USER MOD reduce.3.24.130724 H: found=0, std=0, add=603, rem=0, adj=10 USER MOD reduce.3.24.130724 removed 603 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 95 LYS NZ :NH3+ -118:sc= -0.0709 (180deg=-1.06) USER MOD Set 1.2: A 96 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 46:sc= 0.888 USER MOD Single : A 79 ASN : amide:sc= -1.05 K(o=-1.1,f=-0.3) USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -170:sc= 0 (180deg=-0.142) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 151:sc= 0 (180deg=-0.689) USER MOD Single : A 105 HIS : no HD1:sc= -2.22! K(o=-2.2!,f=-1.2) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 LYS NZ :NH3+ -160:sc= -0.0446 (180deg=-0.354) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.256 USER MOD Single : A 119 THR OG1 : rot 180:sc= 0.00183 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 ASN : amide:sc= -5.84! C(o=-5.8!,f=-5.4!) USER MOD Single : A 131 MET CE :methyl -118:sc= -0.554 (180deg=-3.51!) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 GLN : amide:sc= -0.228 X(o=-0.23,f=-0.031) USER MOD ----------------------------------------------------------------- ATOM 199 N SER A 73 -4.973 2.832 7.004 1.00 0.00 N ATOM 200 CA SER A 73 -3.611 2.779 6.485 1.00 0.00 C ATOM 201 C SER A 73 -3.568 2.052 5.144 1.00 0.00 C ATOM 202 O SER A 73 -3.206 0.878 5.074 1.00 0.00 O ATOM 203 CB SER A 73 -2.689 2.080 7.486 1.00 0.00 C ATOM 204 OG SER A 73 -3.096 0.741 7.706 1.00 0.00 O ATOM 0 HA SER A 73 -3.265 3.802 6.335 1.00 0.00 H new ATOM 0 HB2 SER A 73 -1.665 2.095 7.114 1.00 0.00 H new ATOM 0 HB3 SER A 73 -2.693 2.624 8.430 1.00 0.00 H new ATOM 0 HG SER A 73 -3.283 0.310 6.846 1.00 0.00 H new ATOM 210 N ARG A 74 -3.941 2.760 4.083 1.00 0.00 N ATOM 211 CA ARG A 74 -3.947 2.184 2.744 1.00 0.00 C ATOM 212 C ARG A 74 -2.885 2.839 1.865 1.00 0.00 C ATOM 213 O ARG A 74 -2.831 4.064 1.749 1.00 0.00 O ATOM 214 CB ARG A 74 -5.326 2.345 2.102 1.00 0.00 C ATOM 215 CG ARG A 74 -5.550 1.437 0.904 1.00 0.00 C ATOM 216 CD ARG A 74 -7.032 1.236 0.626 1.00 0.00 C ATOM 217 NE ARG A 74 -7.274 0.096 -0.253 1.00 0.00 N ATOM 218 CZ ARG A 74 -8.464 -0.196 -0.767 1.00 0.00 C ATOM 219 NH1 ARG A 74 -9.514 0.565 -0.491 1.00 0.00 N ATOM 220 NH2 ARG A 74 -8.605 -1.251 -1.560 1.00 0.00 N ATOM 0 H ARG A 74 -4.243 3.733 4.125 1.00 0.00 H new ATOM 0 HA ARG A 74 -3.717 1.122 2.832 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -6.092 2.141 2.850 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -5.453 3.382 1.790 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -5.069 1.867 0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -5.078 0.471 1.085 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -7.560 1.086 1.568 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -7.441 2.138 0.171 1.00 0.00 H new ATOM 0 HE ARG A 74 -6.487 -0.509 -0.485 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -9.410 1.377 0.117 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -10.426 0.338 -0.887 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.799 -1.838 -1.775 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -9.519 -1.474 -1.954 1.00 0.00 H new ATOM 234 N LEU A 75 -2.044 2.016 1.250 1.00 0.00 N ATOM 235 CA LEU A 75 -0.983 2.516 0.382 1.00 0.00 C ATOM 236 C LEU A 75 -1.273 2.184 -1.079 1.00 0.00 C ATOM 237 O LEU A 75 -1.688 1.071 -1.403 1.00 0.00 O ATOM 238 CB LEU A 75 0.364 1.919 0.794 1.00 0.00 C ATOM 239 CG LEU A 75 1.048 2.572 1.995 1.00 0.00 C ATOM 240 CD1 LEU A 75 2.160 1.682 2.526 1.00 0.00 C ATOM 241 CD2 LEU A 75 1.593 3.942 1.618 1.00 0.00 C ATOM 0 H LEU A 75 -2.075 1.000 1.336 1.00 0.00 H new ATOM 0 HA LEU A 75 -0.941 3.600 0.488 1.00 0.00 H new ATOM 0 HB2 LEU A 75 0.218 0.862 1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.040 1.976 -0.059 1.00 0.00 H new ATOM 0 HG LEU A 75 0.307 2.702 2.784 1.00 0.00 H new ATOM 0 HD11 LEU A 75 2.635 2.164 3.381 1.00 0.00 H new ATOM 0 HD12 LEU A 75 1.743 0.724 2.835 1.00 0.00 H new ATOM 0 HD13 LEU A 75 2.901 1.519 1.743 1.00 0.00 H new ATOM 0 HD21 LEU A 75 2.077 4.392 2.485 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.319 3.836 0.812 1.00 0.00 H new ATOM 0 HD23 LEU A 75 0.774 4.581 1.287 1.00 0.00 H new ATOM 253 N PHE A 76 -1.051 3.157 -1.956 1.00 0.00 N ATOM 254 CA PHE A 76 -1.288 2.968 -3.383 1.00 0.00 C ATOM 255 C PHE A 76 0.021 2.701 -4.120 1.00 0.00 C ATOM 256 O PHE A 76 0.955 3.500 -4.060 1.00 0.00 O ATOM 257 CB PHE A 76 -1.977 4.200 -3.974 1.00 0.00 C ATOM 258 CG PHE A 76 -1.898 4.269 -5.473 1.00 0.00 C ATOM 259 CD1 PHE A 76 -2.429 3.257 -6.256 1.00 0.00 C ATOM 260 CD2 PHE A 76 -1.292 5.347 -6.098 1.00 0.00 C ATOM 261 CE1 PHE A 76 -2.358 3.318 -7.635 1.00 0.00 C ATOM 262 CE2 PHE A 76 -1.219 5.413 -7.477 1.00 0.00 C ATOM 263 CZ PHE A 76 -1.751 4.397 -8.246 1.00 0.00 C ATOM 0 H PHE A 76 -0.708 4.084 -1.704 1.00 0.00 H new ATOM 0 HA PHE A 76 -1.938 2.102 -3.507 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -3.025 4.200 -3.673 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -1.524 5.097 -3.552 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -2.904 2.410 -5.783 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -0.872 6.144 -5.502 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -2.777 2.523 -8.234 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -0.746 6.259 -7.953 1.00 0.00 H new ATOM 0 HZ PHE A 76 -1.692 4.446 -9.323 1.00 0.00 H new ATOM 273 N VAL A 77 0.081 1.570 -4.816 1.00 0.00 N ATOM 274 CA VAL A 77 1.274 1.195 -5.566 1.00 0.00 C ATOM 275 C VAL A 77 0.968 1.060 -7.054 1.00 0.00 C ATOM 276 O VAL A 77 0.249 0.153 -7.470 1.00 0.00 O ATOM 277 CB VAL A 77 1.867 -0.130 -5.052 1.00 0.00 C ATOM 278 CG1 VAL A 77 3.223 -0.391 -5.691 1.00 0.00 C ATOM 279 CG2 VAL A 77 1.977 -0.111 -3.535 1.00 0.00 C ATOM 0 H VAL A 77 -0.683 0.897 -4.876 1.00 0.00 H new ATOM 0 HA VAL A 77 2.004 1.991 -5.419 1.00 0.00 H new ATOM 0 HB VAL A 77 1.197 -0.942 -5.334 1.00 0.00 H new ATOM 0 HG11 VAL A 77 3.627 -1.331 -5.316 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.110 -0.451 -6.773 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.905 0.422 -5.442 1.00 0.00 H new ATOM 0 HG21 VAL A 77 2.398 -1.055 -3.189 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.625 0.710 -3.227 1.00 0.00 H new ATOM 0 HG23 VAL A 77 0.987 0.026 -3.100 1.00 0.00 H new ATOM 289 N GLY A 78 1.520 1.969 -7.851 1.00 0.00 N ATOM 290 CA GLY A 78 1.295 1.934 -9.284 1.00 0.00 C ATOM 291 C GLY A 78 2.537 1.534 -10.057 1.00 0.00 C ATOM 292 O GLY A 78 3.612 1.382 -9.479 1.00 0.00 O ATOM 0 H GLY A 78 2.119 2.729 -7.530 1.00 0.00 H new ATOM 0 HA2 GLY A 78 0.491 1.232 -9.505 1.00 0.00 H new ATOM 0 HA3 GLY A 78 0.962 2.916 -9.620 1.00 0.00 H new ATOM 296 N ASN A 79 2.388 1.363 -11.366 1.00 0.00 N ATOM 297 CA ASN A 79 3.506 0.976 -12.218 1.00 0.00 C ATOM 298 C ASN A 79 4.006 -0.420 -11.860 1.00 0.00 C ATOM 299 O ASN A 79 5.199 -0.709 -11.960 1.00 0.00 O ATOM 300 CB ASN A 79 4.647 1.987 -12.088 1.00 0.00 C ATOM 301 CG ASN A 79 5.553 1.996 -13.304 1.00 0.00 C ATOM 302 OD1 ASN A 79 6.365 1.091 -13.493 1.00 0.00 O ATOM 303 ND2 ASN A 79 5.419 3.024 -14.135 1.00 0.00 N ATOM 0 H ASN A 79 1.504 1.486 -11.860 1.00 0.00 H new ATOM 0 HA ASN A 79 3.156 0.963 -13.250 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.231 2.984 -11.941 1.00 0.00 H new ATOM 0 HB3 ASN A 79 5.236 1.754 -11.201 1.00 0.00 H new ATOM 0 HD21 ASN A 79 6.003 3.085 -14.969 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.732 3.752 -13.939 1.00 0.00 H new ATOM 310 N LEU A 80 3.086 -1.283 -11.444 1.00 0.00 N ATOM 311 CA LEU A 80 3.431 -2.650 -11.071 1.00 0.00 C ATOM 312 C LEU A 80 3.806 -3.471 -12.301 1.00 0.00 C ATOM 313 O LEU A 80 3.144 -3.420 -13.337 1.00 0.00 O ATOM 314 CB LEU A 80 2.263 -3.311 -10.339 1.00 0.00 C ATOM 315 CG LEU A 80 2.024 -2.850 -8.900 1.00 0.00 C ATOM 316 CD1 LEU A 80 0.613 -3.200 -8.454 1.00 0.00 C ATOM 317 CD2 LEU A 80 3.051 -3.471 -7.964 1.00 0.00 C ATOM 0 H LEU A 80 2.095 -1.060 -11.356 1.00 0.00 H new ATOM 0 HA LEU A 80 4.293 -2.612 -10.405 1.00 0.00 H new ATOM 0 HB2 LEU A 80 1.353 -3.132 -10.912 1.00 0.00 H new ATOM 0 HB3 LEU A 80 2.428 -4.388 -10.331 1.00 0.00 H new ATOM 0 HG LEU A 80 2.136 -1.766 -8.863 1.00 0.00 H new ATOM 0 HD11 LEU A 80 0.462 -2.864 -7.428 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -0.108 -2.708 -9.107 1.00 0.00 H new ATOM 0 HD13 LEU A 80 0.472 -4.280 -8.507 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.866 -3.132 -6.945 1.00 0.00 H new ATOM 0 HD22 LEU A 80 2.971 -4.557 -8.005 1.00 0.00 H new ATOM 0 HD23 LEU A 80 4.052 -3.169 -8.271 1.00 0.00 H new ATOM 329 N PRO A 81 4.892 -4.250 -12.184 1.00 0.00 N ATOM 330 CA PRO A 81 5.378 -5.100 -13.276 1.00 0.00 C ATOM 331 C PRO A 81 4.445 -6.274 -13.555 1.00 0.00 C ATOM 332 O PRO A 81 3.639 -6.672 -12.713 1.00 0.00 O ATOM 333 CB PRO A 81 6.729 -5.601 -12.760 1.00 0.00 C ATOM 334 CG PRO A 81 6.615 -5.539 -11.276 1.00 0.00 C ATOM 335 CD PRO A 81 5.729 -4.361 -10.978 1.00 0.00 C ATOM 0 HA PRO A 81 5.441 -4.557 -14.219 1.00 0.00 H new ATOM 0 HB2 PRO A 81 6.930 -6.617 -13.099 1.00 0.00 H new ATOM 0 HB3 PRO A 81 7.547 -4.977 -13.121 1.00 0.00 H new ATOM 0 HG2 PRO A 81 6.187 -6.459 -10.879 1.00 0.00 H new ATOM 0 HG3 PRO A 81 7.595 -5.417 -10.814 1.00 0.00 H new ATOM 0 HD2 PRO A 81 5.127 -4.527 -10.085 1.00 0.00 H new ATOM 0 HD3 PRO A 81 6.310 -3.455 -10.807 1.00 0.00 H new ATOM 343 N PRO A 82 4.555 -6.843 -14.764 1.00 0.00 N ATOM 344 CA PRO A 82 3.730 -7.980 -15.182 1.00 0.00 C ATOM 345 C PRO A 82 4.090 -9.262 -14.438 1.00 0.00 C ATOM 346 O PRO A 82 3.371 -10.258 -14.514 1.00 0.00 O ATOM 347 CB PRO A 82 4.048 -8.121 -16.673 1.00 0.00 C ATOM 348 CG PRO A 82 5.407 -7.530 -16.828 1.00 0.00 C ATOM 349 CD PRO A 82 5.494 -6.420 -15.817 1.00 0.00 C ATOM 0 HA PRO A 82 2.673 -7.815 -14.971 1.00 0.00 H new ATOM 0 HB2 PRO A 82 4.033 -9.166 -16.984 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.315 -7.595 -17.285 1.00 0.00 H new ATOM 0 HG2 PRO A 82 6.180 -8.278 -16.653 1.00 0.00 H new ATOM 0 HG3 PRO A 82 5.554 -7.150 -17.839 1.00 0.00 H new ATOM 0 HD2 PRO A 82 6.507 -6.307 -15.430 1.00 0.00 H new ATOM 0 HD3 PRO A 82 5.209 -5.460 -16.248 1.00 0.00 H new ATOM 357 N ASP A 83 5.207 -9.229 -13.719 1.00 0.00 N ATOM 358 CA ASP A 83 5.662 -10.388 -12.960 1.00 0.00 C ATOM 359 C ASP A 83 5.391 -10.201 -11.470 1.00 0.00 C ATOM 360 O ASP A 83 6.166 -10.653 -10.627 1.00 0.00 O ATOM 361 CB ASP A 83 7.155 -10.624 -13.193 1.00 0.00 C ATOM 362 CG ASP A 83 7.440 -11.219 -14.558 1.00 0.00 C ATOM 363 OD1 ASP A 83 6.493 -11.730 -15.192 1.00 0.00 O ATOM 364 OD2 ASP A 83 8.610 -11.174 -14.993 1.00 0.00 O ATOM 0 H ASP A 83 5.814 -8.412 -13.646 1.00 0.00 H new ATOM 0 HA ASP A 83 5.106 -11.259 -13.307 1.00 0.00 H new ATOM 0 HB2 ASP A 83 7.689 -9.679 -13.093 1.00 0.00 H new ATOM 0 HB3 ASP A 83 7.539 -11.291 -12.421 1.00 0.00 H new ATOM 369 N ILE A 84 4.287 -9.533 -11.154 1.00 0.00 N ATOM 370 CA ILE A 84 3.914 -9.287 -9.766 1.00 0.00 C ATOM 371 C ILE A 84 2.667 -10.077 -9.383 1.00 0.00 C ATOM 372 O ILE A 84 1.657 -10.044 -10.087 1.00 0.00 O ATOM 373 CB ILE A 84 3.659 -7.790 -9.508 1.00 0.00 C ATOM 374 CG1 ILE A 84 3.379 -7.547 -8.024 1.00 0.00 C ATOM 375 CG2 ILE A 84 2.499 -7.297 -10.360 1.00 0.00 C ATOM 376 CD1 ILE A 84 4.630 -7.331 -7.201 1.00 0.00 C ATOM 0 H ILE A 84 3.635 -9.152 -11.840 1.00 0.00 H new ATOM 0 HA ILE A 84 4.752 -9.616 -9.152 1.00 0.00 H new ATOM 0 HB ILE A 84 4.552 -7.230 -9.786 1.00 0.00 H new ATOM 0 HG12 ILE A 84 2.732 -6.676 -7.922 1.00 0.00 H new ATOM 0 HG13 ILE A 84 2.832 -8.399 -7.621 1.00 0.00 H new ATOM 0 HG21 ILE A 84 2.330 -6.238 -10.167 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.735 -7.441 -11.414 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.599 -7.859 -10.110 1.00 0.00 H new ATOM 0 HD11 ILE A 84 4.356 -7.165 -6.159 1.00 0.00 H new ATOM 0 HD12 ILE A 84 5.269 -8.211 -7.272 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.168 -6.461 -7.578 1.00 0.00 H new ATOM 388 N THR A 85 2.744 -10.787 -8.262 1.00 0.00 N ATOM 389 CA THR A 85 1.622 -11.585 -7.784 1.00 0.00 C ATOM 390 C THR A 85 1.401 -11.384 -6.290 1.00 0.00 C ATOM 391 O THR A 85 2.229 -10.783 -5.606 1.00 0.00 O ATOM 392 CB THR A 85 1.841 -13.085 -8.061 1.00 0.00 C ATOM 393 OG1 THR A 85 2.949 -13.568 -7.293 1.00 0.00 O ATOM 394 CG2 THR A 85 2.098 -13.330 -9.541 1.00 0.00 C ATOM 0 H THR A 85 3.572 -10.826 -7.668 1.00 0.00 H new ATOM 0 HA THR A 85 0.740 -11.247 -8.328 1.00 0.00 H new ATOM 0 HB THR A 85 0.937 -13.621 -7.772 1.00 0.00 H new ATOM 0 HG1 THR A 85 3.081 -14.522 -7.473 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.250 -14.396 -9.712 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.241 -12.988 -10.121 1.00 0.00 H new ATOM 0 HG23 THR A 85 2.988 -12.782 -9.851 1.00 0.00 H new ATOM 402 N GLU A 86 0.278 -11.890 -5.789 1.00 0.00 N ATOM 403 CA GLU A 86 -0.051 -11.764 -4.374 1.00 0.00 C ATOM 404 C GLU A 86 1.158 -12.093 -3.503 1.00 0.00 C ATOM 405 O GLU A 86 1.365 -11.481 -2.455 1.00 0.00 O ATOM 406 CB GLU A 86 -1.218 -12.687 -4.015 1.00 0.00 C ATOM 407 CG GLU A 86 -2.070 -12.172 -2.867 1.00 0.00 C ATOM 408 CD GLU A 86 -3.213 -13.108 -2.523 1.00 0.00 C ATOM 409 OE1 GLU A 86 -3.710 -13.796 -3.438 1.00 0.00 O ATOM 410 OE2 GLU A 86 -3.609 -13.151 -1.340 1.00 0.00 O ATOM 0 H GLU A 86 -0.418 -12.390 -6.341 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.343 -10.731 -4.186 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -1.849 -12.820 -4.894 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -0.826 -13.670 -3.753 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -1.442 -12.033 -1.987 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -2.473 -11.194 -3.129 1.00 0.00 H new ATOM 417 N GLU A 87 1.952 -13.063 -3.944 1.00 0.00 N ATOM 418 CA GLU A 87 3.139 -13.474 -3.204 1.00 0.00 C ATOM 419 C GLU A 87 4.164 -12.345 -3.150 1.00 0.00 C ATOM 420 O GLU A 87 4.542 -11.888 -2.071 1.00 0.00 O ATOM 421 CB GLU A 87 3.764 -14.714 -3.847 1.00 0.00 C ATOM 422 CG GLU A 87 4.820 -15.382 -2.981 1.00 0.00 C ATOM 423 CD GLU A 87 5.478 -16.562 -3.670 1.00 0.00 C ATOM 424 OE1 GLU A 87 6.485 -16.349 -4.377 1.00 0.00 O ATOM 425 OE2 GLU A 87 4.986 -17.697 -3.502 1.00 0.00 O ATOM 0 H GLU A 87 1.795 -13.579 -4.810 1.00 0.00 H new ATOM 0 HA GLU A 87 2.835 -13.715 -2.185 1.00 0.00 H new ATOM 0 HB2 GLU A 87 2.977 -15.435 -4.066 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.212 -14.432 -4.800 1.00 0.00 H new ATOM 0 HG2 GLU A 87 5.582 -14.650 -2.715 1.00 0.00 H new ATOM 0 HG3 GLU A 87 4.362 -15.718 -2.051 1.00 0.00 H new ATOM 432 N GLU A 88 4.609 -11.901 -4.321 1.00 0.00 N ATOM 433 CA GLU A 88 5.592 -10.827 -4.406 1.00 0.00 C ATOM 434 C GLU A 88 5.251 -9.700 -3.435 1.00 0.00 C ATOM 435 O GLU A 88 6.092 -9.273 -2.644 1.00 0.00 O ATOM 436 CB GLU A 88 5.661 -10.281 -5.834 1.00 0.00 C ATOM 437 CG GLU A 88 6.548 -11.100 -6.756 1.00 0.00 C ATOM 438 CD GLU A 88 5.812 -12.263 -7.393 1.00 0.00 C ATOM 439 OE1 GLU A 88 5.693 -13.319 -6.737 1.00 0.00 O ATOM 440 OE2 GLU A 88 5.355 -12.117 -8.545 1.00 0.00 O ATOM 0 H GLU A 88 4.305 -12.268 -5.223 1.00 0.00 H new ATOM 0 HA GLU A 88 6.565 -11.236 -4.134 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.654 -10.245 -6.250 1.00 0.00 H new ATOM 0 HB3 GLU A 88 6.030 -9.256 -5.805 1.00 0.00 H new ATOM 0 HG2 GLU A 88 6.946 -10.454 -7.539 1.00 0.00 H new ATOM 0 HG3 GLU A 88 7.400 -11.479 -6.192 1.00 0.00 H new ATOM 447 N MET A 89 4.013 -9.223 -3.502 1.00 0.00 N ATOM 448 CA MET A 89 3.560 -8.146 -2.629 1.00 0.00 C ATOM 449 C MET A 89 3.783 -8.505 -1.163 1.00 0.00 C ATOM 450 O MET A 89 4.409 -7.751 -0.418 1.00 0.00 O ATOM 451 CB MET A 89 2.080 -7.850 -2.874 1.00 0.00 C ATOM 452 CG MET A 89 1.617 -6.531 -2.276 1.00 0.00 C ATOM 453 SD MET A 89 0.153 -5.872 -3.098 1.00 0.00 S ATOM 454 CE MET A 89 0.718 -4.228 -3.529 1.00 0.00 C ATOM 0 H MET A 89 3.305 -9.565 -4.152 1.00 0.00 H new ATOM 0 HA MET A 89 4.144 -7.255 -2.860 1.00 0.00 H new ATOM 0 HB2 MET A 89 1.893 -7.838 -3.948 1.00 0.00 H new ATOM 0 HB3 MET A 89 1.482 -8.659 -2.455 1.00 0.00 H new ATOM 0 HG2 MET A 89 1.402 -6.672 -1.217 1.00 0.00 H new ATOM 0 HG3 MET A 89 2.425 -5.803 -2.343 1.00 0.00 H new ATOM 0 HE1 MET A 89 -0.125 -3.635 -3.883 1.00 0.00 H new ATOM 0 HE2 MET A 89 1.154 -3.751 -2.651 1.00 0.00 H new ATOM 0 HE3 MET A 89 1.469 -4.296 -4.316 1.00 0.00 H new ATOM 464 N ARG A 90 3.268 -9.660 -0.756 1.00 0.00 N ATOM 465 CA ARG A 90 3.409 -10.118 0.621 1.00 0.00 C ATOM 466 C ARG A 90 4.868 -10.062 1.064 1.00 0.00 C ATOM 467 O ARG A 90 5.164 -9.810 2.233 1.00 0.00 O ATOM 468 CB ARG A 90 2.875 -11.544 0.764 1.00 0.00 C ATOM 469 CG ARG A 90 1.403 -11.609 1.134 1.00 0.00 C ATOM 470 CD ARG A 90 0.931 -13.045 1.295 1.00 0.00 C ATOM 471 NE ARG A 90 0.489 -13.621 0.027 1.00 0.00 N ATOM 472 CZ ARG A 90 0.257 -14.917 -0.150 1.00 0.00 C ATOM 473 NH1 ARG A 90 0.423 -15.767 0.854 1.00 0.00 N ATOM 474 NH2 ARG A 90 -0.143 -15.365 -1.333 1.00 0.00 N ATOM 0 H ARG A 90 2.749 -10.297 -1.361 1.00 0.00 H new ATOM 0 HA ARG A 90 2.827 -9.455 1.261 1.00 0.00 H new ATOM 0 HB2 ARG A 90 3.029 -12.076 -0.175 1.00 0.00 H new ATOM 0 HB3 ARG A 90 3.455 -12.066 1.525 1.00 0.00 H new ATOM 0 HG2 ARG A 90 1.236 -11.064 2.063 1.00 0.00 H new ATOM 0 HG3 ARG A 90 0.811 -11.115 0.364 1.00 0.00 H new ATOM 0 HD2 ARG A 90 1.740 -13.649 1.705 1.00 0.00 H new ATOM 0 HD3 ARG A 90 0.112 -13.079 2.014 