP A 132 -4.388 -3.735 1.045 1.00 0.00 N ATOM 1975 CE2 TRP A 132 -4.363 -2.528 1.633 1.00 0.00 C ATOM 1976 CE3 TRP A 132 -5.378 -0.374 1.312 1.00 0.00 C ATOM 1977 CZ2 TRP A 132 -3.664 -2.086 2.718 1.00 0.00 C ATOM 1978 CZ3 TRP A 132 -4.689 0.037 2.395 1.00 0.00 C ATOM 1979 CH2 TRP A 132 -3.843 -0.814 3.072 1.00 0.00 C ATOM 0 H TRP A 132 -5.866 -4.270 -2.346 1.00 0.00 H new ATOM 0 HA TRP A 132 -8.160 -3.597 -0.883 1.00 0.00 H new ATOM 0 HB2 TRP A 132 -6.002 -1.845 -2.143 1.00 0.00 H new ATOM 0 HB3 TRP A 132 -7.207 -1.273 -1.006 1.00 0.00 H new ATOM 0 HD1 TRP A 132 -5.506 -4.587 -0.518 1.00 0.00 H new ATOM 0 HE1 TRP A 132 -3.830 -4.541 1.328 1.00 0.00 H new ATOM 0 HE3 TRP A 132 -6.027 0.302 0.775 1.00 0.00 H new ATOM 0 HZ2 TRP A 132 -2.997 -2.736 3.264 1.00 0.00 H new ATOM 0 HZ3 TRP A 132 -4.802 1.054 2.739 1.00 0.00 H new ATOM 0 HH2 TRP A 132 -3.302 -0.434 3.926 1.00 0.00 H new ATOM 1990 N ARG A 133 -9.074 -3.555 -3.608 1.00 0.00 N ATOM 1991 CA ARG A 133 -10.117 -3.099 -4.527 1.00 0.00 C ATOM 1992 C ARG A 133 -11.605 -3.670 -4.408 1.00 0.00 C ATOM 1993 O ARG A 133 -12.591 -2.919 -4.503 1.00 0.00 O ATOM 1994 CB ARG A 133 -9.577 -3.011 -5.970 1.00 0.00 C ATOM 1995 CG ARG A 133 -10.626 -2.950 -7.069 1.00 0.00 C ATOM 1996 CD ARG A 133 -11.128 -4.326 -7.424 1.00 0.00 C ATOM 1997 NE ARG A 133 -12.562 -4.334 -7.756 1.00 0.00 N ATOM 1998 CZ ARG A 133 -13.059 -4.987 -8.832 1.00 0.00 C ATOM 1999 NH1 ARG A 133 -12.307 -5.157 -9.921 1.00 0.00 N ATOM 2000 NH2 ARG A 133 -14.315 -5.402 -8.850 1.00 0.00 N ATOM 0 H ARG A 133 -8.826 -4.542 -3.681 1.00 0.00 H new ATOM 0 HA ARG A 133 -10.332 -2.100 -4.148 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -8.945 -2.126 -6.048 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -8.938 -3.875 -6.152 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -11.461 -2.329 -6.744 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -10.201 -2.476 -7.954 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -10.560 -4.709 -8.272 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -10.948 -5.002 -6.588 1.00 0.00 H new ATOM 0 HE ARG A 133 -13.207 -3.827 -7.150 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -11.354 -4.794 -9.944 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -12.685 -5.650 -10.730 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -14.920 -5.231 -8.047 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -14.678 -5.893 -9.667 1.00 0.00 H new ATOM 2014 N LYS A 134 -11.722 -4.936 -4.194 1.00 0.00 N ATOM 2015 CA LYS A 134 -12.935 -5.740 -4.591 1.00 0.00 C ATOM 2016 C LYS A 134 -14.164 -5.903 -3.601 1.00 0.00 C ATOM 2017 O LYS A 134 -14.747 -6.979 -3.556 1.00 0.00 O ATOM 2018 CB LYS A 134 -12.408 -7.094 -4.970 1.00 0.00 C ATOM 2019 CG LYS A 134 -11.867 -7.791 -3.771 1.00 0.00 C ATOM 2020 CD LYS A 134 -11.051 -8.975 -4.093 1.00 0.00 C ATOM 2021 CE LYS A 134 -9.716 -8.571 -4.618 1.00 0.00 C ATOM 2022 NZ LYS A 134 -8.921 -9.721 -5.107 1.00 0.00 N ATOM 