USER MOD reduce.3.24.130724 H: found=0, std=0, add=591, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 590 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 153 ASN : amide:sc= 0.813 K(o=1.8,f=-0.56!) USER MOD Set 1.2: A 157 GLN : amide:sc= 1.01 K(o=1.8,f=-0.14) USER MOD Set 2.1: A 98 HIS : no HD1:sc= -0.129 K(o=0.33,f=-0.93) USER MOD Set 2.2: A 144 SER OG : rot 132:sc= 0.454 USER MOD Single : A 96 HIS : no HD1:sc= -0.694 K(o=-0.69,f=-0.082) USER MOD Single : A 105 SER OG : rot 180:sc= -0.134 USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ -148:sc= 0.17 (180deg=0.0294) USER MOD Single : A 132 MET CE :methyl -171:sc=-0.00161 (180deg=-0.119) USER MOD Single : A 134 THR OG1 : rot -88:sc= 1.04 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN : amide:sc= -1.34 K(o=-1.3,f=-0.048) USER MOD Single : A 158 MET CE :methyl -156:sc= -0.692 (180deg=-1.53) USER MOD Single : A 161 GLN : amide:sc= -0.43 K(o=-0.43,f=-1.1) USER MOD Single : A 167 GLN : amide:sc= 0.142 X(o=0.14,f=-0.0074) USER MOD Single : A 170 THR OG1 : rot 136:sc= 0.673 USER MOD Single : A 171 ASN : amide:sc= -0.486 X(o=-0.49,f=-0.74) USER MOD ----------------------------------------------------------------- ATOM 178 N HIS A 96 0.937 13.554 -6.941 1.00 0.00 N ATOM 179 CA HIS A 96 0.429 12.216 -7.219 1.00 0.00 C ATOM 180 C HIS A 96 -0.675 11.896 -6.204 1.00 0.00 C ATOM 181 O HIS A 96 -0.889 12.659 -5.252 1.00 0.00 O ATOM 182 CB HIS A 96 1.601 11.216 -7.208 1.00 0.00 C ATOM 183 CG HIS A 96 2.604 11.404 -8.332 1.00 0.00 C ATOM 184 ND1 HIS A 96 3.796 10.687 -8.473 1.00 0.00 N ATOM 185 CD2 HIS A 96 2.475 12.240 -9.408 1.00 0.00 C ATOM 186 CE1 HIS A 96 4.319 11.058 -9.652 1.00 0.00 C ATOM 187 NE2 HIS A 96 3.563 12.015 -10.220 1.00 0.00 N ATOM 0 HA HIS A 96 -0.020 12.147 -8.210 1.00 0.00 H new ATOM 0 HB2 HIS A 96 2.123 11.299 -6.255 1.00 0.00 H new ATOM 0 HB3 HIS A 96 1.199 10.204 -7.263 1.00 0.00 H new ATOM 0 HD2 HIS A 96 1.673 12.942 -9.586 1.00 0.00 H new ATOM 0 HE1 HIS A 96 5.219 10.647 -10.084 1.00 0.00 H new ATOM 0 HE2 HIS A 96 3.762 12.491 -11.100 1.00 0.00 H new ATOM 195 N PHE A 97 -1.362 10.767 -6.389 1.00 0.00 N ATOM 196 CA PHE A 97 -2.461 10.309 -5.547 1.00 0.00 C ATOM 197 C PHE A 97 -2.218 8.898 -5.023 1.00 0.00 C ATOM 198 O PHE A 97 -2.318 7.927 -5.773 1.00 0.00 O ATOM 199 CB PHE A 97 -3.774 10.383 -6.339 1.00 0.00 C ATOM 200 CG PHE A 97 -4.227 11.805 -6.562 1.00 0.00 C ATOM 201 CD1 PHE A 97 -3.585 12.583 -7.539 1.00 0.00 C ATOM 202 CD2 PHE A 97 -5.201 12.386 -5.727 1.00 0.00 C ATOM 203 CE1 PHE A 97 -3.855 13.951 -7.624 1.00 0.00 C ATOM 204 CE2 PHE A 97 -5.504 13.753 -5.851 1.00 0.00 C ATOM 205 CZ PHE A 97 -4.813 14.542 -6.785 1.00 0.00 C ATOM 0 H PHE A 97 -1.159 10.127 -7.157 1.00 0.00 H new ATOM 0 HA PHE A 97 -2.528 10.962 -4.677 1.00 0.00 H new ATOM 0 HB2 PHE A 97 -3.643 9.890 -7.302 1.00 0.00 H new ATOM 0 HB3 PHE A 97 -4.550 9.836 -5.804 1.00 0.00 H new ATOM 0 HD1 PHE A 97 -2.885 12.125 -8.222 1.00 0.00 H new ATOM 0 HD2 PHE A 97 -5.714 11.782 -4.993 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -3.323 14.559 -8.341 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -6.267 14.196 -5.229 1.00 0.00 H new ATOM 0 HZ PHE A 97 -5.018 15.600 -6.858 1.00 0.00 H new ATOM 215 N HIS A 98 -1.906 8.791 -3.730 1.00 0.00 N ATOM 216 CA HIS A 98 -1.659 7.537 -3.046 1.00 0.00 C ATOM 217 C HIS A 98 -2.969 6.914 -2.570 1.00 0.00 C ATOM 218 O HIS A 98 -3.763 7.556 -1.869 1.00 0.00 O ATOM 219 CB HIS A 98 -0.736 7.770 -1.847 1.00 0.00 C ATOM 220 CG HIS A 98 0.552 8.455 -2.208 1.00 0.00 C ATOM 221 ND1 HIS A 98 0.723 9.803 -2.527 1.00 0.00 N ATOM 222 CD2 HIS A 98 1.734 7.814 -2.363 1.00 0.00 C ATOM 223 CE1 HIS A 98 2.017 9.932 -2.858 1.00 0.00 C ATOM 224 NE2 HIS A 98 2.650 8.754 -2.760 1.00 0.00 N ATOM 0 H HIS A 98 -1.818 9.603 -3.119 1.00 0.00 H new ATOM 0 HA HIS A 98 -1.181 6.852 -3.746 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -1.262 8.370 -1.104 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -0.510 6.811 -1.380 1.00 0.00 H new ATOM 0 HD2 HIS A 98 1.920 6.762 -2.204 1.00 0.00 H new ATOM 0 HE1 HIS A 98 2.484 10.857 -3.162 1.00 0.00 H new ATOM 0 HE2 HIS A 98 3.639 8.587 -2.948 1.00 0.00 H new ATOM 232 N VAL A 99 -3.157 5.650 -2.919 1.00 0.00 N ATOM 233 CA VAL A 99 -4.280 4.796 -2.600 1.00 0.00 C ATOM 234 C VAL A 99 -3.766 3.727 -1.640 1.00 0.00 C ATOM 235 O VAL A 99 -2.637 3.249 -1.769 1.00 0.00 O ATOM 236 CB VAL A 99 -4.808 4.129 -3.893 1.00 0.00 C ATOM 237 CG1 VAL A 99 -5.944 3.136 -3.612 1.00 0.00 C ATOM 238 CG2 VAL A 99 -5.320 5.161 -4.899 1.00 0.00 C ATOM 0 H VAL A 99 -2.464 5.157 -3.482 1.00 0.00 H new ATOM 0 HA VAL A 99 -5.093 5.366 -2.150 1.00 0.00 H new ATOM 0 HB VAL A 99 -3.955 3.596 -4.312 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -6.281 2.694 -4.550 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -5.584 2.349 -2.949 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -6.775 3.658 -3.138 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -5.681 4.651 -5.792 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -6.134 5.731 -4.452 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -4.510 5.837 -5.171 1.00 0.00 H new ATOM 248 N PHE A 100 -4.576 3.423 -0.635 1.00 0.00 N ATOM 249 CA PHE A 100 -4.357 2.407 0.377 1.00 0.00 C ATOM 250 C PHE A 100 -5.039 1.137 -0.110 1.00 0.00 C ATOM 251 O PHE A 100 -6.130 1.214 -0.687 1.00 0.00 O ATOM 252 CB PHE A 100 -4.998 2.864 1.704 1.00 0.00 C ATOM 253 CG PHE A 100 -5.333 1.714 2.640 1.00 0.00 C ATOM 254 CD1 PHE A 100 -4.376 1.033 3.415 1.00 0.00 C ATOM 255 CD2 PHE A 100 -6.647 1.214 2.572 1.00 0.00 C ATOM 256 CE1 PHE A 100 -4.753 -0.127 4.128 1.00 0.00 C ATOM 257 CE2 PHE A 100 -7.017 0.059 3.269 1.00 0.00 C ATOM 258 CZ PHE A 100 -6.072 -0.621 4.049 1.00 0.00 C ATOM 0 H PHE A 100 -5.460 3.913 -0.499 1.00 0.00 H new ATOM 0 HA PHE A 100 -3.293 2.237 0.542 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -4.318 3.549 2.211 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -5.908 3.422 1.486 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -3.360 1.395 3.464 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -7.382 1.731 1.972 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -4.025 -0.640 4.739 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -8.031 -0.309 3.206 1.00 0.00 H new ATOM 0 HZ PHE A 100 -6.351 -1.516 4.585 1.00 0.00 H new ATOM 268 N VAL A 101 -4.414 -0.012 0.141 1.00 0.00 N ATOM 269 CA VAL A 101 -4.948 -1.312 -0.216 1.00 0.00 C ATOM 270 C VAL A 101 -4.698 -2.225 0.986 1.00 0.00 C ATOM 271 O VAL A 101 -3.606 -2.202 1.550 1.00 0.00 O ATOM 272 CB VAL A 101 -4.336 -1.887 -1.507 1.00 0.00 C ATOM 273 CG1 VAL A 101 -5.249 -3.017 -1.992 1.00 0.00 C ATOM 274 CG2 VAL A 101 -4.163 -0.886 -2.662 1.00 0.00 C ATOM 0 H VAL A 101 -3.508 -0.059 0.606 1.00 0.00 H new ATOM 0 HA VAL A 101 -6.012 -1.228 -0.438 1.00 0.00 H new ATOM 0 HB VAL A 101 -3.330 -2.214 -1.245 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -4.842 -3.446 -2.907 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -5.311 -3.789 -1.225 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -6.245 -2.621 -2.189 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -3.725 -1.394 -3.521 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -5.135 -0.478 -2.939 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.506 -0.076 -2.346 1.00 0.00 H new ATOM 284 N GLY A 102 -5.664 -3.051 1.379 1.00 0.00 N ATOM 285 CA GLY A 102 -5.541 -3.972 2.501 1.00 0.00 C ATOM 286 C GLY A 102 -6.172 -5.323 2.197 1.00 0.00 C ATOM 287 O GLY A 102 -6.748 -5.525 1.128 1.00 0.00 O ATOM 0 H GLY A 102 -6.572 -3.098 0.916 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -4.487 -4.110 2.744 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.017 -3.539 3.381 1.00 0.00 H new ATOM 291 N ASP A 103 -6.081 -6.214 3.182 1.00 0.00 N ATOM 292 CA ASP A 103 -6.562 -7.599 3.253 1.00 0.00 C ATOM 293 C ASP A 103 -5.952 -8.551 2.217 1.00 0.00 C ATOM 294 O ASP A 103 -6.431 -9.667 2.015 1.00 0.00 O ATOM 295 CB ASP A 103 -8.094 -7.664 3.325 1.00 0.00 C ATOM 296 CG ASP A 103 -8.506 -8.498 4.533 1.00 0.00 C ATOM 297 OD1 ASP A 103 -8.636 -7.911 5.633 1.00 0.00 O ATOM 298 OD2 ASP A 103 -8.705 -9.728 4.436 1.00 0.00 O ATOM 0 H ASP A 103 -5.615 -5.956 4.052 1.00 0.00 H new ATOM 0 HA ASP A 103 -6.182 -7.990 4.197 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -8.509 -6.659 3.404 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -8.494 -8.104 2.411 1.00 0.00 H new ATOM 303 N LEU A 104 -4.852 -8.133 1.590 1.00 0.00 N ATOM 304 CA LEU A 104 -4.121 -8.873 0.569 1.00 0.00 C ATOM 305 C LEU A 104 -3.659 -10.234 1.084 1.00 0.00 C ATOM 306 O LEU A 104 -3.398 -10.392 2.287 1.00 0.00 O ATOM 307 CB LEU A 104 -2.860 -8.089 0.151 1.00 0.00 C ATOM 308 CG LEU A 104 -3.055 -6.589 -0.140 1.00 0.00 C ATOM 309 CD1 LEU A 104 -1.712 -5.906 -0.400 1.00 0.00 C ATOM 310 CD2 LEU A 104 -3.972 -6.397 -1.336 1.00 0.00 C ATOM 0 H LEU A 104 -4.429 -7.227 1.792 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.800 -9.010 -0.273 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -2.116 -8.190 0.941 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -2.444 -8.559 -0.740 1.00 0.00 H new ATOM 0 HG LEU A 104 -3.513 -6.132 0.737 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -1.875 -4.848 -0.603 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -1.074 -6.013 0.477 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -1.228 -6.370 -1.260 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -4.100 -5.332 -1.529 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -3.532 -6.874 -2.212 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -4.942 -6.847 -1.126 1.00 0.00 H new ATOM 322 N SER A 105 -3.566 -11.223 0.192 1.00 0.00 N ATOM 323 CA SER A 105 -3.086 -12.549 0.566 1.00 0.00 C ATOM 324 C SER A 105 -1.607 -12.348 0.967 1.00 0.00 C ATOM 325 O SER A 105 -0.925 -11.515 0.349 1.00 0.00 O ATOM 326 CB SER A 105 -3.311 -13.537 -0.593 1.00 0.00 C ATOM 327 OG SER A 105 -3.100 -14.870 -0.174 1.00 0.00 O ATOM 0 H SER A 105 -3.817 -11.128 -0.792 1.00 0.00 H new ATOM 0 HA SER A 105 -3.624 -12.993 1.404 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.326 -13.429 -0.975 1.00 0.00 H new ATOM 0 HB3 SER A 105 -2.635 -13.299 -1.414 1.00 0.00 H new ATOM 0 HG SER A 105 -3.251 -15.478 -0.928 1.00 0.00 H new ATOM 333 N PRO A 106 -1.065 -13.086 1.956 1.00 0.00 N ATOM 334 CA PRO A 106 0.324 -12.930 2.403 1.00 0.00 C ATOM 335 C PRO A 106 1.392 -13.179 1.327 1.00 0.00 C ATOM 336 O PRO A 106 2.572 -12.925 1.570 1.00 0.00 O ATOM 337 CB PRO A 106 0.480 -13.858 3.613 1.00 0.00 C ATOM 338 CG PRO A 106 -0.617 -14.902 3.420 1.00 0.00 C ATOM 339 CD PRO A 106 -1.736 -14.093 2.770 1.00 0.00 C ATOM 0 HA PRO A 106 0.503 -11.886 2.661 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.468 -14.317 3.639 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.355 -13.316 4.551 1.00 0.00 H new ATOM 0 HG2 PRO A 106 -0.288 -15.723 2.783 1.00 0.00 H new ATOM 0 HG3 PRO A 106 -0.931 -15.340 4.367 1.00 0.00 H new ATOM 0 HD2 PRO A 106 -2.376 -14.729 2.159 1.00 0.00 H new ATOM 0 HD3 PRO A 106 -2.373 -13.629 3.523 1.00 0.00 H new ATOM 347 N GLU A 107 1.005 -13.672 0.147 1.00 0.00 N ATOM 348 CA GLU A 107 1.922 -13.933 -0.953 1.00 0.00 C ATOM 349 C GLU A 107 1.942 -12.805 -1.990 1.00 0.00 C ATOM 350 O GLU A 107 2.904 -12.736 -2.751 1.00 0.00 O ATOM 351 CB GLU A 107 1.591 -15.282 -1.597 1.00 0.00 C ATOM 352 CG GLU A 107 0.212 -15.310 -2.269 1.00 0.00 C ATOM 353 CD GLU A 107 -0.090 -16.644 -2.946 1.00 0.00 C ATOM 354 OE1 GLU A 107 0.455 -17.702 -2.555 1.00 0.00 O ATOM 355 OE2 GLU A 107 -0.989 -16.666 -3.819 1.00 0.00 O ATOM 0 H GLU A 107 0.035 -13.902 -0.068 1.00 0.00 H new ATOM 0 HA GLU A 107 2.930 -13.975 -0.540 1.00 0.00 H new ATOM 0 HB2 GLU A 107 2.354 -15.520 -2.338 1.00 0.00 H new ATOM 0 HB3 GLU A 107 1.633 -16.061 -0.835 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -0.555 -15.105 -1.522 1.00 0.00 H new ATOM 0 HG3 GLU A 107 0.158 -14.512 -3.009 1.00 0.00 H new ATOM 362 N ILE A 108 0.948 -11.906 -2.001 1.00 0.00 N ATOM 363 CA ILE A 108 0.875 -10.804 -2.960 1.00 0.00 C ATOM 364 C ILE A 108 2.143 -9.963 -2.817 1.00 0.00 C ATOM 365 O ILE A 108 2.419 -9.414 -1.740 1.00 0.00 O ATOM 366 CB ILE A 108 -0.456 -10.015 -2.792 1.00 0.00 C ATOM 367 CG1 ILE A 108 -1.668 -10.880 -3.225 1.00 0.00 C ATOM 368 CG2 ILE A 108 -0.479 -8.664 -3.539 1.00 0.00 C ATOM 369 CD1 ILE A 108 -1.528 -11.435 -4.651 1.00 0.00 C ATOM 0 H ILE A 108 0.171 -11.926 -1.341 1.00 0.00 H new ATOM 0 HA ILE A 108 0.846 -11.168 -3.987 1.00 0.00 H new ATOM 0 HB ILE A 108 -0.528 -9.784 -1.729 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -1.783 -11.710 -2.527 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -2.577 -10.281 -3.161 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -1.438 -8.173 -3.374 1.00 0.00 H new ATOM 0 HG22 ILE A 108 0.323 -8.028 -3.165 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -0.338 -8.836 -4.606 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -2.406 -12.032 -4.897 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -1.442 -10.608 -5.356 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -0.636 -12.059 -4.713 1.00 0.00 H new ATOM 381 N THR A 109 2.938 -9.918 -3.888 1.00 0.00 N ATOM 382 CA THR A 109 4.183 -9.176 -3.909 1.00 0.00 C ATOM 383 C THR A 109 3.917 -7.758 -4.416 1.00 0.00 C ATOM 384 O THR A 109 2.800 -7.406 -4.793 1.00 0.00 O ATOM 385 CB THR A 109 5.277 -9.975 -4.641 1.00 0.00 C ATOM 386 OG1 THR A 109 6.535 -9.459 -4.259 1.00 0.00 O ATOM 387 CG2 THR A 109 5.190 -9.947 -6.168 1.00 0.00 C ATOM 0 H THR A 109 2.729 -10.399 -4.763 1.00 0.00 H new ATOM 0 HA THR A 109 4.591 -9.045 -2.907 1.00 0.00 H new ATOM 0 HB THR A 109 5.135 -11.016 -4.350 1.00 0.00 H new ATOM 0 HG1 THR A 109 7.245 -9.958 -4.715 1.00 0.00 H new ATOM 0 HG21 THR A 109 6.003 -10.538 -6.590 1.00 0.00 H new ATOM 0 HG22 THR A 109 4.235 -10.365 -6.486 1.00 0.00 H new ATOM 0 HG23 THR A 109 5.270 -8.918 -6.518 1.00 0.00 H new ATOM 395 N THR A 110 4.924 -6.891 -4.396 1.00 0.00 N ATOM 396 CA THR A 110 4.740 -5.514 -4.849 1.00 0.00 C ATOM 397 C THR A 110 4.395 -5.452 -6.348 1.00 0.00 C ATOM 398 O THR A 110 3.635 -4.582 -6.776 1.00 0.00 O ATOM 399 CB THR A 110 5.980 -4.702 -4.461 1.00 0.00 C ATOM 400 OG1 THR A 110 6.105 -4.742 -3.043 1.00 0.00 O ATOM 401 CG2 THR A 110 5.867 -3.254 -4.925 1.00 0.00 C ATOM 0 H THR A 110 5.867 -7.112 -4.075 1.00 0.00 H new ATOM 0 HA THR A 110 3.880 -5.064 -4.353 1.00 0.00 H new ATOM 0 HB THR A 110 6.857 -5.134 -4.944 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.894 -4.230 -2.770 1.00 0.00 H new ATOM 0 HG21 THR A 110 6.764 -2.707 -4.633 1.00 0.00 H new ATOM 0 HG22 THR A 110 5.762 -3.227 -6.010 1.00 0.00 H new ATOM 0 HG23 THR A 110 4.994 -2.791 -4.465 1.00 0.00 H new ATOM 409 N GLU A 111 4.906 -6.386 -7.148 1.00 0.00 N ATOM 410 CA GLU A 111 4.641 -6.409 -8.584 1.00 0.00 C ATOM 411 C GLU A 111 3.227 -6.917 -8.879 1.00 0.00 C ATOM 412 O GLU A 111 2.655 -6.547 -9.908 1.00 0.00 O ATOM 413 CB GLU A 111 5.744 -7.186 -9.316 1.00 0.00 C ATOM 414 CG GLU A 111 7.120 -6.656 -8.881 1.00 0.00 C ATOM 415 CD GLU A 111 8.205 -6.746 -9.948 1.00 0.00 C ATOM 416 OE1 GLU A 111 8.037 -6.126 -11.020 1.00 0.00 O ATOM 417 OE2 GLU A 111 9.317 -7.232 -9.643 1.00 0.00 O ATOM 0 H GLU A 111 5.510 -7.141 -6.823 1.00 0.00 H new ATOM 0 HA