1.00 0.00 H new ATOM 0 HE ARG A 90 0.351 -12.994 -0.765 1.00 0.00 H new ATOM 0 HH11 ARG A 90 0.730 -15.426 1.765 1.00 0.00 H new ATOM 0 HH12 ARG A 90 0.244 -16.762 0.715 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -0.273 -14.714 -2.108 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -0.321 -16.360 -1.468 1.00 0.00 H new ATOM 488 N LYS A 91 5.777 -10.300 0.124 1.00 0.00 N ATOM 489 CA LYS A 91 7.205 -10.277 0.416 1.00 0.00 C ATOM 490 C LYS A 91 7.730 -8.845 0.453 1.00 0.00 C ATOM 491 O LYS A 91 8.600 -8.513 1.258 1.00 0.00 O ATOM 492 CB LYS A 91 7.974 -11.087 -0.630 1.00 0.00 C ATOM 493 CG LYS A 91 9.376 -11.472 -0.192 1.00 0.00 C ATOM 494 CD LYS A 91 10.072 -12.327 -1.237 1.00 0.00 C ATOM 495 CE LYS A 91 11.547 -12.511 -0.914 1.00 0.00 C ATOM 496 NZ LYS A 91 12.210 -13.448 -1.864 1.00 0.00 N ATOM 0 H LYS A 91 5.549 -10.511 -0.848 1.00 0.00 H new ATOM 0 HA LYS A 91 7.357 -10.726 1.397 1.00 0.00 H new ATOM 0 HB2 LYS A 91 7.413 -11.993 -0.860 1.00 0.00 H new ATOM 0 HB3 LYS A 91 8.037 -10.508 -1.551 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.961 -10.571 -0.009 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.327 -12.017 0.751 1.00 0.00 H new ATOM 0 HD2 LYS A 91 9.587 -13.301 -1.294 1.00 0.00 H new ATOM 0 HD3 LYS A 91 9.968 -11.862 -2.217 1.00 0.00 H new ATOM 0 HE2 LYS A 91 12.049 -11.544 -0.947 1.00 0.00 H new ATOM 0 HE3 LYS A 91 11.652 -12.890 0.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 13.214 -13.547 -1.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 11.747 -14.378 -1.814 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.133 -13.074 -2.831 1.00 0.00 H new ATOM 510 N LEU A 92 7.195 -8.002 -0.423 1.00 0.00 N ATOM 511 CA LEU A 92 7.608 -6.604 -0.490 1.00 0.00 C ATOM 512 C LEU A 92 7.427 -5.917 0.860 1.00 0.00 C ATOM 513 O LEU A 92 8.281 -5.145 1.295 1.00 0.00 O ATOM 514 CB LEU A 92 6.806 -5.866 -1.563 1.00 0.00 C ATOM 515 CG LEU A 92 7.263 -6.078 -3.007 1.00 0.00 C ATOM 516 CD1 LEU A 92 6.213 -5.563 -3.980 1.00 0.00 C ATOM 517 CD2 LEU A 92 8.599 -5.391 -3.250 1.00 0.00 C ATOM 0 H LEU A 92 6.474 -8.262 -1.097 1.00 0.00 H new ATOM 0 HA LEU A 92 8.666 -6.575 -0.752 1.00 0.00 H new ATOM 0 HB2 LEU A 92 5.763 -6.173 -1.484 1.00 0.00 H new ATOM 0 HB3 LEU A 92 6.841 -4.799 -1.345 1.00 0.00 H new ATOM 0 HG LEU A 92 7.391 -7.148 -3.174 1.00 0.00 H new ATOM 0 HD11 LEU A 92 6.555 -5.722 -5.003 1.00 0.00 H new ATOM 0 HD12 LEU A 92 5.277 -6.099 -3.823 1.00 0.00 H new ATOM 0 HD13 LEU A 92 6.053 -4.498 -3.813 1.00 0.00 H new ATOM 0 HD21 LEU A 92 8.909 -5.552 -4.283 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.497 -4.322 -3.065 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.349 -5.806 -2.577 1.00 0.00 H new ATOM 529 N PHE A 93 6.309 -6.206 1.519 1.00 0.00 N ATOM 530 CA PHE A 93 6.016 -5.617 2.820 1.00 0.00 C ATOM 531 C PHE A 93 6.193 -6.644 3.935 1.00 0.00 C ATOM 532 O PHE A 93 5.429 -6.666 4.899 1.00 0.00 O ATOM 533 CB PHE A 93 4.589 -5.064 2.844 1.00 0.00 C ATOM 534 CG PHE A 93 4.327 -4.037 1.779 1.00 0.00 C ATOM 535 CD1 PHE A 93 4.234 -4.409 0.447 1.00 0.00 C ATOM 536 CD2 PHE A 93 4.173 -2.700 2.110 1.00 0.00 C ATOM 537 CE1 PHE A 93 3.993 -3.466 -0.534 1.00 0.00 C ATOM 538 CE2 PHE A 93 3.932 -1.753 1.132 1.00 0.00 C ATOM 539 CZ PHE A 93 3.841 -2.137 -0.191 1.00 0.00 C ATOM 0 H PHE A 93 5.592 -6.844 1.173 1.00 0.00 H new ATOM 0 HA PHE A 93 6.718 -4.800 2.987 1.00 0.00 H new ATOM 0 HB2 PHE A 93 3.886 -5.888 2.724 1.00 0.00 H new ATOM 0 HB3 PHE A 93 4.396 -4.621 3.821 1.00 0.00 H new ATOM 0 HD1 PHE A 93 4.351 -5.447 0.173 1.00 0.00 H new ATOM 0 HD2 PHE A 93 4.242 -2.394 3.144 1.00 0.00 H new ATOM 0 HE1 PHE A 93 3.924 -3.768 -1.569 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.815 -0.714 1.403 1.00 0.00 H new ATOM 0 HZ PHE A 93 3.651 -1.399 -0.956 1.00 0.00 H new ATOM 549 N GLU A 94 7.207 -7.492 3.793 1.00 0.00 N ATOM 550 CA GLU A 94 7.484 -8.523 4.787 1.00 0.00 C ATOM 551 C GLU A 94 8.307 -7.958 5.942 1.00 0.00 C ATOM 552 O GLU A 94 8.585 -8.653 6.919 1.00 0.00 O ATOM 553 CB GLU A 94 8.226 -9.696 4.144 1.00 0.00 C ATOM 554 CG GLU A 94 9.738 -9.554 4.180 1.00 0.00 C ATOM 555 CD GLU A 94 10.445 -10.644 3.398 1.00 0.00 C ATOM 556 OE1 GLU A 94 10.458 -10.568 2.152 1.00 0.00 O ATOM 557 OE2 GLU A 94 10.987 -11.573 4.034 1.00 0.00 O ATOM 0 H GLU A 94 7.849 -7.486 3.001 1.00 0.00 H new ATOM 0 HA GLU A 94 6.531 -8.877 5.181 1.00 0.00 H new ATOM 0 HB2 GLU A 94 7.944 -10.617 4.654 1.00 0.00 H new ATOM 0 HB3 GLU A 94 7.903 -9.794 3.107 1.00 0.00 H new ATOM 0 HG2 GLU A 94 10.018 -8.582 3.775 1.00 0.00 H new ATOM 0 HG3 GLU A 94 10.077 -9.577 5.216 1.00 0.00 H new ATOM 564 N LYS A 95 8.694 -6.693 5.821 1.00 0.00 N ATOM 565 CA LYS A 95 9.485 -6.032 6.853 1.00 0.00 C ATOM 566 C LYS A 95 8.583 -5.320 7.856 1.00 0.00 C ATOM 567 O LYS A 95 8.942 -5.159 9.023 1.00 0.00 O ATOM 568 CB LYS A 95 10.453 -5.030 6.219 1.00 0.00 C ATOM 569 CG LYS A 95 11.133 -4.121 7.228 1.00 0.00 C ATOM 570 CD LYS A 95 12.324 -3.402 6.617 1.00 0.00 C ATOM 571 CE LYS A 95 11.882 -2.343 5.618 1.00 0.00 C ATOM 572 NZ LYS A 95 11.741 -2.900 4.245 1.00 0.00 N ATOM 0 H LYS A 95 8.473 -6.104 5.018 1.00 0.00 H new ATOM 0 HA LYS A 95 10.057 -6.794 7.382 1.00 0.00 H new ATOM 0 HB2 LYS A 95 11.215 -5.576 5.662 1.00 0.00 H new ATOM 0 HB3 LYS A 95 9.910 -4.418 5.499 1.00 0.00 H new ATOM 0 HG2 LYS A 95 10.417 -3.389 7.600 1.00 0.00 H new ATOM 0 HG3 LYS A 95 11.462 -4.709 8.085 1.00 0.00 H new ATOM 0 HD2 LYS A 95 12.913 -2.936 7.407 1.00 0.00 H new ATOM 0 HD3 LYS A 95 12.971 -4.125 6.120 1.00 0.00 H new ATOM 0 HE2 LYS A 95 10.930 -1.918 5.937 1.00 0.00 H new ATOM 0 HE3 LYS A 95 12.607 -1.529 5.607 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 12.410 -2.424 3.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 11.945 -3.920 4.261 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 10.770 -2.746 3.906 1.00 0.00 H new ATOM 586 N TYR A 96 7.412 -4.896 7.395 1.00 0.00 N ATOM 587 CA TYR A 96 6.459 -4.200 8.252 1.00 0.00 C ATOM 588 C TYR A 96 5.292 -5.110 8.620 1.00 0.00 C ATOM 589 O TYR A 96 4.193 -4.642 8.913 1.00 0.00 O ATOM 590 CB TYR A 96 5.939 -2.942 7.555 1.00 0.00 C ATOM 591 CG TYR A 96 6.949 -2.301 6.630 1.00 0.00 C ATOM 592 CD1 TYR A 96 7.877 -1.384 7.110 1.00 0.00 C ATOM 593 CD2 TYR A 96 6.976 -2.613 5.276 1.00 0.00 C ATOM 594 CE1 TYR A 96 8.800 -0.796 6.268 1.00 0.00 C ATOM 595 CE2 TYR A 96 7.897 -2.030 4.427 1.00 0.00 C ATOM 596 CZ TYR A 96 8.807 -1.122 4.927 1.00 0.00 C ATOM 597 OH TYR A 96 9.726 -0.539 4.086 1.00 0.00 O ATOM 0 H TYR A 96 7.099 -5.022 6.432 1.00 0.00 H new ATOM 0 HA TYR A 96 6.975 -3.913 9.168 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.046 -3.196 6.984 1.00 0.00 H new ATOM 0 HB3 TYR A 96 5.639 -2.216 8.311 1.00 0.00 H new ATOM 0 HD1 TYR A 96 7.876 -1.127 8.159 1.00 0.00 H new ATOM 0 HD2 TYR A 96 6.265 -3.323 4.881 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.513 -0.084 6.657 1.00 0.00 H new ATOM 0 HE2 TYR A 96 7.904 -2.284 3.377 1.00 0.00 H new ATOM 0 HH TYR A 96 9.597 -0.877 3.175 1.00 0.00 H new ATOM 607 N GLY A 97 5.540 -6.417 8.603 1.00 0.00 N ATOM 608 CA GLY A 97 4.501 -7.373 8.938 1.00 0.00 C ATOM 609 C GLY A 97 3.609 -7.697 7.756 1.00 0.00 C ATOM 610 O GLY A 97 3.684 -7.045 6.714 1.00 0.00 O ATOM 0 H GLY A 97 6.441 -6.830 8.363 1.00 0.00 H new ATOM 0 HA2 GLY A 97 4.961 -8.291 9.305 1.00 0.00 H new ATOM 0 HA3 GLY A 97 3.893 -6.974 9.750 1.00 0.00 H new ATOM 614 N LYS A 98 2.761 -8.708 7.916 1.00 0.00 N ATOM 615 CA LYS A 98 1.850 -9.118 6.854 1.00 0.00 C ATOM 616 C LYS A 98 0.734 -8.095 6.668 1.00 0.00 C ATOM 617 O LYS A 98 -0.054 -7.850 7.581 1.00 0.00 O ATOM 618 CB LYS A 98 1.250 -10.490 7.170 1.00 0.00 C ATOM 619 CG LYS A 98 0.297 -10.479 8.353 1.00 0.00 C ATOM 620 CD LYS A 98 0.134 -11.867 8.950 1.00 0.00 C ATOM 621 CE LYS A 98 -0.940 -12.663 8.225 1.00 0.00 C ATOM 622 NZ LYS A 98 -0.416 -13.299 6.985 1.00 0.00 N ATOM 0 H LYS A 98 2.686 -9.258 8.771 1.00 0.00 H new ATOM 0 HA LYS A 98 2.419 -9.181 5.927 1.00 0.00 H new ATOM 0 HB2 LYS A 98 0.720 -10.857 6.291 1.00 0.00 H new ATOM 0 HB3 LYS A 98 2.058 -11.193 7.372 1.00 0.00 H new ATOM 0 HG2 LYS A 98 0.670 -9.795 9.116 1.00 0.00 H new ATOM 0 HG3 LYS A 98 -0.675 -10.102 8.035 1.00 0.00 H new ATOM 0 HD2 LYS A 98 1.083 -12.401 8.896 1.00 0.00 H new ATOM 0 HD3 LYS A 98 -0.125 -11.782 10.005 1.00 0.00 H new ATOM 0 HE2 LYS A 98 -1.333 -13.432 8.890 1.00 0.00 H new ATOM 0 HE3 LYS A 98 -1.771 -12.005 7.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 -0.948 -14.171 6.