0 H LYS A 134 -10.998 -5.491 -3.737 1.00 0.00 H new ATOM 0 HA LYS A 134 -13.408 -5.154 -5.380 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -13.204 -7.690 -5.417 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -11.626 -6.990 -5.722 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -11.263 -7.090 -3.196 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -12.697 -8.095 -3.133 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -10.925 -9.589 -3.201 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -11.567 -9.588 -4.832 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -9.851 -7.856 -5.430 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -9.161 -8.059 -3.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -7.912 -9.470 -5.108 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -9.074 -10.539 -4.483 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -9.219 -9.963 -6.074 1.00 0.00 H new ATOM 2036 N LEU A 135 -14.601 -4.892 -2.868 1.00 0.00 N ATOM 2037 CA LEU A 135 -15.790 -5.155 -1.947 1.00 0.00 C ATOM 2038 C LEU A 135 -17.060 -5.059 -2.805 1.00 0.00 C ATOM 2039 O LEU A 135 -16.925 -4.799 -3.979 1.00 0.00 O ATOM 2040 CB LEU A 135 -15.930 -4.151 -0.746 1.00 0.00 C ATOM 2041 CG LEU A 135 -14.721 -3.800 0.085 1.00 0.00 C ATOM 2042 CD1 LEU A 135 -13.702 -4.898 0.154 1.00 0.00 C ATOM 2043 CD2 LEU A 135 -14.150 -2.513 -0.347 1.00 0.00 C ATOM 0 H LEU A 135 -14.219 -3.946 -2.858 1.00 0.00 H new ATOM 0 HA LEU A 135 -15.636 -6.137 -1.500 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -16.330 -3.220 -1.146 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -16.682 -4.557 -0.070 1.00 0.00 H new ATOM 0 HG LEU A 135 -15.063 -3.683 1.113 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -12.861 -4.576 0.768 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -14.154 -5.786 0.595 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -13.350 -5.131 -0.851 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -13.279 -2.278 0.265 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -13.851 -2.580 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -14.897 -1.727 -0.233 1.00 0.00 H new ATOM 2055 N PRO A 136 -18.290 -5.347 -2.280 1.00 0.00 N ATOM 2056 CA PRO A 136 -19.545 -5.105 -3.034 1.00 0.00 C ATOM 2057 C PRO A 136 -19.666 -3.662 -3.634 1.00 0.00 C ATOM 2058 O PRO A 136 -19.073 -3.359 -4.651 1.00 0.00 O ATOM 2059 CB PRO A 136 -20.665 -5.406 -2.004 1.00 0.00 C ATOM 2060 CG PRO A 136 -19.964 -5.598 -0.697 1.00 0.00 C ATOM 2061 CD PRO A 136 -18.578 -6.057 -1.019 1.00 0.00 C ATOM 0 HA PRO A 136 -19.597 -5.738 -3.920 1.00 0.00 H new ATOM 0 HB2 PRO A 136 -21.379 -4.584 -1.949 1.00 0.00 H new ATOM 0 HB3 PRO A 136 -21.226 -6.298 -2.283 1.00 0.00 H new ATOM 0 HG2 PRO A 136 -19.942 -4.668 -0.129 1.00 0.00 H new ATOM 0 HG3 PRO A 136 -20.483 -6.334 -0.083 1.00 0.00 H new ATOM 0 HD2 PRO A 136 -17.870 -5.792 -0.234 1.00 0.00 H new ATOM 0 HD3 PRO A 136 -18.527 -7.139 -1.142 1.00 0.00 H new