GLU A 111 4.670 -5.391 -8.972 1.00 0.00 H new ATOM 0 HB2 GLU A 111 5.665 -8.250 -9.091 1.00 0.00 H new ATOM 0 HB3 GLU A 111 5.625 -7.078 -10.394 1.00 0.00 H new ATOM 0 HG2 GLU A 111 7.013 -5.614 -8.578 1.00 0.00 H new ATOM 0 HG3 GLU A 111 7.447 -7.212 -8.002 1.00 0.00 H new ATOM 424 N ASP A 112 2.643 -7.715 -7.971 1.00 0.00 N ATOM 425 CA ASP A 112 1.285 -8.250 -8.100 1.00 0.00 C ATOM 426 C ASP A 112 0.321 -7.081 -8.028 1.00 0.00 C ATOM 427 O ASP A 112 -0.601 -6.955 -8.833 1.00 0.00 O ATOM 428 CB ASP A 112 0.916 -9.213 -6.973 1.00 0.00 C ATOM 429 CG ASP A 112 1.365 -10.650 -7.232 1.00 0.00 C ATOM 430 OD1 ASP A 112 1.283 -11.153 -8.375 1.00 0.00 O ATOM 431 OD2 ASP A 112 1.901 -11.267 -6.290 1.00 0.00 O ATOM 0 H ASP A 112 3.112 -8.009 -7.114 1.00 0.00 H new ATOM 0 HA ASP A 112 1.231 -8.795 -9.042 1.00 0.00 H new ATOM 0 HB2 ASP A 112 1.364 -8.862 -6.044 1.00 0.00 H new ATOM 0 HB3 ASP A 112 -0.165 -9.198 -6.831 1.00 0.00 H new ATOM 436 N ILE A 113 0.554 -6.216 -7.039 1.00 0.00 N ATOM 437 CA ILE A 113 -0.243 -5.030 -6.820 1.00 0.00 C ATOM 438 C ILE A 113 -0.186 -4.189 -8.084 1.00 0.00 C ATOM 439 O ILE A 113 -1.228 -3.776 -8.595 1.00 0.00 O ATOM 440 CB ILE A 113 0.271 -4.245 -5.601 1.00 0.00 C ATOM 441 CG1 ILE A 113 0.214 -5.116 -4.331 1.00 0.00 C ATOM 442 CG2 ILE A 113 -0.506 -2.937 -5.504 1.00 0.00 C ATOM 443 CD1 ILE A 113 0.226 -4.301 -3.045 1.00 0.00 C ATOM 0 H ILE A 113 1.312 -6.330 -6.366 1.00 0.00 H new ATOM 0 HA ILE A 113 -1.276 -5.303 -6.606 1.00 0.00 H new ATOM 0 HB ILE A 113 1.323 -3.985 -5.715 1.00 0.00 H new ATOM 0 HG12 ILE A 113 -0.688 -5.728 -4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 113 1.063 -5.800 -4.328 1.00 0.00 H new ATOM 0 HG21 ILE A 113 -0.154 -2.367 -4.644 1.00 0.00 H new ATOM 0 HG22 ILE A 113 -0.353 -2.355 -6.412 1.00 0.00 H new ATOM 0 HG23 ILE A 113 -1.568 -3.153 -5.386 1.00 0.00 H new ATOM 0 HD11 ILE A 113 0.184 -4.973 -2.188 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.140 -3.709 -2.998 1.00 0.00 H new ATOM 0 HD13 ILE A 113 -0.638 -3.636 -3.027 1.00 0.00 H new ATOM 455 N LYS A 114 1.026 -3.917 -8.579 1.00 0.00 N ATOM 456 CA LYS A 114 1.159 -3.126 -9.785 1.00 0.00 C ATOM 457 C LYS A 114 0.329 -3.716 -10.907 1.00 0.00 C ATOM 458 O LYS A 114 -0.411 -2.967 -11.513 1.00 0.00 O ATOM 459 CB LYS A 114 2.619 -2.949 -10.184 1.00 0.00 C ATOM 460 CG LYS A 114 3.212 -1.784 -9.391 1.00 0.00 C ATOM 461 CD LYS A 114 4.640 -1.507 -9.847 1.00 0.00 C ATOM 462 CE LYS A 114 5.656 -2.082 -8.863 1.00 0.00 C ATOM 463 NZ LYS A 114 7.022 -2.030 -9.433 1.00 0.00 N ATOM 0 H LYS A 114 1.905 -4.229 -8.167 1.00 0.00 H new ATOM 0 HA LYS A 114 0.771 -2.128 -9.578 1.00 0.00 H new ATOM 0 HB2 LYS A 114 3.178 -3.864 -9.985 1.00 0.00 H new ATOM 0 HB3 LYS A 114 2.696 -2.755 -11.254 1.00 0.00 H new ATOM 0 HG2 LYS A 114 2.600 -0.893 -9.528 1.00 0.00 H new ATOM 0 HG3 LYS A 114 3.202 -2.017 -8.326 1.00 0.00 H new ATOM 0 HD2 LYS A 114 4.800 -1.941 -10.834 1.00 0.00 H new ATOM 0 HD3 LYS A 114 4.792 -0.432 -9.943 1.00 0.00 H new ATOM 0 HE2 LYS A 114 5.624 -1.520 -7.929 1.00 0.00 H new ATOM 0 HE3 LYS A 114 5.395 -3.113 -8.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 7.699 -2.425 -8.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 7.053 -2.586 -10.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 7.275 -1.042 -9.639 1.00 0.00 H new ATOM 477 N ALA A 115 0.425 -5.015 -11.176 1.00 0.00 N ATOM 478 CA ALA A 115 -0.350 -5.651 -12.238 1.00 0.00 C ATOM 479 C ALA A 115 -1.854 -5.436 -12.050 1.00 0.00 C ATOM 480 O ALA A 115 -2.560 -5.084 -12.994 1.00 0.00 O ATOM 481 CB ALA A 115 -0.028 -7.147 -12.307 1.00 0.00 C ATOM 0 H ALA A 115 1.038 -5.653 -10.668 1.00 0.00 H new ATOM 0 HA ALA A 115 -0.067 -5.182 -13.180 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -0.613 -7.609 -13.103 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.034 -7.281 -12.512 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.276 -7.617 -11.355 1.00 0.00 H new ATOM 487 N ALA A 116 -2.340 -5.623 -10.824 1.00 0.00 N ATOM 488 CA ALA A 116 -3.744 -5.472 -10.490 1.00 0.00 C ATOM 489 C ALA A 116 -4.292 -4.070 -10.757 1.00 0.00 C ATOM 490 O ALA A 116 -5.388 -3.942 -11.305 1.00 0.00 O ATOM 491 CB ALA A 116 -3.925 -5.791 -9.010 1.00 0.00 C ATOM 0 H ALA A 116 -1.758 -5.887 -10.029 1.00 0.00 H new ATOM 0 HA ALA A 116 -4.300 -6.156 -11.131 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -4.976 -5.683 -8.740 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -3.604 -6.815 -8.817 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -3.325 -5.104 -8.414 1.00 0.00 H new ATOM 497 N PHE A 117 -3.549 -3.038 -10.350 1.00 0.00 N ATOM 498 CA PHE A 117 -3.933 -1.641 -10.495 1.00 0.00 C ATOM 499 C PHE A 117 -3.420 -0.972 -11.777 1.00 0.00 C ATOM 500 O PHE A 117 -3.874 0.117 -12.114 1.00 0.00 O ATOM 501 CB PHE A 117 -3.457 -0.911 -9.232 1.00 0.00 C ATOM 502 CG PHE A 117 -4.309 -1.233 -8.015 1.00 0.00 C ATOM 503 CD1 PHE A 117 -5.488 -0.507 -7.775 1.00 0.00 C ATOM 504 CD2 PHE A 117 -3.971 -2.289 -7.150 1.00 0.00 C ATOM 505 CE1 PHE A 117 -6.321 -0.829 -6.686 1.00 0.00 C ATOM 506 CE2 PHE A 117 -4.798 -2.611 -6.061 1.00 0.00 C ATOM 507 CZ PHE A 117 -5.971 -1.881 -5.824 1.00 0.00 C ATOM 0 H PHE A 117 -2.642 -3.159 -9.900 1.00 0.00 H new ATOM 0 HA PHE A 117 -5.017 -1.584 -10.599 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -2.421 -1.183 -9.028 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -3.475 0.164 -9.410 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -5.758 0.306 -8.432 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -3.069 -2.857 -7.324 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -7.228 -0.268 -6.514 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -4.529 -3.424 -5.404 1.00 0.00 H new ATOM 0 HZ PHE A 117 -6.602 -2.126 -4.983 1.00 0.00 H new ATOM 517 N ALA A 118 -2.531 -1.617 -12.528 1.00 0.00 N ATOM 518 CA ALA A 118 -1.944 -1.093 -13.759 1.00 0.00 C ATOM 519 C ALA A 118 -2.978 -0.713 -14.816 1.00 0.00 C ATOM 520 O ALA A 118 -2.858 0.391 -15.351 1.00 0.00 O ATOM 521 CB ALA A 118 -0.908 -2.048 -14.357 1.00 0.00 C ATOM 0 H ALA A 118 -2.188 -2.548 -12.289 1.00 0.00 H new ATOM 0 HA ALA A 118 -1.440 -0.174 -13.458 1.00 0.00 H new ATOM 0 HB1 ALA A 118 -0.499 -1.616 -15.270 1.00 0.00 H new ATOM 0 HB2 ALA A 118 -0.103 -2.207 -13.639 1.00 0.00 H new ATOM 0 HB3 ALA A 118 -1.383 -3.002 -14.588 1.00 0.00 H new ATOM 527 N PRO A 119 -4.001 -1.528 -15.149 1.00 0.00 N ATOM 528 CA PRO A 119 -4.974 -1.124 -16.160 1.00 0.00 C ATOM 529 C PRO A 119 -5.798 0.092 -15.724 1.00 0.00 C ATOM 530 O PRO A 119 -6.525 0.649 -16.544 1.00 0.00 O ATOM 531 CB PRO A 119 -5.830 -2.350 -16.448 1.00 0.00 C ATOM 532 CG PRO A 119 -5.718 -3.177 -15.178 1.00 0.00 C ATOM 533 CD PRO A 119 -4.321 -2.862 -14.654 1.00 0.00 C ATOM 0 HA PRO A 119 -4.474 -0.791 -17.069 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -6.864 -2.076 -16.657 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -5.464 -2.898 -17.316 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -6.486 -2.904 -14.455 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -5.837 -4.241 -15.383 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -4.297 -2.891 -13.565 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -3.596 -3.595 -15.009 1.00 0.00 H new ATOM 541 N PHE A 120 -5.642 0.562 -14.481 1.00 0.00 N ATOM 542 CA PHE A 120 -6.370 1.721 -13.990 1.00 0.00 C ATOM 543 C PHE A 120 -5.488 2.964 -14.091 1.00 0.00 C ATOM 544 O PHE A 120 -6.025 4.063 -13.978 1.00 0.00 O ATOM 545 CB PHE A 120 -6.851 1.507 -12.551 1.00 0.00 C ATOM 546 CG PHE A 120 -7.858 0.386 -12.425 1.00 0.00 C ATOM 547 CD1 PHE A 120 -7.441 -0.948 -12.262 1.00 0.00 C ATOM 548 CD2 