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 -0.524 -12.642 6.186 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 0.590 -13.529 7.111 1.00 0.00 H new ATOM 636 N ALA A 99 0.674 -7.501 5.481 1.00 0.00 N ATOM 637 CA ALA A 99 -0.347 -6.507 5.175 1.00 0.00 C ATOM 638 C ALA A 99 -1.747 -7.084 5.357 1.00 0.00 C ATOM 639 O ALA A 99 -2.002 -8.238 5.017 1.00 0.00 O ATOM 640 CB ALA A 99 -0.169 -5.987 3.756 1.00 0.00 C ATOM 0 H ALA A 99 1.321 -7.691 4.715 1.00 0.00 H new ATOM 0 HA ALA A 99 -0.231 -5.677 5.872 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -0.938 -5.245 3.541 1.00 0.00 H new ATOM 0 HB2 ALA A 99 0.815 -5.528 3.657 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -0.256 -6.814 3.052 1.00 0.00 H new ATOM 646 N GLY A 100 -2.651 -6.272 5.897 1.00 0.00 N ATOM 647 CA GLY A 100 -4.014 -6.720 6.115 1.00 0.00 C ATOM 648 C GLY A 100 -4.741 -7.021 4.819 1.00 0.00 C ATOM 649 O GLY A 100 -5.363 -8.073 4.679 1.00 0.00 O ATOM 0 H GLY A 100 -2.464 -5.312 6.187 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -4.004 -7.614 6.738 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -4.561 -5.954 6.665 1.00 0.00 H new ATOM 653 N GLU A 101 -4.663 -6.093 3.870 1.00 0.00 N ATOM 654 CA GLU A 101 -5.321 -6.265 2.580 1.00 0.00 C ATOM 655 C GLU A 101 -4.309 -6.199 1.440 1.00 0.00 C ATOM 656 O GLU A 101 -3.449 -5.318 1.407 1.00 0.00 O ATOM 657 CB GLU A 101 -6.395 -5.193 2.385 1.00 0.00 C ATOM 658 CG GLU A 101 -7.329 -5.473 1.219 1.00 0.00 C ATOM 659 CD GLU A 101 -8.379 -4.393 1.040 1.00 0.00 C ATOM 660 OE1 GLU A 101 -9.033 -4.029 2.040 1.00 0.00 O ATOM 661 OE2 GLU A 101 -8.546 -3.912 -0.100 1.00 0.00 O ATOM 0 H GLU A 101 -4.152 -5.216 3.970 1.00 0.00 H new ATOM 0 HA GLU A 101 -5.792 -7.248 2.569 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -6.983 -5.109 3.299 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -5.910 -4.229 2.228 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -6.744 -5.562 0.303 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -7.823 -6.432 1.376 1.00 0.00 H new ATOM 668 N VAL A 102 -4.416 -7.139 0.506 1.00 0.00 N ATOM 669 CA VAL A 102 -3.512 -7.189 -0.636 1.00 0.00 C ATOM 670 C VAL A 102 -4.275 -7.450 -1.930 1.00 0.00 C ATOM 671 O VAL A 102 -4.878 -8.509 -2.105 1.00 0.00 O ATOM 672 CB VAL A 102 -2.440 -8.280 -0.456 1.00 0.00 C ATOM 673 CG1 VAL A 102 -1.585 -8.402 -1.708 1.00 0.00 C ATOM 674 CG2 VAL A 102 -1.577 -7.983 0.761 1.00 0.00 C ATOM 0 H VAL A 102 -5.121 -7.876 0.518 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.023 -6.216 -0.696 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.942 -9.234 -0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.834 -9.178 -1.561 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -2.217 -8.665 -2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.091 -7.451 -1.905 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.825 -8.764 0.873 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -1.083 -7.020 0.631 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -2.203 -7.952 1.652 1.00 0.00 H new ATOM 684 N PHE A 103 -4.243 -6.478 -2.836 1.00 0.00 N ATOM 685 CA PHE A 103 -4.932 -6.602 -4.115 1.00 0.00 C ATOM 686 C PHE A 103 -4.046 -6.116 -5.259 1.00 0.00 C ATOM 687 O PHE A 103 -3.494 -5.017 -5.206 1.00 0.00 O ATOM 688 CB PHE A 103 -6.239 -5.807 -4.094 1.00 0.00 C ATOM 689 CG PHE A 103 -7.342 -6.487 -3.335 1.00 0.00 C ATOM 690 CD1 PHE A 103 -7.723 -7.781 -3.651 1.00 0.00 C ATOM 691 CD2 PHE A 103 -7.998 -5.832 -2.305 1.00 0.00 C ATOM 692 CE1 PHE A 103 -8.738 -8.410 -2.955 1.00 0.00 C ATOM 693 CE2 PHE A 103 -9.013 -6.456 -1.605 1.00 0.00 C ATOM 694 CZ PHE A 103 -9.384 -7.746 -1.931 1.00 0.00 C ATOM 0 H PHE A 103 -3.747 -5.596 -2.708 1.00 0.00 H new ATOM 0 HA PHE A 103 -5.159 -7.656 -4.276 1.00 0.00 H new ATOM 0 HB2 PHE A 103 -6.053 -4.829 -3.650 1.00 0.00 H new ATOM 0 HB3 PHE A 103 -6.567 -5.635 -5.119 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -7.221 -8.305 -4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 103 -7.713 -4.823 -2.047 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -9.025 -9.419 -3.212 1.00 0.00 H new ATOM 0 HE2 PHE A 103 -9.516 -5.935 -0.803 1.00 0.00 H new ATOM 0 HZ PHE A 103 -10.178 -8.235 -1.386 1.00 0.00 H new ATOM 704 N ILE A 104 -3.916 -6.944 -6.290 1.00 0.00 N ATOM 705 CA ILE A 104 -3.098 -6.599 -7.447 1.00 0.00 C ATOM 706 C ILE A 104 -3.872 -6.797 -8.746 1.00 0.00 C ATOM 707 O ILE A 104 -4.262 -7.915 -9.084 1.00 0.00 O ATOM 708 CB ILE A 104 -1.810 -7.441 -7.497 1.00 0.00 C ATOM 709 CG1 ILE A 104 -0.944 -7.162 -6.266 1.00 0.00 C ATOM 710 CG2 ILE A 104 -1.035 -7.149 -8.773 1.00 0.00 C ATOM 711 CD1 ILE A 104 0.184 -8.153 -6.084 1.00 0.00 C ATOM 0 H ILE A 104 -4.366 -7.858 -6.348 1.00 0.00 H new ATOM 0 HA ILE A 104 -2.831 -5.547 -7.342 1.00 0.00 H new ATOM 0 HB ILE A 104 -2.083 -8.496 -7.495 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -0.526 -6.159 -6.346 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -1.575 -7.175 -5.377 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -0.127 -7.752 -8.793 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -1.652 -7.393 -9.638 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -0.769 -6.092 -8.804 1.00 0.00 H new ATOM 0 HD11 ILE A 104 0.756 -7.894 -5.193 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -0.227 -9.156 -5.972 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.838 -8.124 -6.956 1.00 0.00 H new ATOM 723 N HIS A 105 -4.090 -5.705 -9.471 1.00 0.00 N ATOM 724 CA HIS A 105 -4.816 -5.759 -10.735 1.00 0.00 C ATOM 725 C HIS A 105 -3.871 -5.541 -11.913 1.00 0.00 C ATOM 726 O HIS A 105 -3.156 -4.541 -11.973 1.00 0.00 O ATOM 727 CB HIS A 105 -5.926 -4.707 -10.756 1.00 0.00 C ATOM 728 CG HIS A 105 -7.107 -5.099 -11.589 1.00 0.00 C ATOM 729 ND1 HIS A 105 -7.575 -4.335 -12.637 1.00 0.00 N ATOM 730 CD2 HIS A 105 -7.915 -6.184 -11.526 1.00 0.00 C ATOM 731 CE1 HIS A 105 -8.621 -4.931 -13.181 1.00 0.00 C ATOM 732 NE2 HIS A 105 -8.847 -6.055 -12.526 1.00 0.00 N ATOM 0 H HIS A 105 -3.775 -4.772 -9.205 1.00 0.00 H new ATOM 0 HA HIS A 105 -5.262 -6.749 -10.827 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -6.258 -4.521 -9.735 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -5.520 -3.769 -11.135 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -7.840 -6.999 -10.821 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -9.194 -4.562 -14.019 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -9.593 -6.720 -12.730 1.00 0.00 H new ATOM 740 N LYS A 106 -3.873 -6.485 -12.849 1.00 0.00 N ATOM 741 CA LYS A 106 -3.018 -6.398 -14.026 1.00 0.00 C ATOM 742 C LYS A 106 -3.693 -5.592 -15.131 1.00 0.00 C ATOM 743 O LYS A 106 -3.093 -4.681 -15.703 1.00 0.00 O ATOM 744 CB LYS A 106 -2.676 -7.799 -14.538 1.00 0.00 C ATOM 745 CG LYS A 106 -1.812 -7.795 -15.788 1.00 0.00 C ATOM 746 CD LYS A 106 -2.027 -9.050 -16.618 1.00 0.00 C ATOM 747 CE LYS A 106 -3.350 -9.004 -17.365 1.00 0.00 C ATOM 748 NZ LYS A 106 -3.313 -9.820 -18.611 1.00 0.00 N ATOM 0 H LYS A 106 -4.458 -7.320 -12.814 1.00 0.00 H new ATOM 0 HA LYS A 106 -2.098 -5.888 -13.739 1.00 0.00 H new ATOM 0 HB2 LYS A 106 -2.159 -8.348 -13.751 1.00 0.00 H new ATOM 0 HB3 LYS A 106 -3.601 -8.336 -14.747 1.00 0.00 H new ATOM 0 HG2 LYS A 106 -2.044 -6.916 -16.389 1.00 0.00 H new ATOM 0 HG3 LYS A 106 -0.762 -7.720 -15.505 1.00 0.00 H new ATOM 0 HD2 LYS A 106 -1.209 -9.161 -17.330 1.00 0.00 H new ATOM 0 HD3 LYS A 106 -2.005 -9.925 -15.969 1.00 0.00 H new ATOM 0 HE2 LYS A 106 -4.146 -9.368 -16.716 1.00 0.00 H new ATOM 0 HE3 LYS A 106 -3.590 -7.971 -17.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 -4.234 -9.762 -19.091 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 -2.570 -9.457 -19.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 -3.109 -10.811 -18.371 1.00 0.00 H new ATOM 762 N ASP A 107 -4.943 -5.931 -15.425 1.00 0.00 N ATOM 763 CA ASP A 107 -5.701 -5.237 -16.460 1.00 0.00 C ATOM 764 C ASP A 107 -5.349 -3.753 -16.488 1.00 0.00 C ATOM 765 O ASP A 107 -4.862 -3.238 -17.495 1.00 0.00 O ATOM 766 CB ASP A 107 -7.202 -5.413 -16.227 1.00 0.00 C ATOM 767 CG ASP A 107 -8.020 -4.306 -16.862 1.00 0.00 C ATOM 768 OD1 ASP A 107 -7.870 -4.082 -18.081 1.00 0.00 O ATOM 769 OD2 ASP A 107 -8.811 -3.663 -16.140 1.00 0.00 O ATOM 0 H ASP A 107 -5.453 -6.682 -14.961 1.00 0.00 H new ATOM 0 HA ASP A 107 -5.437 -5.673 -17.423 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -7.519 -6.374 -16.632 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -7.400 -5.438 -15.155 1.00 0.00 H new ATOM 774 N LYS A 108 -5.599 -3.069 -15.376 1.00 0.00 N ATOM 775 CA LYS A 108 -5.309 -1.644 -15.272 1.00 0.00 C ATOM 776 C LYS A 108 -3.846 -1.412 -14.910 1.00 0.00 C ATOM 777 O LYS A 108 -3.287 -0.352 -15.190 1.00 0.00 O ATOM 778 CB LYS A 108 -6.215 -0.994 -14.224 1.00 0.00 C ATOM 779 CG LYS A 108 -7.693 -1.075 -14.563 1.00 0.00 C ATOM 780 CD LYS A 108 -8.071 -0.084 -15.651 1.00 0.00 C ATOM 781 CE LYS A 108 -8.286 1.311 -15.084 1.00 0.00 C ATOM 782 NZ LYS A 108 -9.492 1.376 -14.213 1.00 0.00 N ATOM 0 H LYS A 108 -6.002 -3.479 -14.534 1.00 0.00 H new ATOM 0 HA LYS A 108 -5.501 -1.187 -16.243 1.00 0.00 H new ATOM 0 HB2 LYS A 108 -6.045 -1.475 -13.261 1.00 0.00 H new ATOM 0 HB3 LYS A 108 -5.933 0.053 -14.112 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -7.937 -2.086 -14.890 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -8.284 -0.877 -13.668 1.00 0.00 H new ATOM 0 HD2 LYS A 108 -7.285 -0.054 -16.406 1.00 0.00 H new ATOM 0 HD3 LYS A 108 -8.980 -0.419 -16.150 1.00 0.00 H new ATOM 0 HE2 LYS A 108 -7.408 1.609 -14.511 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -8.390 2.024 -15.902 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 -9.802 2.365 -14.122 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 -10.256 0.811 -14.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 -9.261 0.998 -13.272 1.00 0.00 H new ATOM 796 N GLY A 109 -3.229 -2.412 -14.286 1.00 0.00 N ATOM 797 CA GLY A 109 -1.836 -2.296 -13.897 1.00 0.00 C ATOM 798 C GLY A 109 -1.654 -1.493 -12.625 1.00 0.00 C ATOM 799 O GLY A 109 -0.804 -0.604 -12.559 1.00 0.00 O ATOM 0 H GLY A 109 -3.669 -3.300 -14.043 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -1.417 -3.292 -13.757 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -1.275 -1.825 -14.704 1.00 0.00 H new ATOM 803 N PHE A 110 -2.455 -1.804 -11.611 1.00 0.00 N ATOM 804 CA PHE A 110 -2.380 -1.102 -10.334 1.00 0.00 C ATOM 805 C PHE A 110 -2.628 -2.059 -9.172 1.00 0.00 C ATOM 806 O PHE A 110 -3.275 -3.093 -9.333 1.00 0.00 O ATOM 807 CB PHE A 110 -3.397 0.040 -10.296 1.00 0.00 C ATOM 808 CG PHE A 110 -2.958 1.260 -11.055 1.00 0.00 C ATOM 809 CD1 PHE A 110 -1.911 2.041 -10.592 1.00 0.00 C ATOM 810 CD2 PHE A 110 -3.592 1.625 -12.232 1.00 0.00 C ATOM 811 CE1 PHE A 110 -1.506 3.164 -11.288 1.00 0.00 C ATOM 812 CE2 PHE A 110 -3.191 2.747 -12.932 1.00 0.00 C ATOM 813 CZ PHE A 110 -2.146 3.517 -12.460 1.00 0.00 C ATOM 0 H PHE A 110 -3.163 -2.537 -11.648 1.00 0.00 H new ATOM 0 HA PHE A 110 -1.376 -0.689 -10.233 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -4.343 -0.313 -10.707 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -3.583 0.315 -9.258 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -1.406 1.769 -9.677 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -4.409 1.026 -12.606 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -0.690 3.765 -10.916 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -3.694 3.022 -13.847 1.00 0.00 H new ATOM 0 HZ PHE A 110 -1.830 4.393 -13.006 1.00 0.00 H new ATOM 823 N GLY A 111 -2.108 -1.706 -8.001 1.00 0.00 N ATOM 824 CA GLY A 111 -2.283 -2.543 -6.829 1.00 0.00 C ATOM 825 C GLY A 111 -2.397 -1.736 -5.551 1.00 0.00 C ATOM 826 O GLY A 111 -1.909 -0.608 -5.475 1.00 0.00 O ATOM 0 H GLY A 111 -1.568 -0.855 -7.843 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -3.179 -3.152 -6.952 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.440 -3.229 -6.748 1.00 0.00 H new ATOM 830 N PHE A 112 -3.046 -2.312 -4.544 1.00 0.00 N ATOM 831 CA PHE A 112 -3.226 -1.637 -3.264 1.00 0.00 C ATOM 832 C PHE A 112 -2.878 -2.567 -2.106 1.00 0.00 C ATOM 833 O PHE A 112 -3.055 -3.782 -2.197 1.00 0.00 O ATOM 834 CB PHE A 112 -4.667 -1.144 -3.122 1.00 0.00 C ATOM 835 CG PHE A 112 -5.135 -0.315 -4.284 1.00 0.00 C ATOM 836 CD1 PHE A 112 -5.622 -0.919 -5.431 1.00 0.00 C ATOM 837 CD2 PHE A 112 -5.086 1.069 -4.229 1.00 0.00 C ATOM 838 CE1 PHE A 112 -6.054 -0.160 -6.502 1.00 0.00 C ATOM 839 CE2 PHE A 112 -5.516 1.834 -5.297 1.00 0.00 C ATOM 840 CZ PHE A 112 -5.999 1.219 -6.435 1.00 0.00 C ATOM 0 H PHE A 112 -3.456 -3.245 -4.590 1.00 0.00 H new ATOM 0 HA PHE A 112 -2.552 -0.781 -3.235 1.00 0.00 H new ATOM 0 HB2 PHE A 112 -5.327 -2.004 -3.010 1.00 0.00 H new ATOM 0 HB3 PHE A 112 -4.753 -0.556 -2.208 1.00 0.00 H new ATOM 0 HD1 PHE A 112 -5.665 -1.997 -5.489 1.00 0.00 H new ATOM 0 HD2 PHE A 112 -4.708 1.555 -3.342 1.00 0.00 H new ATOM 0 HE1 PHE A 112 -6.434 -0.644 -7.390 1.00 0.00 H new ATOM 0 HE2 PHE A 112 -5.474 2.912 -5.241 1.00 0.00 H new ATOM 0 HZ PHE A 112 -6.333 1.815 -7.271 1.00 0.00 H new ATOM 850 N ILE A 113 -2.382 -1.987 -1.018 1.00 0.00 N ATOM 851 CA ILE A 113 -2.010 -2.763 0.159 1.00 0.00 C ATOM 852 C ILE A 113 -2.358 -2.017 1.442 1.00 0.00 C ATOM 853 O ILE A 113 -2.017 -0.846 1.604 1.00 0.00 O ATOM 854 CB ILE A 113 -0.505 -3.093 0.162 1.00 0.00 C ATOM 855 CG1 ILE A 113 -0.184 -4.098 1.270 1.00 0.00 C ATOM 856 CG2 ILE A 113 0.315 -1.823 0.338 1.00 0.00 C ATOM 857 CD1 ILE A 113 1.035 -4.946 0.982 1.00 0.00 C ATOM 0 H ILE A 113 -2.228 -0.983 -0.927 1.00 0.00 H new ATOM 0 HA ILE A 113 -2.578 -3.692 0.117 1.00 0.00 H new ATOM 0 HB ILE A 113 -0.244 -3.541 -0.797 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.029 -3.559 2.205 1.00 0.00 H new ATOM 0 HG13 ILE A 113 -1.044 -4.751 1.418 1.00 0.00 H new ATOM 0 HG21 ILE A 113 1.376 -2.072 0.338 1.00 0.00 H new ATOM 0 HG22 ILE A 113 0.103 -1.137 -0.482 1.00 0.00 H new ATOM 0 HG23 ILE A 113 0.053 -1.349 1.284 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.203 -5.635 1.810 1.00 0.00 H new ATOM 0 HD12 ILE A 113 0.876 -5.513 0.065 1.00 0.00 H new ATOM 0 HD13 ILE A 113 1.907 -4.302 0.864 1.00 0.00 H new ATOM 869 N ARG A 114 -3.040 -2.705 2.353 1.00 0.00 N ATOM 870 CA ARG A 114 -3.434 -2.107 3.623 1.00 0.00 C ATOM 871 C ARG A 114 -2.671 -2.741 4.782 1.00 0.00 C ATOM 872 O ARG A 114 -2.788 -3.941 5.035 1.00 0.00 O ATOM 873 CB ARG A 114 -4.940 -2.269 3.841 1.00 0.00 C ATOM 874 CG ARG A 114 -5.516 -1.299 4.859 1.00 0.00 C ATOM 875 CD ARG A 114 -6.804 -1.830 5.468 1.00 0.00 C ATOM 876 NE ARG A 114 -6.591 -3.077 6.198 1.00 0.00 N ATOM 877 CZ ARG A 114 -6.185 -3.128 7.462 1.00 0.00 C ATOM 878 NH1 ARG A 114 -5.951 -2.009 8.133 1.00 0.00 N ATOM 879 NH2 ARG A 114 -6.015 -4.301 8.058 1.00 0.00 N ATOM 0 H ARG A 114 -3.331 -3.676 2.235 1.00 0.00 H new ATOM 0 HA ARG A 114 -3.190 -1.045 3.588 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -5.453 -2.131 2.889 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -5.144 -3.289 4.168 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -4.785 -1.122 5.648 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -5.708 -0.339 4.380 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -7.221 -1.082 6.142 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -7.538 -1.993 4.679 1.00 0.00 H new ATOM 0 HE ARG A 114 -6.763 -3.956 5.711 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -6.083 -1.105 7.679 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.639 -2.052 9.103 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -6.196 -5.164 7.546 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -5.703 -4.340 9.028 1.00 0.00 H new ATOM 893 N LEU A 115 -1.889 -1.928 5.483 1.00 0.00 N ATOM 894 CA LEU A 115 -1.105 -2.408 6.616 1.00 0.00 C ATOM 895 C LEU A 115 -1.950 -2.449 7.885 1.00 0.00 C ATOM 896 O LEU A 115 -3.150 -2.179 7.851 1.00 0.00 O ATOM 897 CB LEU A 115 0.117 -1.513 6.832 1.00 0.00 C ATOM 898 CG LEU A 115 0.891 -1.118 5.574 1.00 0.00 C ATOM 899 CD1 LEU A 115 2.025 -0.166 5.922 1.00 0.00 C ATOM 900 CD2 LEU A 115 1.428 -2.355 4.868 1.00 0.00 C ATOM 0 H LEU A 115 -1.781 -0.933 5.287 1.00 0.00 H new ATOM 0 HA LEU A 115 -0.771 -3.421 6.391 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -0.209 -0.602 7.335 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.801 -2.024 7.510 1.00 0.00 H new ATOM 0 HG LEU A 115 0.208 -0.605 4.896 1.00 0.00 H new ATOM 0 HD11 LEU A 115 2.565 0.104 5.014 1.00 0.00 H new ATOM 0 HD12 LEU A 115 1.617 0.733 6.383 1.00 0.00 H new ATOM 0 HD13 LEU A 115 2.708 -0.653 6.619 1.00 0.00 H new ATOM 0 HD21 LEU A 115 1.976 -2.055 3.975 1.00 0.00 H new ATOM 0 HD22 LEU A 115 2.095 -2.896 5.539 1.00 0.00 H new ATOM 0 HD23 LEU A 115 0.597 -3.001 4.584 1.00 0.00 H new ATOM 912 N GLU A 116 -1.315 -2.787 9.003 1.00 0.00 N ATOM 913 CA GLU A 116 -2.009 -2.862 10.283 1.00 0.00 C ATOM 914 C GLU A 116 -2.116 -1.482 10.925 1.00 0.00 C ATOM 915 O GLU A 116 -3.208 -1.024 11.263 1.00 0.00 O ATOM 916 CB GLU A 116 -1.282 -3.822 11.227 1.00 0.00 C ATOM 917 CG GLU A 116 0.146 -3.406 11.537 1.00 0.00 C ATOM 918 CD GLU A 116 0.963 -4.529 12.144 1.00 0.00 C ATOM 919 OE1 GLU A 116 0.359 -5.440 12.750 1.00 0.00 O ATOM 920 OE2 GLU A 116 2.204 -4.499 12.014 1.00 0.00 O ATOM 0 H GLU A 116 -0.321 -3.013 9.048 1.00 0.00 H new ATOM 0 HA GLU A 116 -3.016 -3.237 10.100 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -1.841 -3.894 12.160 