PHE A 120 -9.228 0.681 -12.521 1.00 0.00 C ATOM 549 CE1 PHE A 120 -8.393 -1.977 -12.184 1.00 0.00 C ATOM 550 CE2 PHE A 120 -10.178 -0.348 -12.460 1.00 0.00 C ATOM 551 CZ PHE A 120 -9.763 -1.676 -12.274 1.00 0.00 C ATOM 0 H PHE A 120 -5.010 0.147 -13.796 1.00 0.00 H new ATOM 0 HA PHE A 120 -7.255 1.863 -14.610 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -5.993 1.290 -11.915 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -7.296 2.431 -12.181 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -6.388 -1.180 -12.197 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -9.551 1.705 -12.642 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -8.073 -3.000 -12.055 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -11.229 -0.119 -12.556 1.00 0.00 H new ATOM 0 HZ PHE A 120 -10.496 -2.466 -12.200 1.00 0.00 H new ATOM 561 N GLY A 121 -4.181 2.840 -14.362 1.00 0.00 N ATOM 562 CA GLY A 121 -3.309 3.984 -14.492 1.00 0.00 C ATOM 563 C GLY A 121 -1.841 3.665 -14.327 1.00 0.00 C ATOM 564 O GLY A 121 -1.445 2.593 -13.864 1.00 0.00 O ATOM 0 H GLY A 121 -3.714 1.943 -14.494 1.00 0.00 H new ATOM 0 HA2 GLY A 121 -3.463 4.435 -15.472 1.00 0.00 H new ATOM 0 HA3 GLY A 121 -3.593 4.730 -13.750 1.00 0.00 H new ATOM 568 N ARG A 122 -1.020 4.631 -14.733 1.00 0.00 N ATOM 569 CA ARG A 122 0.421 4.531 -14.626 1.00 0.00 C ATOM 570 C ARG A 122 0.734 4.782 -13.158 1.00 0.00 C ATOM 571 O ARG A 122 0.369 5.828 -12.617 1.00 0.00 O ATOM 572 CB ARG A 122 1.109 5.536 -15.544 1.00 0.00 C ATOM 573 CG ARG A 122 1.055 5.083 -17.005 1.00 0.00 C ATOM 574 CD ARG A 122 1.523 6.186 -17.960 1.00 0.00 C ATOM 575 NE ARG A 122 1.396 5.778 -19.371 1.00 0.00 N ATOM 576 CZ ARG A 122 2.212 6.107 -20.380 1.00 0.00 C ATOM 577 NH1 ARG A 122 3.355 6.748 -20.172 1.00 0.00 N ATOM 578 NH2 ARG A 122 1.867 5.790 -21.620 1.00 0.00 N ATOM 0 H ARG A 122 -1.344 5.506 -15.146 1.00 0.00 H new ATOM 0 HA ARG A 122 0.790 3.555 -14.942 1.00 0.00 H new ATOM 0 HB2 ARG A 122 0.629 6.510 -15.445 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.148 5.660 -15.238 1.00 0.00 H new ATOM 0 HG2 ARG A 122 1.681 4.200 -17.135 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.036 4.792 -17.258 1.00 0.00 H new ATOM 0 HD2 ARG A 122 0.936 7.089 -17.788 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.562 6.436 -17.746 1.00 0.00 H new ATOM 0 HE ARG A 122 0.602 5.182 -19.603 1.00 0.00 H new ATOM 0 HH11 ARG A 122 3.632 7.003 -19.224 1.00 0.00 H new ATOM 0 HH12 ARG A 122 3.957 6.986 -20.960 1.00 0.00 H new ATOM 0 HH21 ARG A 122 0.989 5.301 -21.796 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.479 6.035 -22.398 1.00 0.00 H new ATOM 592 N ILE A 123 1.334 3.792 -12.517 1.00 0.00 N ATOM 593 CA ILE A 123 1.718 3.818 -11.113 1.00 0.00 C ATOM 594 C ILE A 123 3.182 4.261 -11.055 1.00 0.00 C ATOM 595 O ILE A 123 3.960 3.929 -11.958 1.00 0.00 O ATOM 596 CB ILE A 123 1.551 2.407 -10.493 1.00 0.00 C ATOM 597 CG1 ILE A 123 0.148 1.789 -10.736 1.00 0.00 C ATOM 598 CG2 ILE A 123 1.830 2.445 -8.982 1.00 0.00 C ATOM 599 CD1 ILE A 123 0.063 0.281 -10.466 1.00 0.00 C ATOM 0 H ILE A 123 1.577 2.915 -12.977 1.00 0.00 H new ATOM 0 HA ILE A 123 1.089 4.505 -10.547 1.00 0.00 H new ATOM 0 HB ILE A 123 2.279 1.772 -10.998 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -0.576 2.301 -10.101 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -0.145 1.978 -11.769 1.00 0.00 H new ATOM 0 HG21 ILE A 123 1.708 1.446 -8.564 1.00 0.00 H new ATOM 0 HG22 ILE A 123 2.850 2.789 -8.809 1.00 0.00 H new ATOM 0 HG23 ILE A 123 1.130 3.128 -8.500 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -0.951 -0.067 -10.661 1.00 0.00 H new ATOM 0 HD12 ILE A 123 0.759 -0.245 -11.119 1.00 0.00 H new ATOM 0 HD13 ILE A 123 0.321 0.083 -9.426 1.00 0.00 H new ATOM 611 N SER A 124 3.584 4.948 -9.986 1.00 0.00 N ATOM 612 CA SER A 124 4.954 5.398 -9.783 1.00 0.00 C ATOM 613 C SER A 124 5.514 4.653 -8.568 1.00 0.00 C ATOM 614 O SER A 124 6.479 3.900 -8.705 1.00 0.00 O ATOM 615 CB SER A 124 5.042 6.920 -9.667 1.00 0.00 C ATOM 616 OG SER A 124 6.355 7.319 -10.019 1.00 0.00 O ATOM 0 H SER A 124 2.955 5.210 -9.227 1.00 0.00 H new ATOM 0 HA SER A 124 5.569 5.160 -10.651 1.00 0.00 H new ATOM 0 HB2 SER A 124 4.313 7.393 -10.324 1.00 0.00 H new ATOM 0 HB3 SER A 124 4.809 7.237 -8.651 1.00 0.00 H new ATOM 0 HG SER A 124 6.430 8.294 -9.952 1.00 0.00 H new ATOM 622 N ASP A 125 4.996 4.920 -7.368 1.00 0.00 N ATOM 623 CA ASP A 125 5.410 4.272 -6.117 1.00 0.00 C ATOM 624 C ASP A 125 4.377 3.220 -5.735 1.00 0.00 C ATOM 625 O ASP A 125 3.196 3.548 -5.653 1.00 0.00 O ATOM 626 CB ASP A 125 5.661 5.268 -4.973 1.00 0.00 C ATOM 627 CG ASP A 125 5.965 4.520 -3.671 1.00 0.00 C ATOM 628 OD1 ASP A 125 6.936 3.726 -3.657 1.00 0.00 O ATOM 629 OD2 ASP A 125 5.237 4.682 -2.668 1.00 0.00 O ATOM 0 H ASP A 125 4.258 5.611 -7.233 1.00 0.00 H new ATOM 0 HA ASP A 125 6.373 3.791 -6.290 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.495 5.922 -5.228 1.00 0.00 H new ATOM 0 HB3 ASP A 125 4.787 5.905 -4.838 1.00 0.00 H new ATOM 634 N ALA A 126 4.784 1.971 -5.524 1.00 0.00 N ATOM 635 CA ALA A 126 3.906 0.878 -5.135 1.00 0.00 C ATOM 636 C ALA A 126 4.667 0.043 -4.121 1.00 0.00 C ATOM 637 O ALA A 126 5.853 -0.222 -4.332 1.00 0.00 O ATOM 638 CB ALA A 126 3.529 0.032 -6.349 1.00 0.00 C ATOM 0 H ALA A 126 5.759 1.687 -5.622 1.00 0.00 H new ATOM 0 HA ALA A 126 2.978 1.260 -4.708 1.00 0.00 H new ATOM 0 HB1 ALA A 126 2.872 -0.780 -6.037 1.00 0.00 H new ATOM 0 HB2 ALA A 126 3.014 0.655 -7.081 1.00 0.00 H new ATOM 0 HB3 ALA A 126 4.431 -0.383 -6.797 1.00 0.00 H new ATOM 644 N ARG A 127 4.044 -0.383 -3.025 1.00 0.00 N ATOM 645 CA ARG A 127 4.755 -1.180 -2.026 1.00 0.00 C ATOM 646 C ARG A 127 3.803 -1.936 -1.127 1.00 0.00 C ATOM 647 O ARG A 127 2.674 -1.513 -0.901 1.00 0.00 O ATOM 648 CB ARG A 127 5.671 -0.269 -1.184 1.00 0.00 C ATOM 649 CG ARG A 127 4.951 0.940 -0.554 1.00 0.00 C ATOM 650 CD ARG A 127 5.946 1.871 0.141 1.00 0.00 C ATOM 651 NE ARG A 127 6.872 2.524 -0.818 1.00 0.00 N ATOM 652 CZ ARG A 127 8.199 2.341 -0.907 1.00 0.00 C ATOM 653 NH1 ARG A 127 8.857 1.658 0.024 1.00 0.00 N ATOM 654 NH2 ARG A 127 8.862 2.849 -1.941 1.00 0.00 N ATOM 0 H ARG A 127 3.066 -0.195 -2.807 1.00 0.00 H new ATOM 0 HA ARG A 127 5.359 -1.916 -2.556 1.00 0.00 H new ATOM 0 HB2 ARG A 127 6.124 -0.862 -0.390 1.00 0.00 H new ATOM 0 HB3 ARG A 127 6.483 0.094 -1.814 1.00 0.00 H new ATOM 0 HG2 ARG A 127 4.412 1.489 -1.326 1.00 0.00 H new ATOM 0 HG3 ARG A 127 4.210 0.592 0.166 1.00 0.00 H new ATOM 0 HD2 ARG A 127 5.400 2.636 0.693 1.00 0.00 H new ATOM 0 HD3 ARG A 127 6.523 1.303 0.870 1.00 0.00 H new ATOM 0 HE ARG A 127 6.456 3.181 -1.479 1.00 0.00 H new ATOM 0 HH11 ARG A 127 8.354 1.265 0.819 1.00 0.00 H new ATOM 0 HH12 ARG A 127 9.865 1.527 -0.057 1.00 0.00 H new ATOM 0 HH21 ARG A 127 8.362 3.373 -2.659 1.00 0.00 H new ATOM 0 HH22 ARG A 127 9.870 2.715 -2.016 1.00 0.00 H new ATOM 668 N VAL A 128 4.293 -3.049 -0.598 1.00 0.00 N ATOM 669 CA VAL A 128 3.592 -3.932 0.318 1.00 0.00 C ATOM 670 C VAL A 128 4.258 -3.675 1.666 1.00 0.00 C ATOM 671 O VAL A 128 5.471 -3.895 1.801 1.00 0.00 O ATOM 672 CB VAL A 128 3.734 -5.401 -0.129 1.00 0.00 C ATOM 673 CG1 VAL A 128 3.235 -6.384 0.941 1.00 0.00 C ATOM 674 CG2 VAL A 128 2.979 -5.704 -1.423 1.00 0.00 C ATOM 0 H VAL A 128 5.237 -3.375 -0.808 1.00 0.00 H new ATOM 0 HA VAL A 128 2.519 -3.745 0.357 1.00 0.00 H new ATOM 0 HB VAL A 128 4.803 -5.535 -0.293 1.00 0.00 H new ATOM 0 HG11 VAL A 128 3.355 -7.406 0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 128 3.813 -6.251 1.855 1.00 0.00 H new ATOM 0 HG13 VAL A 128 2.182 -6.194 1.147 1.00 0.00 H new ATOM 0 HG21 VAL A 128 3.116 -6.753 -1.687 1.00 0.00 H new