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -1.273 -4.818 10.783 1.00 0.00 H new ATOM 0 HG2 GLU A 116 0.628 -3.066 10.621 1.00 0.00 H new ATOM 0 HG3 GLU A 116 0.133 -2.560 12.224 1.00 0.00 H new ATOM 927 N THR A 117 -0.974 -0.823 11.092 1.00 0.00 N ATOM 928 CA THR A 117 -0.937 0.503 11.695 1.00 0.00 C ATOM 929 C THR A 117 -0.585 1.567 10.662 1.00 0.00 C ATOM 930 O THR A 117 -0.338 1.257 9.496 1.00 0.00 O ATOM 931 CB THR A 117 0.081 0.567 12.849 1.00 0.00 C ATOM 932 OG1 THR A 117 1.366 0.131 12.393 1.00 0.00 O ATOM 933 CG2 THR A 117 -0.369 -0.297 14.017 1.00 0.00 C ATOM 0 H THR A 117 -0.061 -1.187 10.818 1.00 0.00 H new ATOM 0 HA THR A 117 -1.934 0.699 12.089 1.00 0.00 H new ATOM 0 HB THR A 117 0.148 1.601 13.188 1.00 0.00 H new ATOM 0 HG1 THR A 117 2.008 0.176 13.132 1.00 0.00 H new ATOM 0 HG21 THR A 117 0.366 -0.235 14.819 1.00 0.00 H new ATOM 0 HG22 THR A 117 -1.334 0.057 14.381 1.00 0.00 H new ATOM 0 HG23 THR A 117 -0.462 -1.332 13.689 1.00 0.00 H new ATOM 941 N ARG A 118 -0.564 2.823 11.096 1.00 0.00 N ATOM 942 CA ARG A 118 -0.243 3.934 10.208 1.00 0.00 C ATOM 943 C ARG A 118 1.266 4.156 10.139 1.00 0.00 C ATOM 944 O ARG A 118 1.820 4.405 9.068 1.00 0.00 O ATOM 945 CB ARG A 118 -0.936 5.212 10.683 1.00 0.00 C ATOM 946 CG ARG A 118 -0.638 5.564 12.132 1.00 0.00 C ATOM 947 CD ARG A 118 -1.171 6.942 12.491 1.00 0.00 C ATOM 948 NE ARG A 118 -1.198 7.159 13.935 1.00 0.00 N ATOM 949 CZ ARG A 118 -1.211 8.362 14.497 1.00 0.00 C ATOM 950 NH1 ARG A 118 -1.200 9.451 13.741 1.00 0.00 N ATOM 951 NH2 ARG A 118 -1.236 8.478 15.819 1.00 0.00 N ATOM 0 H ARG A 118 -0.766 3.097 12.058 1.00 0.00 H new ATOM 0 HA ARG A 118 -0.603 3.684 9.210 1.00 0.00 H new ATOM 0 HB2 ARG A 118 -0.628 6.041 10.046 1.00 0.00 H new ATOM 0 HB3 ARG A 118 -2.013 5.099 10.560 1.00 0.00 H new ATOM 0 HG2 ARG A 118 -1.085 4.817 12.788 1.00 0.00 H new ATOM 0 HG3 ARG A 118 0.438 5.534 12.301 1.00 0.00 H new ATOM 0 HD2 ARG A 118 -0.550 7.705 12.021 1.00 0.00 H new ATOM 0 HD3 ARG A 118 -2.177 7.058 12.088 1.00 0.00 H new ATOM 0 HE ARG A 118 -1.207 6.342 14.545 1.00 0.00 H new ATOM 0 HH11 ARG A 118 -1.182 9.366 12.725 1.00 0.00 H new ATOM 0 HH12 ARG A 118 -1.210 10.374 14.176 1.00 0.00 H new ATOM 0 HH21 ARG A 118 -1.245 7.643 16.404 1.00 0.00 H new ATOM 0 HH22 ARG A 118 -1.246 9.403 16.250 1.00 0.00 H new ATOM 965 N THR A 119 1.925 4.064 11.290 1.00 0.00 N ATOM 966 CA THR A 119 3.368 4.256 11.361 1.00 0.00 C ATOM 967 C THR A 119 4.083 3.463 10.273 1.00 0.00 C ATOM 968 O THR A 119 4.934 3.995 9.559 1.00 0.00 O ATOM 969 CB THR A 119 3.924 3.838 12.735 1.00 0.00 C ATOM 970 OG1 THR A 119 3.147 4.433 13.780 1.00 0.00 O ATOM 971 CG2 THR A 119 5.380 4.253 12.880 1.00 0.00 C ATOM 0 H THR A 119 1.482 3.858 12.185 1.00 0.00 H new ATOM 0 HA THR A 119 3.552 5.320 11.212 1.00 0.00 H new ATOM 0 HB THR A 119 3.863 2.752 12.811 1.00 0.00 H new ATOM 0 HG1 THR A 119 3.506 4.161 14.650 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.750 3.947 13.859 1.00 0.00 H new ATOM 0 HG22 THR A 119 5.974 3.774 12.101 1.00 0.00 H new ATOM 0 HG23 THR A 119 5.461 5.336 12.784 1.00 0.00 H new ATOM 979 N LEU A 120 3.732 2.187 10.151 1.00 0.00 N ATOM 980 CA LEU A 120 4.340 1.319 9.149 1.00 0.00 C ATOM 981 C LEU A 120 4.082 1.848 7.742 1.00 0.00 C ATOM 982 O LEU A 120 4.935 1.741 6.861 1.00 0.00 O ATOM 983 CB LEU A 120 3.794 -0.104 9.279 1.00 0.00 C ATOM 984 CG LEU A 120 3.875 -0.729 10.672 1.00 0.00 C ATOM 985 CD1 LEU A 120 2.930 -1.916 10.781 1.00 0.00 C ATOM 986 CD2 LEU A 120 5.303 -1.151 10.986 1.00 0.00 C ATOM 0 H LEU A 120 3.030 1.731 10.734 1.00 0.00 H new ATOM 0 HA LEU A 120 5.416 1.306 9.321 1.00 0.00 H new ATOM 0 HB2 LEU A 120 2.751 -0.102 8.964 1.00 0.00 H new ATOM 0 HB3 LEU A 120 4.336 -0.745 8.583 1.00 0.00 H new ATOM 0 HG LEU A 120 3.570 0.020 11.403 1.00 0.00 H new ATOM 0 HD11 LEU A 120 3.002 -2.348 11.779 1.00 0.00 H new ATOM 0 HD12 LEU A 120 1.907 -1.585 10.602 1.00 0.00 H new ATOM 0 HD13 LEU A 120 3.203 -2.668 10.040 1.00 0.00 H new ATOM 0 HD21 LEU A 120 5.341 -1.594 11.981 1.00 0.00 H new ATOM 0 HD22 LEU A 120 5.636 -1.883 10.250 1.00 0.00 H new ATOM 0 HD23 LEU A 120 5.956 -0.279 10.952 1.00 0.00 H new ATOM 998 N ALA A 121 2.901 2.422 7.538 1.00 0.00 N ATOM 999 CA ALA A 121 2.532 2.971 6.240 1.00 0.00 C ATOM 1000 C ALA A 121 3.444 4.131 5.855 1.00 0.00 C ATOM 1001 O ALA A 121 3.785 4.303 4.686 1.00 0.00 O ATOM 1002 CB ALA A 121 1.079 3.422 6.251 1.00 0.00 C ATOM 0 H ALA A 121 2.183 2.519 8.256 1.00 0.00 H new ATOM 0 HA ALA A 121 2.652 2.185 5.494 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.817 3.830 5.275 1.00 0.00 H new ATOM 0 HB2 ALA A 121 0.435 2.571 6.473 1.00 0.00 H new ATOM 0 HB3 ALA A 121 0.942 4.189 7.013 1.00 0.00 H new ATOM 1008 N GLU A 122 3.836 4.924 6.848 1.00 0.00 N ATOM 1009 CA GLU A 122 4.708 6.069 6.612 1.00 0.00 C ATOM 1010 C GLU A 122 6.116 5.613 6.242 1.00 0.00 C ATOM 1011 O GLU A 122 6.619 5.927 5.163 1.00 0.00 O ATOM 1012 CB GLU A 122 4.759 6.964 7.852 1.00 0.00 C ATOM 1013 CG GLU A 122 3.467 7.722 8.108 1.00 0.00 C ATOM 1014 CD GLU A 122 3.663 8.917 9.021 1.00 0.00 C ATOM 1015 OE1 GLU A 122 3.976 8.709 10.212 1.00 0.00 O ATOM 1016 OE2 GLU A 122 3.505 10.060 8.544 1.00 0.00 O ATOM 0 H GLU A 122 3.564 4.795 7.822 1.00 0.00 H new ATOM 0 HA GLU A 122 4.298 6.639 5.778 1.00 0.00 H new ATOM 0 HB2 GLU A 122 4.990 6.351 8.723 1.00 0.00 H new ATOM 0 HB3 GLU A 122 5.574 7.679 7.741 1.00 0.00 H new ATOM 0 HG2 GLU A 122 3.054 8.060 7.158 1.00 0.00 H new ATOM 0 HG3 GLU A 122 2.736 7.047 8.552 1.00 0.00 H new ATOM 1023 N ILE A 123 6.747 4.871 7.146 1.00 0.00 N ATOM 1024 CA ILE A 123 8.097 4.371 6.915 1.00 0.00 C ATOM 1025 C ILE A 123 8.199 3.666 5.566 1.00 0.00 C ATOM 1026 O ILE A 123 9.167 3.853 4.829 1.00 0.00 O ATOM 1027 CB ILE A 123 8.534 3.396 8.025 1.00 0.00 C ATOM 1028 CG1 ILE A 123 8.519 4.098 9.384 1.00 0.00 C ATOM 1029 CG2 ILE A 123 9.917 2.838 7.725 1.00 0.00 C ATOM 1030 CD1 ILE A 123 8.619 3.146 10.556 1.00 0.00 C ATOM 0 H ILE A 123 6.345 4.603 8.045 1.00 0.00 H new ATOM 0 HA ILE A 123 8.759 5.237 6.921 1.00 0.00 H new ATOM 0 HB ILE A 123 7.829 2.566 8.059 1.00 0.00 H new ATOM 0 HG12 ILE A 123 9.348 4.805 9.428 1.00 0.00 H new ATOM 0 HG13 ILE A 123 7.601 4.678 9.474 1.00 0.00 H new ATOM 0 HG21 ILE A 123 10.212 2.151 8.518 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.896 2.307 6.774 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.635 3.656 7.668 1.00 0.00 H new ATOM 0 HD11 ILE A 123 8.603 3.712 11.487 1.00 0.00 H new ATOM 0 HD12 ILE A 123 7.776 2.455 10.537 1.00 0.00 H new ATOM 0 HD13 ILE A 123 9.550 2.584 10.490 1.00 0.00 H new ATOM 1042 N ALA A 124 7.194 2.858 5.250 1.00 0.00 N ATOM 1043 CA ALA A 124 7.168 2.128 3.988 1.00 0.00 C ATOM 1044 C ALA A 124 6.819 3.052 2.826 1.00 0.00 C ATOM 1045 O ALA A 124 7.424 2.979 1.757 1.00 0.00 O ATOM 1046 CB ALA A 124 6.178 0.976 4.064 1.00 0.00 C ATOM 0 H ALA A 124 6.386 2.692 5.850 1.00 0.00 H new ATOM 0 HA ALA A 124 8.165 1.724 3.810 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.170 0.440 3.115 1.00 0.00 H new ATOM 0 HB2 ALA A 124 6.473 0.295 4.862 1.00 0.00 H new ATOM 0 HB3 ALA A 124 5.181 1.366 4.269 1.00 0.00 H new ATOM 1052 N LYS A 125 5.838 3.923 3.043 1.00 0.00 N ATOM 1053 CA LYS A 125 5.408 4.863 2.015 1.00 0.00 C ATOM 1054 C LYS A 125 6.599 5.619 1.436 1.00 0.00 C ATOM 1055 O LYS A 125 6.612 5.967 0.255 1.00 0.00 O ATOM 1056 CB LYS A 125 4.394 5.853 2.592 1.00 0.00 C ATOM 1057 CG LYS A 125 4.119 7.040 1.686 1.00 0.00 C ATOM 1058 CD LYS A 125 5.089 8.179 1.948 1.00 0.00 C ATOM 1059 CE LYS A 125 4.599 9.481 1.335 1.00 0.00 C ATOM 1060 NZ LYS A 125 5.724 10.407 1.026 1.00 0.00 N ATOM 0 H LYS A 125 5.326 3.997 3.922 1.00 0.00 H new ATOM 0 HA LYS A 125 4.936 4.295 1.213 1.00 0.00 H new ATOM 0 HB2 LYS A 125 3.458 5.330 2.785 1.00 0.00 H new ATOM 0 HB3 LYS A 125 4.760 6.217 3.552 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.195 6.729 0.644 1.00 0.00 H new ATOM 0 HG3 LYS A 125 3.098 7.388 1.841 1.00 0.00 H new ATOM 0 HD2 LYS A 125 5.219 8.308 3.023 1.00 0.00 H new ATOM 0 HD3 LYS A 125 6.067 7.927 1.537 1.00 0.00 H new ATOM 0 HE2 LYS A 125 4.044 9.266 0.422 1.00 0.00 H new ATOM 0 HE3 LYS A 125 3.906 9.968 2.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.348 11.283 0.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 6.238 10.633 1.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 6.372 9.953 0.351 1.00 0.00 H new ATOM 1074 N VAL A 126 7.600 5.868 2.274 1.00 0.00 N ATOM 1075 CA VAL A 126 8.798 6.581 1.844 1.00 0.00 C ATOM 1076 C VAL A 126 9.834 5.619 1.273 1.00 0.00 C ATOM 1077 O VAL A 126 10.213 5.721 0.107 1.00 0.00 O ATOM 1078 CB VAL A 126 9.430 7.369 3.007 1.00 0.00 C ATOM 1079 CG1 VAL A 126 10.777 7.941 2.594 1.00 0.00 C ATOM 1080 CG2 VAL A 126 8.493 8.472 3.474 1.00 0.00 C ATOM 0 H VAL A 126 7.606 5.587 3.254 1.00 0.00 H new ATOM 0 HA VAL A 126 8.489 7.281 1.067 1.00 0.00 H new ATOM 0 HB VAL A 126 9.593 6.686 3.840 1.00 0.00 H new ATOM 0 HG11 VAL A 126 11.208 8.494 3.428 1.00 0.00 H new ATOM 0 HG12 VAL A 126 11.447 7.128 2.313 1.00 0.00 H new ATOM 0 HG13 VAL A 126 10.643 8.611 1.745 1.00 0.00 H new ATOM 0 HG21 VAL A 126 8.955 9.018 4.296 1.00 0.00 H new ATOM 0 HG22 VAL A 126 8.296 9.156 2.649 1.00 0.00 H new ATOM 0 HG23 VAL A 126 7.555 8.033 3.813 1.00 0.00 H new ATOM 1090 N GLU A 127 10.288 4.686 2.104 1.00 0.00 N ATOM 1091 CA GLU A 127 11.282 3.706 1.681 1.00 0.00 C ATOM 1092 C GLU A 127 10.867 3.042 0.371 1.00 0.00 C ATOM 1093 O GLU A 127 11.639 2.998 -0.588 1.00 0.00 O ATOM 1094 CB GLU A 127 11.477 2.644 2.765 1.00 0.00 C ATOM 1095 CG GLU A 127 12.553 2.998 3.777 1.00 0.00 C ATOM 1096 CD GLU A 127 13.939 3.043 3.163 1.00 0.00 C ATOM 1097 OE1 GLU A 127 14.486 1.964 2.852 1.00 0.00 O ATOM 1098 OE2 GLU A 127 14.476 4.157 2.992 1.00 0.00 O ATOM 0 H GLU A 127 9.984 4.588 3.073 1.00 0.00 H new ATOM 0 HA GLU A 127 12.225 4.228 1.521 1.00 0.00 H new ATOM 0 HB2 GLU A 127 10.533 2.494 3.289 1.00 0.00 H new ATOM 0 HB3 GLU A 127 11.733 1.696 2.291 1.00 0.00 H new ATOM 0 HG2 GLU A 127 12.325 3.967 4.221 1.00 0.00 H new ATOM 0 HG3 GLU A 127 12.541 2.267 4.585 1.00 0.00 H new ATOM 1105 N LEU A 128 9.644 2.524 0.338 1.00 0.00 N ATOM 1106 CA LEU A 128 9.126 1.861 -0.853 1.00 0.00 C ATOM 1107 C LEU A 128 9.118 2.812 -2.046 1.00 0.00 C ATOM 1108 O LEU A 128 9.457 2.423 -3.164 1.00 0.00 O ATOM 1109 CB LEU A 128 7.712 1.337 -0.595 1.00 0.00 C ATOM 1110 CG LEU A 128 7.587 0.229 0.451 1.00 0.00 C ATOM 1111 CD1 LEU A 128 6.128 -0.143 0.663 1.00 0.00 C ATOM 1112 CD2 LEU A 128 8.395 -0.991 0.033 1.00 0.00 C ATOM 0 H LEU A 128 8.993 2.551 1.123 1.00 0.00 H new ATOM 0 HA LEU A 128 9.781 1.022 -1.085 1.00 0.00 H new ATOM 0 HB2 LEU A 128 7.087 2.174 -0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 128 7.306 0.968 -1.537 1.00 0.00 H new ATOM 0 HG LEU A 128 7.987 0.599 1.395 1.00 0.00 H new ATOM 0 HD11 LEU A 128 6.059 -0.933 1.411 1.00 0.00 H new ATOM 0 HD12 LEU A 128 5.576 0.732 1.007 1.00 0.00 H new ATOM 0 HD13 LEU A 128 5.702 -0.495 -0.277 1.00 0.00 H new ATOM 0 HD21 LEU A 128 8.295 -1.770 0.789 1.00 0.00 H new ATOM 0 HD22 LEU A 128 8.025 -1.363 -0.922 1.00 0.00 H new ATOM 0 HD23 LEU A 128 9.445 -0.715 -0.067 1.00 0.00 H new ATOM 1124 N ASP A 129 8.732 4.059 -1.799 1.00 0.00 N ATOM 1125 CA ASP A 129 8.684 5.066 -2.852 1.00 0.00 C ATOM 1126 C ASP A 129 10.005 5.120 -3.614 1.00 0.00 C ATOM 1127 O ASP A 129 11.066 4.843 -3.056 1.00 0.00 O ATOM 1128 CB ASP A 129 8.367 6.440 -2.259 1.00 0.00 C ATOM 1129 CG ASP A 129 8.290 7.523 -3.317 1.00 0.00 C ATOM 1130 OD1 ASP A 129 9.335 8.139 -3.613 1.00 0.00 O ATOM 1131 OD2 ASP A 129 7.184 7.755 -3.848 1.00 0.00 O ATOM 0 H ASP A 129 8.448 4.396 -0.879 1.00 0.00 H new ATOM 0 HA ASP A 129 7.894 4.789 -3.550 1.00 0.00 H new ATOM 0 HB2 ASP A 129 7.419 6.391 -1.723 1.00 0.00 H new ATOM 0 HB3 ASP A 129 9.133 6.703 -1.529 1.00 0.00 H new ATOM 1136 N ASN A 130 9.931 5.477 -4.892 1.00 0.00 N ATOM 1137 CA ASN A 130 11.120 5.565 -5.731 1.00 0.00 C ATOM 1138 C ASN A 130 11.968 4.303 -5.607 1.00 0.00 C ATOM 1139 O ASN A 130 13.195 4.372 -5.531 1.00 0.00 O ATOM 1140 CB ASN A 130 11.951 6.791 -5.347 1.00 0.00 C ATOM 1141 CG ASN A 130 12.639 6.626 -4.006 1.00 0.00 C ATOM 1142 OD1 ASN A 130 13.735 6.072 -3.921 1.00 0.00 O ATOM 1143 ND2 ASN A 130 11.995 7.107 -2.948 1.00 0.00 N ATOM 0 H ASN A 130 9.060 5.710 -5.369 1.00 0.00 H new ATOM 0 HA ASN A 130 10.796 5.664 -6.767 1.00 0.00 H new ATOM 0 HB2 ASN A 130 12.701 6.974 -6.117 1.00 0.00 H new ATOM 0 HB3 ASN A 130 11.306 7.669 -5.316 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.408 7.024 -2.019 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.088 7.559 -3.065 1.00 0.00 H new ATOM 1150 N MET A 131 11.306 3.151 -5.588 1.00 0.00 N ATOM 1151 CA MET A 131 11.999 1.873 -5.475 1.00 0.00 C ATOM 1152 C MET A 131 11.908 1.088 -6.780 1.00 0.00 C ATOM 1153 O MET A 131 10.823 0.789 -7.278 1.00 0.00 O ATOM 1154 CB MET A 131 11.411 1.049 -4.328 1.00 0.00 C ATOM 1155 CG MET A 131 12.102 -0.290 -4.124 1.00 0.00 C ATOM 1156 SD MET A 131 11.298 -1.302 -2.868 1.00 0.00 S ATOM 1157 CE MET A 131 10.173 -2.264 -3.877 1.00 0.00 C ATOM 0 H MET A 131 10.291 3.076 -5.649 1.00 0.00 H new ATOM 0 HA MET A 131 13.049 2.075 -5.266 1.00 0.00 H new ATOM 0 HB2 MET A 131 11.477 1.627 -3.406 1.00 0.00 H new ATOM 0 HB3 MET A 131 10.352 0.876 -4.521 1.00 0.00 H new ATOM 0 HG2 MET A 131 12.117 -0.834 -5.068 1.00 0.00 H new ATOM 0 HG3 MET A 131 13.140 -0.119 -3.838 1.00 0.00 H new ATOM 0 HE1 MET A 131 9.146 -2.049 -3.583 1.00 0.00 H new ATOM 0 HE2 MET A 131 10.312 -2.004 -4.926 1.00 0.00 H new ATOM 0 HE3 MET A 131 10.376 -3.326 -3.737 1.00 0.00 H new ATOM 1167 N PRO A 132 13.074 0.745 -7.348 1.00 0.00 N ATOM 1168 CA PRO A 132 13.152 -0.010 -8.602 1.00 0.00 C ATOM 1169 C PRO A 132 12.694 -1.456 -8.437 1.00 0.00 C ATOM 1170 O PRO A 132 13.177 -2.175 -7.562 1.00 0.00 O ATOM 1171 CB PRO A 132 14.640 0.043 -8.956 1.00 0.00 C ATOM 1172 CG PRO A 132 15.333 0.236 -7.652 1.00 0.00 C ATOM 1173 CD PRO A 132 14.406 1.068 -6.809 1.00 0.00 C ATOM 0 HA PRO A 132 12.502 0.408 -9.371 1.00 0.00 H new ATOM 0 HB2 PRO A 132 14.964 -0.876 -9.444 1.00 0.00 H new ATOM 0 HB3 PRO A 132 14.855 0.861 -9.643 1.00 0.00 H new ATOM 0 HG2 PRO A 132 15.540 -0.722 -7.175 1.00 0.00 H new ATOM 0 HG3 PRO A 132 16.291 0.737 -7.790 1.00 0.00 H new ATOM 0 HD2 PRO A 132 14.485 0.812 -5.752 1.00 0.00 H new ATOM 0 HD3 PRO A 132 14.628 2.131 -6.897 1.00 0.00 H new ATOM 1181 N LEU A 133 11.762 -1.876 -9.285 1.00 0.00 N ATOM 1182 CA LEU A 133 11.239 -3.237 -9.234 1.00 0.00 C ATOM 1183 C LEU A 133 11.275 -3.886 -10.614 1.00 0.00 C ATOM 1184 O LEU A 133 10.478 -3.550 -11.490 1.00 0.00 O ATOM 1185 CB LEU A 133 9.807 -3.235 -8.696 1.00 0.00 C ATOM 1186 CG LEU A 133 9.069 -4.573 -8.746 1.00 0.00 C ATOM 1187 CD1 LEU A 133 9.623 -5.528 -7.699 1.00 0.00 C ATOM 1188 CD2 LEU A 133 7.575 -4.366 -8.545 1.00 0.00 C ATOM 0 H LEU A 133 11.353 -1.294 -10.016 1.00 0.00 H new ATOM 0 HA LEU A 133 11.872 -3.818 -8.563 1.00 0.00 H new ATOM 0 HB2 LEU A 133 9.830 -2.894 -7.661 1.00 0.00 H new ATOM 0 HB3 LEU A 133 9.229 -2.503 -9.260 1.00 0.00 H new ATOM 0 HG LEU A 133 9.225 -5.015 -9.730 1.00 0.00 H new ATOM 0 HD11 LEU A 133 9.086 -6.475 -7.750 1.00 0.00 H new ATOM 0 HD12 LEU A 133 10.682 -5.701 -7.889 1.00 0.00 H new ATOM 0 HD13 LEU A 133 9.499 -5.093 -6.707 1.00 0.00 H new ATOM 0 HD21 LEU A 133 7.066 -5.329 -8.584 1.00 0.00 H new ATOM 0 HD22 LEU A 133 7.399 -3.901 -7.575 1.00 0.00 H new ATOM 0 HD23 LEU A 133 7.188 -3.719 -9.332 1.00 0.00 H new ATOM 1200 N ARG A 134 12.203 -4.819 -10.799 1.00 0.00 N ATOM 1201 CA ARG A 134 12.343 -5.516 -12.072 1.00 0.00 C ATOM 1202 C ARG A 134 12.690 -4.540 -13.191 1.00 0.00 C ATOM 1203 O ARG A 134 12.237 -4.692 -14.325 1.00 0.00 O ATOM 1204 CB ARG A 134 11.051 -6.261 -12.413 1.00 0.00 C ATOM 1205 CG ARG A 134 10.865 -7.550 -11.628 1.00 0.00 C ATOM 1206 CD ARG A 134 11.617 -8.706 -12.269 1.00 0.00 C ATOM 1207 NE ARG A 134 11.668 -9.876 -11.397 1.00 0.00 N ATOM 1208 CZ ARG A 134 12.189 -11.042 -11.761 1.00 0.00 C ATOM 1209 NH1 ARG A 134 12.702 -11.193 -12.974 1.00 0.00 N ATOM 1210 NH2 ARG A 134 12.199 -12.061 -10.911 1.00 0.00 N ATOM 0 H ARG A 134 12.869 -5.110 -10.083 1.00 0.00 H new ATOM 0 HA ARG A 134 13.156 -6.236 -11.977 1.00 0.00 H new ATOM 0 HB2 ARG A 134 10.202 -5.604 -12.223 1.00 0.00 H new ATOM 0 HB3 ARG A 134 11.044 -6.490 -13.479 1.00 0.00 H new ATOM 0 HG2 ARG A 134 11.216 -7.409 -10.606 1.00 0.00 H new ATOM 0 HG3 ARG A 134 9.804 -7.792 -11.570 1.00 0.00 H new ATOM 0 HD2 ARG A 134 11.135 -8.975 -13.209 1.00 0.00 H new ATOM 0 HD3 ARG A 134 12.632 -8.389 -12.510 1.00 0.00 H new ATOM 0 HE ARG A 134 11.282 -9.793 -10.456 1.00 0.00 H new ATOM 0 HH11 ARG A 134 12.697 -10.412 -13.631 1.00 0.00 H new ATOM 0 HH12 ARG A 134 13.102 -12.090 -13.251 1.00 0.00 H new ATOM 0 HH21 ARG A 134 11.806 -11.949 -9.976 1.00 0.00 H new ATOM 0 HH22 ARG A 134 12.600 -12.956 -11.192 1.00 0.00 H new ATOM 1224 N GLY A 135 13.499 -3.536 -12.864 1.00 0.00 N ATOM 1225 CA GLY A 135 13.893 -2.549 -13.853 1.00 0.00 C ATOM 1226 C GLY A 135 12.791 -1.551 -14.147 1.00 0.00 C ATOM 1227 O GLY A 135 12.766 -0.938 -15.215 1.00 0.00 O ATOM 0 H GLY A 135 13.888 -3.389 -11.933 1.00 0.00 H new ATOM 0 HA2 GLY A 135 14.776 -2.017 -13.499 1.00 0.00 H new ATOM 0 HA3 GLY A 135 14.175 -3.056 -14.776 1.00 0.00 H new ATOM 1231 N LYS A 136 11.874 -1.387 -13.199 1.00 0.00 N ATOM 1232 CA LYS A 136 10.763 -0.457 -13.361 1.00 0.00 C ATOM 1233 C LYS A 136 10.659 0.479 -12.161 1.00 0.00 C ATOM 1234 O LYS A 136 11.220 0.208 -11.100 1.00 0.00 O ATOM 1235 CB LYS A 136 9.451 -1.224 -13.538 1.00 0.00 C ATOM 1236 CG LYS A 136 9.487 -2.237 -14.670 1.00 0.00 C ATOM 1237 CD LYS A 136 9.091 -1.607 -15.995 1.00 0.00 C ATOM 1238 CE LYS A 136 8.595 -2.652 -16.982 1.00 0.00 C ATOM 1239 NZ LYS A 136 9.712 -3.461 -17.543 1.00 0.00 N ATOM 0 H LYS A 136 11.879 -1.887 -12.310 1.00 0.00 H new ATOM 0 HA LYS A 136 10.949 0.142 -14.252 1.00 0.00 H new ATOM 0 HB2 LYS A 136 9.213 -1.740 -12.608 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.646 -0.513 -13.723 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.489 -2.658 -14.751 1.00 0.00 H new ATOM 0 HG3 LYS A 136 8.812 -3.062 -14.442 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.311 -0.864 -15.827 1.00 0.00 H new ATOM 0 HD3 LYS A 136 9.946 -1.081 -16.419 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.883 -3.311 -16.485 1.00 0.00 H new ATOM 0 HE3 LYS A 136 8.060 -2.159 -17.