ATOM 0 HG22 VAL A 128 1.917 -5.501 -1.281 1.00 0.00 H new ATOM 0 HG23 VAL A 128 3.364 -5.074 -2.225 1.00 0.00 H new ATOM 684 N VAL A 129 3.503 -3.132 2.618 1.00 0.00 N ATOM 685 CA VAL A 129 3.948 -2.829 3.971 1.00 0.00 C ATOM 686 C VAL A 129 4.451 -4.132 4.596 1.00 0.00 C ATOM 687 O VAL A 129 3.849 -5.195 4.414 1.00 0.00 O ATOM 688 CB VAL A 129 2.772 -2.224 4.771 1.00 0.00 C ATOM 689 CG1 VAL A 129 3.141 -1.967 6.237 1.00 0.00 C ATOM 690 CG2 VAL A 129 2.314 -0.900 4.141 1.00 0.00 C ATOM 0 H VAL A 129 2.527 -2.882 2.459 1.00 0.00 H new ATOM 0 HA VAL A 129 4.756 -2.097 3.974 1.00 0.00 H new ATOM 0 HB VAL A 129 1.965 -2.956 4.739 1.00 0.00 H new ATOM 0 HG11 VAL A 129 2.284 -1.542 6.759 1.00 0.00 H new ATOM 0 HG12 VAL A 129 3.425 -2.907 6.711 1.00 0.00 H new ATOM 0 HG13 VAL A 129 3.977 -1.269 6.285 1.00 0.00 H new ATOM 0 HG21 VAL A 129 1.485 -0.490 4.718 1.00 0.00 H new ATOM 0 HG22 VAL A 129 3.142 -0.191 4.141 1.00 0.00 H new ATOM 0 HG23 VAL A 129 1.989 -1.078 3.116 1.00 0.00 H new ATOM 700 N LYS A 130 5.558 -4.074 5.336 1.00 0.00 N ATOM 701 CA LYS A 130 6.133 -5.247 5.985 1.00 0.00 C ATOM 702 C LYS A 130 6.428 -4.956 7.438 1.00 0.00 C ATOM 703 O LYS A 130 6.617 -3.803 7.837 1.00 0.00 O ATOM 704 CB LYS A 130 7.387 -5.717 5.238 1.00 0.00 C ATOM 705 CG LYS A 130 6.991 -6.427 3.940 1.00 0.00 C ATOM 706 CD LYS A 130 8.200 -6.664 3.051 1.00 0.00 C ATOM 707 CE LYS A 130 7.782 -7.282 1.714 1.00 0.00 C ATOM 708 NZ LYS A 130 7.115 -6.306 0.828 1.00 0.00 N ATOM 0 H LYS A 130 6.079 -3.213 5.501 1.00 0.00 H new ATOM 0 HA LYS A 130 5.406 -6.058 5.950 1.00 0.00 H new ATOM 0 HB2 LYS A 130 8.028 -4.864 5.014 1.00 0.00 H new ATOM 0 HB3 LYS A 130 7.964 -6.392 5.870 1.00 0.00 H new ATOM 0 HG2 LYS A 130 6.516 -7.380 4.174 1.00 0.00 H new ATOM 0 HG3 LYS A 130 6.255 -5.827 3.405 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.717 -5.721 2.874 1.00 0.00 H new ATOM 0 HD3 LYS A 130 8.905 -7.324 3.557 1.00 0.00 H new ATOM 0 HE2 LYS A 130 8.662 -7.683 1.211 1.00 0.00 H new ATOM 0 HE3 LYS A 130 7.110 -8.120 1.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 6.407 -6.795 0.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.646 -5.578 1.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.822 -5.857 0.212 1.00 0.00 H new ATOM 722 N ASP A 131 6.425 -6.011 8.241 1.00 0.00 N ATOM 723 CA ASP A 131 6.696 -5.947 9.661 1.00 0.00 C ATOM 724 C ASP A 131 8.131 -5.495 9.848 1.00 0.00 C ATOM 725 O ASP A 131 9.049 -6.272 9.616 1.00 0.00 O ATOM 726 CB ASP A 131 6.479 -7.302 10.319 1.00 0.00 C ATOM 727 CG ASP A 131 6.825 -7.187 11.794 1.00 0.00 C ATOM 728 OD1 ASP A 131 6.163 -6.390 12.499 1.00 0.00 O ATOM 729 OD2 ASP A 131 7.776 -7.877 12.217 1.00 0.00 O ATOM 0 H ASP A 131 6.229 -6.956 7.910 1.00 0.00 H new ATOM 0 HA ASP A 131 6.012 -5.241 10.133 1.00 0.00 H new ATOM 0 HB2 ASP A 131 5.444 -7.620 10.197 1.00 0.00 H new ATOM 0 HB3 ASP A 131 7.103 -8.058 9.842 1.00 0.00 H new ATOM 734 N MET A 132 8.333 -4.260 10.293 1.00 0.00 N ATOM 735 CA MET A 132 9.648 -3.672 10.502 1.00 0.00 C ATOM 736 C MET A 132 10.598 -4.475 11.401 1.00 0.00 C ATOM 737 O MET A 132 11.794 -4.177 11.375 1.00 0.00 O ATOM 738 CB MET A 132 9.489 -2.224 10.970 1.00 0.00 C ATOM 739 CG MET A 132 8.716 -2.079 12.279 1.00 0.00 C ATOM 740 SD MET A 132 8.365 -0.364 12.709 1.00 0.00 S ATOM 741 CE MET A 132 10.028 0.285 13.023 1.00 0.00 C ATOM 0 H MET A 132 7.568 -3.626 10.523 1.00 0.00 H new ATOM 0 HA MET A 132 10.150 -3.697 9.535 1.00 0.00 H new ATOM 0 HB2 MET A 132 10.477 -1.781 11.092 1.00 0.00 H new ATOM 0 HB3 MET A 132 8.979 -1.655 10.193 1.00 0.00 H new ATOM 0 HG2 MET A 132 7.777 -2.627 12.202 1.00 0.00 H new ATOM 0 HG3 MET A 132 9.288 -2.539 13.085 1.00 0.00 H new ATOM 0 HE1 MET A 132 9.954 1.284 13.452 1.00 0.00 H new ATOM 0 HE2 MET A 132 10.549 -0.371 13.720 1.00 0.00 H new ATOM 0 HE3 MET A 132 10.583 0.332 12.086 1.00 0.00 H new ATOM 751 N ALA A 133 10.115 -5.474 12.152 1.00 0.00 N ATOM 752 CA ALA A 133 10.928 -6.308 13.025 1.00 0.00 C ATOM 753 C ALA A 133 11.282 -7.663 12.394 1.00 0.00 C ATOM 754 O ALA A 133 12.278 -8.257 12.815 1.00 0.00 O ATOM 755 CB ALA A 133 10.185 -6.535 14.345 1.00 0.00 C ATOM 0 H ALA A 133 9.126 -5.724 12.164 1.00 0.00 H new ATOM 0 HA ALA A 133 11.866 -5.780 13.197 1.00 0.00 H new ATOM 0 HB1 ALA A 133 10.791 -7.159 15.001 1.00 0.00 H new ATOM 0 HB2 ALA A 133 9.999 -5.575 14.827 1.00 0.00 H new ATOM 0 HB3 ALA A 133 9.235 -7.032 14.147 1.00 0.00 H new ATOM 761 N THR A 134 10.572 -8.143 11.362 1.00 0.00 N ATOM 762 CA THR A 134 10.840 -9.450 10.731 1.00 0.00 C ATOM 763 C THR A 134 10.955 -9.440 9.211 1.00 0.00 C ATOM 764 O THR A 134 11.545 -10.353 8.631 1.00 0.00 O ATOM 765 CB THR A 134 9.706 -10.424 11.078 1.00 0.00 C ATOM 766 OG1 THR A 134 8.452 -9.899 10.709 1.00 0.00 O ATOM 767 CG2 THR A 134 9.647 -10.703 12.558 1.00 0.00 C ATOM 0 H THR A 134 9.794 -7.637 10.939 1.00 0.00 H new ATOM 0 HA THR A 134 11.812 -9.746 11.126 1.00 0.00 H new ATOM 0 HB THR A 134 9.918 -11.341 10.528 1.00 0.00 H new ATOM 0 HG1 THR A 134 8.097 -9.355 11.442 1.00 0.00 H new ATOM 0 HG21 THR A 134 8.832 -11.396 12.765 1.00 0.00 H new ATOM 0 HG22 THR A 134 10.590 -11.143 12.883 1.00 0.00 H new ATOM 0 HG23 THR A 134 9.477 -9.771 13.097 1.00 0.00 H new ATOM 775 N GLY A 135 10.371 -8.427 8.587 1.00 0.00 N ATOM 776 CA GLY A 135 10.327 -8.203 7.154 1.00 0.00 C ATOM 777 C GLY A 135 9.241 -9.028 6.460 1.00 0.00 C ATOM 778 O GLY A 135 9.312 -9.231 5.247 1.00 0.00 O ATOM 0 H GLY A 135 9.885 -7.694 9.104 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.152 -7.145 6.961 1.00 0.00 H new ATOM 0 HA3 GLY A 135 11.297 -8.450 6.722 1.00 0.00 H new ATOM 782 N LYS A 136 8.261 -9.564 7.197 1.00 0.00 N ATOM 783 CA LYS A 136 7.177 -10.364 6.621 1.00 0.00 C ATOM 784 C LYS A 136 6.078 -9.433 6.129 1.00 0.00 C ATOM 785 O LYS A 136 5.969 -8.310 6.621 1.00 0.00 O ATOM 786 CB LYS A 136 6.646 -11.371 7.652 1.00 0.00 C ATOM 787 CG LYS A 136 7.752 -12.244 8.265 1.00 0.00 C ATOM 788 CD LYS A 136 8.535 -13.106 7.265 1.00 0.00 C ATOM 789 CE LYS A 136 9.705 -13.727 8.033 1.00 0.00 C ATOM 790 NZ LYS A 136 10.217 -14.972 7.432 1.00 0.00 N ATOM 0 H LYS A 136 8.198 -9.455 8.209 1.00 0.00 H new ATOM 0 HA LYS A 136 7.552 -10.938 5.774 1.00 0.00 H new ATOM 0 HB2 LYS A 136 6.134 -10.831 8.448 1.00 0.00 H new ATOM 0 HB3 LYS A 136 5.906 -12.014 7.176 1.00 0.00 H new ATOM 0 HG2 LYS A 136 8.454 -11.597 8.790 1.00 0.00 H new ATOM 0 HG3 LYS A 136 7.303 -12.899 9.012 1.00 0.00 H new ATOM 0 HD2 LYS A 136 7.897 -13.881 6.841 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.897 -12.501 6.434 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.516 -13.001 8.090 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.388 -13.932 9.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 11.006 -15.335 8.