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.332 -4.162 -18.211 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 10.379 -2.836 -18.039 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.207 -3.952 -16.771 1.00 0.00 H new ATOM 1253 N GLN A 137 9.936 1.581 -12.337 1.00 0.00 N ATOM 1254 CA GLN A 137 9.758 2.556 -11.268 1.00 0.00 C ATOM 1255 C GLN A 137 8.436 2.331 -10.541 1.00 0.00 C ATOM 1256 O GLN A 137 7.396 2.127 -11.169 1.00 0.00 O ATOM 1257 CB GLN A 137 9.808 3.977 -11.832 1.00 0.00 C ATOM 1258 CG GLN A 137 8.654 4.302 -12.767 1.00 0.00 C ATOM 1259 CD GLN A 137 8.958 5.468 -13.686 1.00 0.00 C ATOM 1260 OE1 GLN A 137 8.211 6.446 -13.735 1.00 0.00 O ATOM 1261 NE2 GLN A 137 10.060 5.372 -14.421 1.00 0.00 N ATOM 0 H GLN A 137 9.465 1.820 -13.209 1.00 0.00 H new ATOM 0 HA GLN A 137 10.571 2.427 -10.554 1.00 0.00 H new ATOM 0 HB2 GLN A 137 9.806 4.687 -11.005 1.00 0.00 H new ATOM 0 HB3 GLN A 137 10.748 4.114 -12.367 1.00 0.00 H new ATOM 0 HG2 GLN A 137 8.419 3.423 -13.367 1.00 0.00 H new ATOM 0 HG3 GLN A 137 7.767 4.531 -12.177 1.00 0.00 H new ATOM 0 HE21 GLN A 137 10.650 4.543 -14.349 1.00 0.00 H new ATOM 0 HE22 GLN A 137 10.316 6.127 -15.057 1.00 0.00 H new ATOM 1270 N LEU A 138 8.483 2.369 -9.214 1.00 0.00 N ATOM 1271 CA LEU A 138 7.289 2.169 -8.400 1.00 0.00 C ATOM 1272 C LEU A 138 6.803 3.491 -7.812 1.00 0.00 C ATOM 1273 O LEU A 138 7.604 4.365 -7.480 1.00 0.00 O ATOM 1274 CB LEU A 138 7.576 1.173 -7.275 1.00 0.00 C ATOM 1275 CG LEU A 138 7.601 -0.303 -7.676 1.00 0.00 C ATOM 1276 CD1 LEU A 138 8.289 -1.135 -6.605 1.00 0.00 C ATOM 1277 CD2 LEU A 138 6.189 -0.812 -7.926 1.00 0.00 C ATOM 0 H LEU A 138 9.335 2.536 -8.679 1.00 0.00 H new ATOM 0 HA LEU A 138 6.505 1.767 -9.042 1.00 0.00 H new ATOM 0 HB2 LEU A 138 8.539 1.425 -6.831 1.00 0.00 H new ATOM 0 HB3 LEU A 138 6.823 1.305 -6.499 1.00 0.00 H new ATOM 0 HG LEU A 138 8.169 -0.399 -8.602 1.00 0.00 H new ATOM 0 HD11 LEU A 138 8.297 -2.182 -6.907 1.00 0.00 H new ATOM 0 HD12 LEU A 138 9.314 -0.786 -6.476 1.00 0.00 H new ATOM 0 HD13 LEU A 138 7.750 -1.034 -5.663 1.00 0.00 H new ATOM 0 HD21 LEU A 138 6.226 -1.864 -8.210 1.00 0.00 H new ATOM 0 HD22 LEU A 138 5.597 -0.702 -7.018 1.00 0.00 H new ATOM 0 HD23 LEU A 138 5.731 -0.235 -8.730 1.00 0.00 H new ATOM 1289 N ARG A 139 5.488 3.627 -7.685 1.00 0.00 N ATOM 1290 CA ARG A 139 4.895 4.841 -7.136 1.00 0.00 C ATOM 1291 C ARG A 139 4.071 4.529 -5.890 1.00 0.00 C ATOM 1292 O ARG A 139 2.990 3.947 -5.978 1.00 0.00 O ATOM 1293 CB ARG A 139 4.015 5.523 -8.185 1.00 0.00 C ATOM 1294 CG ARG A 139 3.191 6.675 -7.632 1.00 0.00 C ATOM 1295 CD ARG A 139 3.941 7.994 -7.730 1.00 0.00 C ATOM 1296 NE ARG A 139 3.810 8.602 -9.051 1.00 0.00 N ATOM 1297 CZ ARG A 139 4.223 9.831 -9.339 1.00 0.00 C ATOM 1298 NH1 ARG A 139 4.791 10.579 -8.403 1.00 0.00 N ATOM 1299 NH2 ARG A 139 4.069 10.314 -10.565 1.00 0.00 N ATOM 0 H ARG A 139 4.812 2.912 -7.955 1.00 0.00 H new ATOM 0 HA ARG A 139 5.704 5.516 -6.856 1.00 0.00 H new ATOM 0 HB2 ARG A 139 4.647 5.894 -8.992 1.00 0.00 H new ATOM 0 HB3 ARG A 139 3.343 4.783 -8.620 1.00 0.00 H new ATOM 0 HG2 ARG A 139 2.252 6.748 -8.180 1.00 0.00 H new ATOM 0 HG3 ARG A 139 2.938 6.476 -6.591 1.00 0.00 H new ATOM 0 HD2 ARG A 139 3.563 8.683 -6.975 1.00 0.00 H new ATOM 0 HD3 ARG A 139 4.996 7.828 -7.510 1.00 0.00 H new ATOM 0 HE ARG A 139 3.377 8.053 -9.794 1.00 0.00 H new ATOM 0 HH11 ARG A 139 4.912 10.211 -7.459 1.00 0.00 H new ATOM 0 HH12 ARG A 139 5.107 11.523 -8.627 1.00 0.00 H new ATOM 0 HH21 ARG A 139 3.633 9.741 -11.288 1.00 0.00 H new ATOM 0 HH22 ARG A 139 4.387 11.258 -10.785 1.00 0.00 H new ATOM 1313 N VAL A 140 4.590 4.919 -4.731 1.00 0.00 N ATOM 1314 CA VAL A 140 3.903 4.682 -3.467 1.00 0.00 C ATOM 1315 C VAL A 140 3.327 5.976 -2.903 1.00 0.00 C ATOM 1316 O VAL A 140 4.068 6.870 -2.492 1.00 0.00 O ATOM 1317 CB VAL A 140 4.848 4.056 -2.424 1.00 0.00 C ATOM 1318 CG1 VAL A 140 4.086 3.710 -1.153 1.00 0.00 C ATOM 1319 CG2 VAL A 140 5.532 2.824 -2.997 1.00 0.00 C ATOM 0 H VAL A 140 5.484 5.401 -4.641 1.00 0.00 H new ATOM 0 HA VAL A 140 3.090 3.986 -3.674 1.00 0.00 H new ATOM 0 HB VAL A 140 5.617 4.786 -2.171 1.00 0.00 H new ATOM 0 HG11 VAL A 140 4.770 3.269 -0.428 1.00 0.00 H new ATOM 0 HG12 VAL A 140 3.647 4.615 -0.734 1.00 0.00 H new ATOM 0 HG13 VAL A 140 3.295 2.997 -1.386 1.00 0.00 H new ATOM 0 HG21 VAL A 140 6.196 2.394 -2.247 1.00 0.00 H new ATOM 0 HG22 VAL A 140 4.779 2.088 -3.279 1.00 0.00 H new ATOM 0 HG23 VAL A 140 6.112 3.105 -3.876 1.00 0.00 H new ATOM 1329 N ARG A 141 2.002 6.069 -2.885 1.00 0.00 N ATOM 1330 CA ARG A 141 1.326 7.255 -2.372 1.00 0.00 C ATOM 1331 C ARG A 141 0.142 6.867 -1.491 1.00 0.00 C ATOM 1332 O ARG A 141 -0.457 5.806 -1.669 1.00 0.00 O ATOM 1333 CB ARG A 141 0.848 8.136 -3.528 1.00 0.00 C ATOM 1334 CG ARG A 141 1.973 8.636 -4.419 1.00 0.00 C ATOM 1335 CD ARG A 141 2.618 9.890 -3.850 1.00 0.00 C ATOM 1336 NE ARG A 141 1.743 11.054 -3.960 1.00 0.00 N ATOM 1337 CZ ARG A 141 1.871 12.144 -3.211 1.00 0.00 C ATOM 1338 NH1 ARG A 141 2.833 12.218 -2.302 1.00 0.00 N ATOM 1339 NH2 ARG A 141 1.035 13.162 -3.371 1.00 0.00 N ATOM 0 H ARG A 141 1.375 5.338 -3.220 1.00 0.00 H new ATOM 0 HA ARG A 141 2.039 7.816 -1.767 1.00 0.00 H new ATOM 0 HB2 ARG A 141 0.139 7.572 -4.134 1.00 0.00 H new ATOM 0 HB3 ARG A 141 0.310 8.992 -3.122 1.00 0.00 H new ATOM 0 HG2 ARG A 141 2.726 7.856 -4.529 1.00 0.00 H new ATOM 0 HG3 ARG A 141 1.584 8.846 -5.415 1.00 0.00 H new ATOM 0 HD2 ARG A 141 2.871 9.724 -2.803 1.00 0.00 H new ATOM 0 HD3 ARG A 141 3.552 10.088 -4.376 1.00 0.00 H new ATOM 0 HE ARG A 141 0.992 11.029 -4.650 1.00 0.00 H new ATOM 0 HH11 ARG A 141 3.477 11.437 -2.176 1.00 0.00 H new ATOM 0 HH12 ARG A 141 2.929 13.056 -1.728 1.00 0.00 H new ATOM 0 HH21 ARG A 141 0.293 13.108 -4.069 1.00 0.00 H new ATOM 0 HH22 ARG A 141 1.134 13.998 -2.796 1.00 0.00 H new ATOM 1353 N PHE A 142 -0.188 7.733 -0.538 1.00 0.00 N ATOM 1354 CA PHE A 142 -1.299 7.481 0.372 1.00 0.00 C ATOM 1355 C PHE A 142 -2.626 7.463 -0.380 1.00 0.00 C ATOM 1356 O PHE A 142 -3.022 8.459 -0.985 1.00 0.00 O ATOM 1357 CB PHE A 142 -1.337 8.545 1.471 1.00 0.00 C ATOM 1358 CG PHE A 142 -0.341 8.307 2.570 1.00 0.00 C ATOM 1359 CD1 PHE A 142 -0.508 7.259 3.460 1.00 0.00 C ATOM 1360 CD2 PHE A 142 0.763 9.132 2.712 1.00 0.00 C ATOM 1361 CE1 PHE A 142 0.407 7.039 4.473 1.00 0.00 C ATOM 1362 CE2 PHE A 142 1.682 8.917 3.722 1.00 0.00 C ATOM 1363 CZ PHE A 142 1.504 7.868 4.603 1.00 0.00 C ATOM 0 H PHE A 142 0.298 8.615 -0.376 1.00 0.00 H new ATOM 0 HA PHE A 142 -1.147 6.503 0.828 1.00 0.00 H new ATOM 0 HB2 PHE A 142 -1.149 9.522 1.026 1.00 0.00 H new ATOM 0 HB3 PHE A 142 -2.339 8.577 1.900 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.363 6.606 3.362 1.00 0.00 H new ATOM 0 HD2 PHE A 142 0.907 9.953 2.025 1.00 0.00 H new ATOM 0 HE1 PHE A 142 0.264 6.220 5.162 1.00 0.00 H new ATOM 0 HE2 PHE A 142 2.538 9.568 3.822 1.00 0.00 H new ATOM 0 HZ PHE A 142 2.221 7.696 5.392 1.00 0.00 H new ATOM 1373 N ALA A 143 -3.308 6.323 -0.339 1.00 0.00 N ATOM 1374 CA ALA A 143 -4.591 6.175 -1.015 1.00 0.00 C ATOM 1375 C ALA A 143 -5.750 6.410 -0.051 1.00 0.00 C ATOM 1376 O ALA A 143 -6.802 5.780 -0.165 1.00 0.00 O ATOM 1377 CB ALA A 143 -4.699 4.795 -1.646 1.00 0.00 C ATOM 0 H ALA A 143 -2.993 5.488 0.155 1.00 0.00 H new ATOM 0 HA ALA A 143 -4.648 6.928 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 143 -5.662 4.698 -2.147 1.00 0.00 H new ATOM 0 HB2 ALA A 143 -3.897 4.663 -2.372 1.00 0.00 H new ATOM 0 HB3 ALA A 143 -4.615 4.033 -0.871 1.00 0.00 H new