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 9.457 -15.681 7.402 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 10.550 -14.780 6.466 1.00 0.00 H new ATOM 804 N SER A 137 5.276 -9.873 5.160 1.00 0.00 N ATOM 805 CA SER A 137 4.200 -9.061 4.615 1.00 0.00 C ATOM 806 C SER A 137 3.166 -8.749 5.690 1.00 0.00 C ATOM 807 O SER A 137 2.622 -9.670 6.313 1.00 0.00 O ATOM 808 CB SER A 137 3.529 -9.761 3.425 1.00 0.00 C ATOM 809 OG SER A 137 2.598 -8.859 2.860 1.00 0.00 O ATOM 0 H SER A 137 5.357 -10.797 4.736 1.00 0.00 H new ATOM 0 HA SER A 137 4.634 -8.125 4.263 1.00 0.00 H new ATOM 0 HB2 SER A 137 4.274 -10.054 2.685 1.00 0.00 H new ATOM 0 HB3 SER A 137 3.028 -10.672 3.751 1.00 0.00 H new ATOM 0 HG SER A 137 2.156 -9.282 2.095 1.00 0.00 H new ATOM 815 N LYS A 138 2.915 -7.457 5.941 1.00 0.00 N ATOM 816 CA LYS A 138 1.881 -7.090 6.923 1.00 0.00 C ATOM 817 C LYS A 138 0.506 -7.401 6.332 1.00 0.00 C ATOM 818 O LYS A 138 -0.446 -7.606 7.085 1.00 0.00 O ATOM 819 CB LYS A 138 1.913 -5.611 7.344 1.00 0.00 C ATOM 820 CG LYS A 138 3.024 -5.314 8.355 1.00 0.00 C ATOM 821 CD LYS A 138 2.630 -4.255 9.398 1.00 0.00 C ATOM 822 CE LYS A 138 3.823 -4.079 10.339 1.00 0.00 C ATOM 823 NZ LYS A 138 3.550 -3.267 11.538 1.00 0.00 N ATOM 0 H LYS A 138 3.393 -6.673 5.497 1.00 0.00 H new ATOM 0 HA LYS A 138 2.084 -7.675 7.820 1.00 0.00 H new ATOM 0 HB2 LYS A 138 2.054 -4.988 6.461 1.00 0.00 H new ATOM 0 HB3 LYS A 138 0.950 -5.339 7.776 1.00 0.00 H new ATOM 0 HG2 LYS A 138 3.295 -6.237 8.869 1.00 0.00 H new ATOM 0 HG3 LYS A 138 3.911 -4.975 7.820 1.00 0.00 H new ATOM 0 HD2 LYS A 138 2.381 -3.311 8.913 1.00 0.00 H new ATOM 0 HD3 LYS A 138 1.746 -4.571 9.952 1.00 0.00 H new ATOM 0 HE2 LYS A 138 4.167 -5.064 10.655 1.00 0.00 H new ATOM 0 HE3 LYS A 138 4.641 -3.619 9.784 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 4.412 -3.201 12.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 3.252 -2.313 11.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 2.793 -3.713 12.094 1.00 0.00 H new ATOM 837 N GLY A 139 0.390 -7.416 5.001 1.00 0.00 N ATOM 838 CA GLY A 139 -0.833 -7.696 4.269 1.00 0.00 C ATOM 839 C GLY A 139 -1.434 -6.455 3.615 1.00 0.00 C ATOM 840 O GLY A 139 -2.433 -6.601 2.919 1.00 0.00 O ATOM 0 H GLY A 139 1.181 -7.225 4.386 1.00 0.00 H new ATOM 0 HA2 GLY A 139 -0.627 -8.441 3.501 1.00 0.00 H new ATOM 0 HA3 GLY A 139 -1.565 -8.132 4.949 1.00 0.00 H new ATOM 844 N TYR A 140 -1.030 -5.235 3.986 1.00 0.00 N ATOM 845 CA TYR A 140 -1.511 -3.996 3.366 1.00 0.00 C ATOM 846 C TYR A 140 -0.451 -3.422 2.422 1.00 0.00 C ATOM 847 O TYR A 140 0.721 -3.804 2.498 1.00 0.00 O ATOM 848 CB TYR A 140 -2.118 -3.001 4.367 1.00 0.00 C ATOM 849 CG TYR A 140 -1.320 -2.590 5.590 1.00 0.00 C ATOM 850 CD1 TYR A 140 -1.134 -3.498 6.649 1.00 0.00 C ATOM 851 CD2 TYR A 140 -0.908 -1.252 5.742 1.00 0.00 C ATOM 852 CE1 TYR A 140 -0.551 -3.068 7.852 1.00 0.00 C ATOM 853 CE2 TYR A 140 -0.356 -0.810 6.961 1.00 0.00 C ATOM 854 CZ TYR A 140 -0.200 -1.713 8.035 1.00 0.00 C ATOM 855 OH TYR A 140 0.238 -1.281 9.252 1.00 0.00 O ATOM 0 H TYR A 140 -0.353 -5.079 4.733 1.00 0.00 H new ATOM 0 HA TYR A 140 -2.368 -4.240 2.738 1.00 0.00 H new ATOM 0 HB2 TYR A 140 -2.363 -2.093 3.817 1.00 0.00 H new ATOM 0 HB3 TYR A 140 -3.059 -3.424 4.718 1.00 0.00 H new ATOM 0 HD1 TYR A 140 -1.440 -4.528 6.536 1.00 0.00 H new ATOM 0 HD2 TYR A 140 -1.016 -0.560 4.919 1.00 0.00 H new ATOM 0 HE1 TYR A 140 -0.370 -3.780 8.644 1.00 0.00 H new ATOM 0 HE2 TYR A 140 -0.052 0.220 7.074 1.00 0.00 H new ATOM 0 HH TYR A 140 0.438 -0.323 9.206 1.00 0.00 H new ATOM 865 N GLY A 141 -0.825 -2.471 1.571 1.00 0.00 N ATOM 866 CA GLY A 141 0.076 -1.824 0.635 1.00 0.00 C ATOM 867 C GLY A 141 -0.433 -0.448 0.217 1.00 0.00 C ATOM 868 O GLY A 141 -1.508 -0.009 0.640 1.00 0.00 O ATOM 0 H GLY A 141 -1.783 -2.125 1.515 1.00 0.00 H new ATOM 0 HA2 GLY A 141 1.062 -1.724 1.089 1.00 0.00 H new ATOM 0 HA3 GLY A 141 0.194 -2.451 -0.248 1.00 0.00 H new ATOM 872 N PHE A 142 0.365 0.238 -0.602 1.00 0.00 N ATOM 873 CA PHE A 142 0.072 1.557 -1.146 1.00 0.00 C ATOM 874 C PHE A 142 0.415 1.588 -2.634 1.00 0.00 C ATOM 875 O PHE A 142 1.382 0.943 -3.051 1.00 0.00 O ATOM 876 CB PHE A 142 0.867 2.634 -0.398 1.00 0.00 C ATOM 877 CG PHE A 142 0.480 2.796 1.056 1.00 0.00 C ATOM 878 CD1 PHE A 142 -0.724 3.445 1.386 1.00 0.00 C ATOM 879 CD2 PHE A 142 1.307 2.288 2.075 1.00 0.00 C ATOM 880 CE1 PHE A 142 -1.096 3.596 2.733 1.00 0.00 C ATOM 881 CE2 PHE A 142 0.932 2.438 3.421 1.00 0.00 C ATOM 882 CZ PHE A 142 -0.263 3.100 3.749 1.00 0.00 C ATOM 0 H PHE A 142 1.265 -0.126 -0.914 1.00 0.00 H new ATOM 0 HA PHE A 142 -0.991 1.763 -1.019 1.00 0.00 H new ATOM 0 HB2 PHE A 142 1.928 2.391 -0.455 1.00 0.00 H new ATOM 0 HB3 PHE A 142 0.731 3.588 -0.907 1.00 0.00 H new ATOM 0 HD1 PHE A 142 -1.363 3.827 0.604 1.00 0.00 H new ATOM 0 HD2 PHE A 142 2.228 1.784 1.823 1.00 0.00 H new ATOM 0 HE1 PHE A 142 -2.021 4.093 2.986 1.00 0.00 H new ATOM 0 HE2 PHE A 142 1.563 2.044 4.204 1.00 0.00 H new ATOM 0 HZ PHE A 142 -0.542 3.228 4.785 1.00 0.00 H new ATOM 892 N VAL A 143 -0.333 2.383 -3.407 1.00 0.00 N ATOM 893 CA VAL A 143 -0.182 2.574 -4.849 1.00 0.00 C ATOM 894 C VAL A 143 -0.337 4.073 -5.125 1.00 0.00 C ATOM 895 O VAL A 143 -1.370 4.651 -4.806 1.00 0.00 O ATOM 896 CB VAL A 143 -1.248 1.748 -5.601 1.00 0.00 C ATOM 897 CG1 VAL A 143 -1.162 1.899 -7.121 1.00 0.00 C ATOM 898 CG2 VAL A 143 -1.151 0.246 -5.299 1.00 0.00 C ATOM 0 H VAL A 143 -1.098 2.937 -3.022 1.00 0.00 H new ATOM 0 HA VAL A 143 0.793 2.233 -5.197 1.00 0.00 H new ATOM 0 HB VAL A 143 -2.194 2.151 -5.239 1.00 0.00 H new ATOM 0 HG11 VAL A 143 -1.937 1.294 -7.591 1.00 0.00 H new ATOM 0 HG12 VAL A 143 -1.304 2.945 -7.391 1.00 0.00 H new ATOM 0 HG13 VAL A 143 -0.183 1.565 -7.465 1.00 0.00 H new ATOM 0 HG21 VAL A 143 -1.923 -0.287 -5.853 1.00 0.00 H new ATOM 0 HG22 VAL A 143 -0.170 -0.123 -5.598 1.00 0.00 H new ATOM 0 HG23 VAL A 143 -1.291 0.080 -4.231 1.00 0.00 H new ATOM 908 N SER A 144 0.676 4.722 -5.692 1.00 0.00 N ATOM 909 CA SER A 144 0.710 6.135 -6.030 1.00 0.00 C ATOM 910 C SER A 144 0.554 6.286 -7.543 1.00 0.00 C ATOM 911 O SER A 144 1.417 5.828 -8.301 1.00 0.00 O ATOM 912 CB SER A 144 2.043 6.711 -5.548 1.00 0.00 C ATOM 913 OG SER A 144 2.097 8.121 -5.627 1.00 0.00 O ATOM 0 H SER A 144 1.543 4.245 -5.941 1.00 0.00 H new ATOM 0 HA SER A 144 -0.103 6.677 -5.548 1.00 0.00 H new ATOM 0 HB2 SER A 144 2.213 6.404 -4.516 1.00 0.00 H new ATOM 0 HB3 SER A 144 2.852 6.288 -6.144 1.00 0.00 H new ATOM 0 HG SER A 144 2.430 8.484 -4.780 1.00 0.00 H new ATOM 919 N PHE A 145 -0.555 6.884 -7.972 1.00 0.00 N ATOM 920 CA PHE A 145 -0.872 7.136 -9.371 1.00 0.00 C ATOM 921 C PHE A 145 -0.523 8.583 -9.710 1.00 0.00 C ATOM 922 O PHE A 145 -0.603 9.468 -8.853 1.00 0.00 O ATOM 923 CB PHE A 145 -2.374 6.947 -9.599 1.00 0.00 C ATOM 924 CG PHE A 145 -2.874 5.530 -9.435 1.00 0.00 C ATOM 925 CD1 PHE A 145 -3.320 5.080 -8.178 1.00 0.00 C ATOM 926 CD2 PHE A 145 -2.939 4.675 -10.551 1.00 0.00 C ATOM 927 CE1 PHE A 145 -3.895 3.806 -8.054 1.00 0.00 C ATOM 928 CE2 PHE A 145 -3.511 3.398 -10.427 1.00 0.00 C ATOM 929 CZ PHE A 145 -4.016 2.980 -9.184 1.00 0.00 C ATOM 0 H PHE A 145 -1.278 7.216 -7.334 1.00 0.00 H new ATOM 0 HA PHE A 145 -0.305 6.446 -9.996 1.00 0.00 H new ATOM 0 HB2 PHE A 145 -2.915 7.589 -8.904 1.00 0.00 H new ATOM 0 HB3 PHE A 145 -2.619 7.288 -10.605 1.00 0.00 H new ATOM 0 HD1 PHE A 145 -3.220 5.715 -7.310 1.00 0.00 H new ATOM 0 HD2 PHE A 145 -2.549 5.001 -11.504 1.00 0.00 H new ATOM 0 HE1 PHE A 145 -4.244 3.461 -7.092 1.00 0.00 H new ATOM 0 HE2 PHE A 145 -3.562 2.741 -11.283 1.00 0.00 H new ATOM 0 HZ PHE A 145 -4.500 2.018 -9.097 1.00 0.00 H new ATOM 939 N PHE A 146 -0.135 8.831 -10.960 1.00 0.00 N ATOM 940 CA PHE A 146 0.200 10.160 -11.440 1.00 0.00 C ATOM 941 C PHE A 146 -1.050 11.038 -11.481 1.00 0.00 C ATOM 942 O PHE A 146 -0.976 12.219 -11.141 1.00 0.00 O ATOM 943 CB PHE A 146 0.729 10.120 -12.886 1.00 0.00 C ATOM 944 CG PHE A 146 1.953 9.282 -13.201 1.00 0.00 C ATOM 945 CD1 PHE A 146 3.039 9.222 -12.312 1.00 0.00 C ATOM 946 CD2 PHE A 146 2.053 8.649 -14.454 1.00 0.00 C ATOM 947 CE1 PHE A 146 4.222 8.560 -12.681 1.00 0.00 C ATOM 948 CE2 PHE A 146 3.221 7.955 -14.805 1.00 0.00 C ATOM 949 CZ PHE A 146 4.307 7.902 -13.916 1.00 0.00 C ATOM 0 H PHE A 146 -0.045 8.105 -11.670 1.00 0.00 H new ATOM 0 HA PHE A 146 0.956 10.553 -10.760 1.00 0.00 H new ATOM 0 HB2 PHE A 146 -0.083 9.768 -13.523 1.00 0.00 H new ATOM 0 HB3 PHE A 146 0.947 11.145 -13.184 1.00 0.00 H new ATOM 0 HD1 PHE A 146 2.964 9.687 -11.340 1.00 0.00 H new ATOM 0 HD2 PHE A 146 1.227 8.698 -15.148 1.00 0.00 H new ATOM 0 HE1 PHE A 146 5.069 8.558 -12.011 1.00 0.00 H new ATOM 0 HE2 PHE A 146 3.285 7.460 -15.763 1.00 0.00 H new ATOM 0 HZ PHE A 146 5.201 7.358 -14.182 1.00 0.00 H new ATOM 959 N ASN A 147 -2.182 10.473 -11.915 1.00 0.00 N ATOM 960 CA ASN A 147 -3.447 11.183 -12.053 1.00 0.00 C ATOM 961 C ASN A 147 -4.477 10.722 -11.037 1.00 0.00 C ATOM 962 O ASN A 147 -4.585 9.538 -10.728 1.00 0.00 O ATOM 963 CB ASN A 147 -4.004 10.985 -13.474 1.00 0.00 C ATOM 964 CG ASN A 147 -3.070 11.554 -14.528 1.00 0.00 C ATOM 965 OD1 ASN A 147 -2.424 10.817 -15.274 1.00 0.00 O ATOM 966 ND2 ASN A 147 -2.921 12.867 -14.579 1.00 0.00 N ATOM 0 H ASN A 147 -2.240 9.491 -12.184 1.00 0.00 H new ATOM 0 HA ASN A 147 -3.249 12.239 -11.870 1.00 0.00 H new ATOM 0 HB2 ASN A 147 -4.158 9.922 -13.660 1.00 0.00 H new ATOM 0 HB3 ASN A 147 -4.979 11.467 -13.553 1.00 0.00 H new ATOM 0 HD21 ASN A 147 -2.265 13.280 -15.242 1.00 0.00 H new ATOM 0 HD22 ASN A 147 -3.462 13.466 -13.956 1.00 0.00 H new ATOM 973 N LYS A 148 -5.302 11.665 -10.589 1.00 0.00 N ATOM 974 CA LYS A 148 -6.363 11.426 -9.623 1.00 0.00 C ATOM 975 C LYS A 148 -7.407 10.448 -10.147 1.00 0.00 C ATOM 976 O LYS A 148 -7.784 9.527 -9.435 1.00 0.00 O ATOM 977 CB LYS A 148 -7.027 12.769 -9.291 1.00 0.00 C ATOM 978 CG LYS A 148 -8.212 12.565 -8.344 1.00 0.00 C ATOM 979 CD LYS A 148 -8.756 13.899 -7.856 1.00 0.00 C ATOM 980 CE LYS A 148 -9.908 13.605 -6.901 1.00 0.00 C ATOM 981 NZ LYS A 148 -10.397 14.832 -6.260 1.00 0.00 N ATOM 0 H LYS A 148 -5.248 12.636 -10.896 1.00 0.00 H new ATOM 0 HA LYS A 148 -5.925 10.978 -8.731 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -6.299 13.437 -8.832 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -7.366 13.250 -10.209 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -9.000 12.012 -8.856 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -7.901 11.961 -7.491 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -7.976 14.469 -7.351 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -9.099 14.503 -8.696 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -10.722 13.128 -7.446 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -9.579 12.900 -6.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -11.180 14.599 -5.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -9.625 15.273 -5.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -10.733 15.494 -6.988 1.00 0.00 H new ATOM 995 N TRP A 149 -7.867 10.643 -11.378 1.00 0.00 N ATOM 996 CA TRP A 149 -8.893 9.823 -12.017 1.00 0.00 C ATOM 997 C TRP A 149 -8.518 8.357 -12.089 1.00 0.00 C ATOM 998 O TRP A 149 -9.399 7.503 -12.028 1.00 0.00 O ATOM 999 CB TRP A 149 -9.161 10.327 -13.438 1.00 0.00 C ATOM 1000 CG TRP A 149 -8.690 11.713 -13.718 1.00 0.00 C ATOM 1001 CD1 TRP A 149 -7.800 12.045 -14.673 1.00 0.00 C ATOM 1002 CD2 TRP A 149 -9.026 12.939 -13.010 1.00 0.00 C ATOM 1003 NE1 TRP A 149 -7.592 13.410 -14.633 1.00 0.00 N ATOM 1004 CE2 TRP A 149 -8.317 14.008 -13.621 1.00 0.00 C ATOM 1005 CE3 TRP A 149 -9.836 13.244 -11.894 1.00 0.00 C ATOM 1006 CZ2 TRP A 149 -8.454 15.331 -13.181 1.00 0.00 C ATOM 1007 CZ3 TRP A 149 -9.981 14.567 -11.444 1.00 0.00 C ATOM 1008 CH2 TRP A 149 -9.305 15.614 -12.096 1.00 0.00 C ATOM 0 H TRP A 149 -7.528 11.396 -11.976 1.00 0.00 H new ATOM 0 HA TRP A 149 -9.785 9.912 -11.397 1.00 0.00 H new ATOM 0 HB2 TRP A 149 -8.682 9.648 -14.144 1.00 0.00 H new ATOM 0 HB3 TRP A 149 -10.233 10.279 -13.627 1.00 0.00 H new ATOM 0 HD1 TRP A 149 -7.327 11.357 -15.358 1.00 0.00 H new ATOM 0 HE1 TRP A 149 -6.978 13.915 -15.273 1.00 0.00 H new ATOM 0 HE3 TRP A 149 -10.352 12.448 -11.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 149 -7.912 16.127 -13.670 1.00 0.00 H new ATOM 0 HZ3 TRP A 149 -10.613 14.781 -10.595 1.00 0.00 H new ATOM 0 HH2 TRP A 149 -9.439 16.633 -11.765 1.00 0.00 H new ATOM 1019 N ASP A 150 -7.223 8.088 -12.266 1.00 0.00 N ATOM 1020 CA ASP A 150 -6.712 6.732 -12.355 1.00 0.00 C ATOM 1021 C ASP A 150 -6.967 6.050 -11.006 1.00 0.00 C ATOM 1022 O ASP A 150 -7.487 4.934 -10.937 1.00 0.00 O ATOM 1023 CB ASP A 150 -5.210 6.735 -12.695 1.00 0.00 C ATOM 1024 CG ASP A 150 -4.860 6.957 -14.174 1.00 0.00 C ATOM 1025 OD1 ASP A 150 -5.757 7.050 -15.047 1.00 0.00 O ATOM 1026 OD2 ASP A 150 -3.649 7.066 -14.478 1.00 0.00 O ATOM 0 H ASP A 150 -6.505 8.808 -12.351 1.00 0.00 H new ATOM 0 HA ASP A 150 -7.218 6.188 -13.153 1.00 0.00 H new ATOM 0 HB2 ASP A 150 -4.725 7.513 -12.106 1.00 0.00 H new ATOM 0 HB3 ASP A 150 -4.783 5.783 -12.379 1.00 0.00 H new ATOM 1031 N ALA A 151 -6.614 6.758 -9.926 1.00 0.00 N ATOM 1032 CA ALA A 151 -6.776 6.317 -8.553 1.00 0.00 C ATOM 1033 C ALA A 151 -8.253 6.193 -8.185 1.00 0.00 C ATOM 1034 O ALA A 151 -8.651 5.177 -7.626 1.00 0.00 O ATOM 1035 CB ALA A 151 -6.088 7.309 -7.609 1.00 0.00 C ATOM 0 H ALA A 151 -6.194 7.685 -9.997 1.00 0.00 H new ATOM 0 HA ALA A 151 -6.317 5.334 -8.452 1.00 0.00 H new ATOM 0 HB1 ALA A 151 -6.211 6.976 -6.579 1.00 0.00 H new ATOM 0 HB2 ALA A 151 -5.026 7.363 -7.849 1.00 0.00 H new ATOM 0 HB3 ALA A 151 -6.537 8.295 -7.727 1.00 0.00 H new ATOM 1041 N GLU A 152 -9.072 7.208 -8.482 1.00 0.00 N ATOM 1042 CA GLU A 152 -10.501 7.208 -8.175 1.00 0.00 C ATOM 1043 C GLU A 152 -11.177 5.996 -8.805 1.00 0.00 C ATOM 1044 O GLU A 152 -11.925 5.286 -8.130 1.00 0.00 O ATOM 1045 CB GLU A 152 -11.189 8.497 -8.662 1.00 0.00 C ATOM 1046 CG GLU A 152 -10.888 9.699 -7.770 1.00 0.00 C ATOM 1047 CD GLU A 152 -11.798 10.894 -8.055 1.00 0.00 C ATOM 1048 OE1 GLU A 152 -11.699 11.509 -9.138 1.00 0.00 O ATOM 1049 OE2 GLU A 152 -12.623 11.242 -7.171 1.00 0.00 O ATOM 0 H GLU A 152 -8.756 8.059 -8.947 1.00 0.00 H new ATOM 0 HA GLU A 152 -10.602 7.160 -7.091 1.00 0.00 H new ATOM 0 HB2 GLU A 152 -10.865 8.715 -9.680 1.00 0.00 H new ATOM 0 HB3 GLU A 152 -12.267 8.337 -8.698 1.00 0.00 H new ATOM 0 HG2 GLU A 152 -10.997 9.406 -6.726 1.00 0.00 H new ATOM 0 HG3 GLU A 152 -9.849 9.998 -7.910 1.00 0.00 H new ATOM 1056 N ASN A 153 -10.902 5.748 -10.089 1.00 0.00 N ATOM 1057 CA ASN A 153 -11.476 4.624 -10.807 1.00 0.00 C ATOM 1058 C ASN A 153 -11.169 3.322 -10.069 1.00 0.00 C ATOM 1059 O ASN A 153 -12.072 2.536 -9.791 1.00 0.00 O ATOM 1060 CB ASN A 153 -10.973 4.600 -12.253 1.00 0.00 C ATOM 1061 CG ASN A 153 -11.764 3.604 -13.088 1.00 0.00 C ATOM 1062 OD1 ASN A 153 -12.918 3.302 -12.797 1.00 0.00 O ATOM 1063 ND2 ASN A 153 -11.165 3.079 -14.139 1.00 0.00 N ATOM 0 H ASN A 153 -10.276 6.324 -10.652 1.00 0.00 H new ATOM 0 HA ASN A 153 -12.560 4.734 -10.846 1.00 0.00 H new ATOM 0 HB2 ASN A 153 -11.060 5.595 -12.689 1.00 0.00 H new ATOM 0 HB3 ASN A 153 -9.916 4.336 -12.270 1.00 0.00 H new ATOM 0 HD21 ASN A 153 -11.661 2.409 -14.727 1.00 0.00 H new ATOM 0 HD22 ASN A 153 -10.206 3.343 -14.364 1.00 0.00 H new ATOM 1070 N ALA A 154 -9.901 3.123 -9.708 1.00 0.00 N ATOM 1071 CA ALA A 154 -9.423 1.965 -8.992 1.00 0.00 C ATOM 1072 C ALA A 154 -10.091 1.833 -7.624 1.00 0.00 C ATOM 1073 O ALA A 154 -10.568 0.749 -7.323 1.00 0.00 O ATOM 1074 CB ALA A 154 -7.908 2.039 -8.840 1.00 0.00 C ATOM 0 H ALA A 154 -9.162 3.793 -9.919 1.00 0.00 H new ATOM 0 HA ALA A 154 -9.684 1.079 -9.570 1.00 0.00 H new ATOM 0 HB1 ALA A 154 -7.553 1.162 -8.299 1.00 0.00 H new ATOM 0 HB2 ALA A 154 -7.444 2.069 -9.826 1.00 0.00 H new ATOM 0 HB3 ALA A 154 -7.641 2.939 -8.286 1.00 0.00 H new ATOM 1080 N ILE A 155 -10.129 2.871 -6.781 1.00 0.00 N ATOM 1081 CA ILE A 155 -10.758 2.821 -5.459 1.00 0.00 C ATOM 1082 C ILE A 155 -12.171 2.243 -5.567 1.00 0.00 C ATOM 1083 O ILE A 155 -12.543 1.405 -4.742 1.00 0.00 O ATOM 1084 CB ILE A 155 -10.778 4.234 -4.830 1.00 0.00 C ATOM 1085 CG1 ILE A 155 -9.339 4.637 -4.454 1.00 0.00 C ATOM 1086 CG2 ILE A 155 -11.682 4.299 -3.581 1.00 0.00 C ATOM 1087 CD1 ILE A 155 -9.186 6.115 -4.078 1.00 0.00 C ATOM 0 H ILE A 155 -9.719 3.779 -7.001 1.00 0.00 H new ATOM 0 HA ILE A 155 -10.177 2.167 -4.809 1.00 0.00 H new ATOM 0 HB ILE A 155 -11.188 4.927 -5.565 1.00 0.00 H new ATOM 0 HG12 ILE A 155 -9.007 4.023 -3.617 1.00 0.00 H new ATOM 0 HG13 ILE A 155 -8.679 4.415 -5.293 1.00 0.00 H new ATOM 0 HG21 ILE A 155 -11.666 5.309 -3.172 1.00 0.00 H new ATOM 0 HG22 ILE A 155 -12.703 4.035 -3.857 1.00 0.00 H new ATOM 0 HG23 ILE A 155 -11.316 3.598 -2.830 1.00 0.00 H new ATOM 0 HD11 ILE A 155 -8.146 6.321 -3.826 1.00 0.00 H new ATOM 0 HD12 ILE A 155 -9.485 6.738 -4.921 1.00 0.00 H new ATOM 0 HD13 ILE A 155 -9.818 6.339 -3.219 1.00 0.00 H new ATOM 1099 N GLN A 156 -12.928 2.695 -6.563 1.00 0.00 N ATOM 1100 CA GLN A 156 -14.298 2.276 -6.802 1.00 0.00 C ATOM 1101 C GLN A 156 -14.407 0.863 -7.363 1.00 0.00 C ATOM 1102 O GLN A 156 -15.073 0.018 -6.767 1.00 0.00 O ATOM 1103 CB GLN A 156 -14.969 3.255 -7.770 1.00 0.00 C ATOM 1104 CG GLN A 156 -14.995 4.710 -7.265 1.00 0.00 C ATOM 1105 CD GLN A 156 -15.245 5.729 -8.375 1.00 0.00 C ATOM 1106 OE1 GLN A 156 -15.911 6.741 -8.152 1.00 0.00 O ATOM 1107 NE2 GLN A 156 -14.664 5.536 -9.548 1.00 0.00 N ATOM 0 H GLN A 156 -12.593 3.380 -7.241 1.00 0.00 H new ATOM 0 HA GLN A 156 -14.800 2.275 -5.835 1.00 0.00 H new ATOM 0 HB2 GLN A 156 -14.447 3.221 -8.726 1.00 0.00 H new ATOM 0 HB3 GLN A 156 -15.992 2.926 -7.954 1.00 0.00 H new ATOM 0 HG2 GLN A 156 -15.772 4.811 -6.507 1.00 0.00 H new ATOM 0 HG3 GLN A 156 -14.045 4.936 -6.780 1.00 0.00 H new ATOM 0 HE21 GLN A 156 -14.117 4.691 -9.713 1.00 0.00 H new ATOM 0 HE22 GLN A 156 -14.764 6.232 -10.287 1.00 0.00 H new ATOM 1116 N GLN A 157 -13.783 0.597 -8.512 1.00 0.00 N ATOM 1117 CA GLN A 157 -13.860 -0.708 -9.149 1.00 0.00 C ATOM 1118 C GLN A 157 -13.131 -1.785 -8.356 1.00 0.00 C ATOM 1119 O GLN A 157 -13.712 -2.840 -8.119 1.00 0.00 O ATOM 1120 CB GLN A 157 -13.349 -0.649 -10.590 1.00 0.00 C ATOM 1121 CG GLN A 157 -14.106 0.369 -11.465 1.00 0.00 C ATOM 1122 CD GLN A 157 -14.167 -0.076 -12.930 1.00 0.00 C ATOM 1123 OE1 GLN A 157 -14.614 -1.175 -13.268 1.00 0.00 O ATOM 1124 NE2 GLN A 157 -13.695 0.764 -13.829 1.00 0.00 N ATOM 0 H GLN A 157 -13.216 1.277 -9.019 1.00 0.00 H new ATOM 0 HA GLN A 157 -14.914 -0.987 -9.170 1.00 0.00 H new ATOM 0 HB2 GLN A 157 -12.289 -0.393 -10.582 1.00 0.00 H new ATOM 0 HB3 GLN A 157 -13.435 -1.638 -11.039 1.00 0.00 H new ATOM 0 HG2 GLN A 157 -15.118 0.497 -11.081 1.00 0.00 H new ATOM 0 HG3 GLN A 157 -13.616 1.340 -11.400 1.00 0.00 H new ATOM 0 HE21 GLN A 157 -13.328 1.670 -13.537 1.00 0.00 H new ATOM 0 HE22 GLN A 157 -13.697 0.508 -14.816 1.00 0.00 H new ATOM 1133 N MET A 158 -11.869 -1.569 -7.970 1.00 0.00 N ATOM 1134 CA MET A 158 -11.116 -2.575 -7.214 1.00 0.00 C ATOM 1135 C MET A 158 -11.668 -2.790 -5.801 1.00 0.00 C ATOM 1136 O MET A 158 -11.404 -3.836 -5.201 1.00 0.00 O ATOM 1137 CB MET A 158 -9.616 -2.245 -7.182 1.00 0.00 C ATOM 1138 CG MET A 158 -8.981 -2.299 -8.579 1.00 0.00 C ATOM 1139 SD MET A 158 -9.130 -3.894 -9.435 1.00 0.00 S ATOM 1140 CE MET A 158 -8.427 -4.985 -8.179 1.00 0.00 C ATOM 0 H MET A 158 -11.351 -0.713 -8.167 1.00 0.00 H new ATOM 0 HA MET A 158 -11.243 -3.519 -7.745 1.00 0.00 H new ATOM 0 HB2 MET A 158 -9.473 -1.251 -6.758 1.00 0.00 H new ATOM 0 HB3 MET A 158 -9.105 -2.948 -6.525 1.00 0.00 H new ATOM 0 HG2 MET A 158 -9.439 -1.528 -9.199 1.00 0.00 H new ATOM 0 HG3 MET A 158 -7.924 -2.050 -8.490 1.00 0.00 H new ATOM 0 HE1 MET A 158 -8.047 -5.889 -8.654 1.00 0.00 H new ATOM 0 HE2 MET A 158 -7.611 -4.473 -7.668 1.00 0.00 H new ATOM 0 HE3 MET A 158 -9.198 -5.251 -7.456 1.00 0.00 H new ATOM 1150 N GLY A 159 -12.419 -1.828 -5.265 1.00 0.00 N ATOM 1151 CA GLY A 159 -13.033 -1.897 -3.947 1.00 0.00 C ATOM 1152 C GLY A 159 -14.194 -2.877 -4.023 1.00 0.00 C ATOM 1153 O GLY A 159 -15.317 -2.495 -4.344 1.00 0.00 O ATOM 0 H GLY A 159 -12.620 -0.955 -5.753 1.00 0.00 H new ATOM 0 HA2 GLY A 159 -12.306 -2.224 -3.204 1.00 0.00 H new ATOM 0 HA3 GLY A 159 -13.384 -0.913 -3.638 1.00 0.00 H new ATOM 1157 N GLY A 160 -13.903 -4.146 -3.750 1.00 0.00 N ATOM 1158 CA GLY A 160 -14.842 -5.262 -3.781 1.00 0.00 C ATOM 1159 C GLY A 160 -14.311 -6.427 -4.620 1.00 0.00 C ATOM 1160 O GLY A 160 -14.935 -7.498 -4.661 1.00 0.00 O ATOM 0 H GLY A 160 -12.961 -4.437 -3.489 1.00 0.00 H new ATOM 0 HA2 GLY A 160 -15.034 -5.604 -2.764 1.00 0.00 H new ATOM 0 HA3 GLY A 160 -15.795 -4.924 -4.189 1.00 0.00 H new ATOM 1164 N GLN A 161 -13.171 -6.244 -5.297 1.00 0.00 N ATOM 1165 CA GLN A 161 -12.545 -7.270 -6.112 1.00 0.00 C ATOM 1166 C GLN A 161 -11.634 -8.135 -5.257 1.00 0.00 C ATOM 1167 O GLN A 161 -11.416 -7.854 -4.076 1.00 0.00 O ATOM 1168 CB GLN A 161 -11.776 -6.625 -7.277 1.00 0.00 C ATOM 1169 CG GLN A 161 -12.746 -6.076 -8.327 1.00 0.00 C ATOM 1170 CD GLN A 161 -13.664 -7.168 -8.876 1.00 0.00 C ATOM 1171 OE1 GLN A 161 -13.289 -8.335 -8.954 1.00 0.00 O ATOM 1172 NE2 GLN A 161 -14.898 -6.836 -9.202 1.00 0.00 N ATOM 0 H GLN A 161 -12.657 -5.363 -5.288 1.00 0.00 H new ATOM 0 HA GLN A 161 -13.317 -7.913 -6.535 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -11.145 -5.820 -6.901 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -11.115 -7.361 -7.735 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -13.349 -5.282 -7.886 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -12.181 -5.630 -9.146 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -15.200 -5.864 -9.134 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -15.551 -7.551 -9.522 1.00 0.00 H new ATOM 1181 N TRP A 162 -11.121 -9.200 -5.866 1.00 0.00 N ATOM 1182 CA TRP A 162 -10.228 -10.159 -5.250 1.00 0.00 C ATOM 1183 C TRP A 162 -8.851 -10.058 -5.907 1.00 0.00 C ATOM 1184 O TRP A 162 -8.740 -9.637 -7.063 1.00 0.00 O ATOM 1185 CB TRP A 162 -10.813 -11.574 -5.398 1.00 0.00 C ATOM 1186 CG TRP A 162 -12.092 -11.925 -4.677 1.00 0.00 C ATOM 1187 CD1 TRP A 162 -13.266 -11.251 -4.705 1.00 0.00 C ATOM 1188 CD2 TRP A 162 -12.359 -13.101 -3.854 1.00 0.00 C ATOM 1189 NE1 TRP A 162 -14.228 -11.933 -3.984 1.00 0.00 N ATOM 1190 CE2 TRP A 162 -13.721 -13.090 -3.438 1.00 0.00 C ATOM 1191 CE3 TRP A 162 -11.581 -14.189 -3.421 1.00 0.00 C ATOM 1192 CZ2 TRP A 162 -14.285 -14.116 -2.663 1.00 0.00 C ATOM 1193 CZ3 TRP A 162 -12.121 -15.200 -2.607 1.00 0.00 C ATOM 1194 CH2 TRP A 162 -13.478 -15.188 -2.255 1.00 0.00 C ATOM 0 H TRP A 162 -11.328 -9.422 -6.840 1.00 0.00 H new ATOM 0 HA TRP A 162 -10.120 -9.945 -4.187 1.00 0.00 H new ATOM 0 HB2 TRP A 162 -10.977 -11.751 -6.461 1.00 0.00 H new ATOM 0 HB3 TRP A 162 -10.049 -12.280 -5.072 1.00 0.00 H new ATOM 0 HD1 TRP A 162 -13.428 -10.314 -5.218 1.00 0.00 H new ATOM 0 HE1 TRP A 162 -15.192 -11.619 -3.871 1.00 0.00 H new ATOM 0 HE3 TRP A 162 -10.545 -14.249 -3.720 1.00 0.00 H new ATOM 0 HZ2 TRP A 162 -15.328 -14.080 -2.384 1.00 0.00 H new ATOM 0 HZ3 TRP A 162 -11.483 -15.995 -2.249 1.00 0.00 H new ATOM 0 HH2 TRP A 162 -13.898 -15.997 -1.675 1.00 0.00 H new ATOM 1205 N LEU A 163 -7.804 -10.449 -5.180 1.00 0.00 N ATOM 1206 CA LEU A 163 -6.421 -10.449 -5.622 1.00 0.00 C ATOM 1207 C LEU A 163 -5.687 -11.524 -4.820 1.00 0.00 C ATOM 1208 O LEU A 163 -5.773 -11.533 -3.592 1.00 0.00 O ATOM 1209 CB LEU A 163 -5.803 -9.069 -5.347 1.00 0.00 C ATOM 1210 CG LEU A 163 -4.334 -8.957 -5.784 1.00 0.00 C ATOM 1211 CD1 LEU A 163 -4.202 -9.010 -7.300 1.00 0.00 C ATOM 1212 CD2 LEU A 163 -3.726 -7.651 -5.287 1.00 0.00 C ATOM 0 H LEU A 163 -7.908 -10.789 -4.224 1.00 0.00 H new ATOM 0 HA LEU A 163 -6.346 -10.655 -6.690 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -6.387 -8.308 -5.865 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -5.874 -8.854 -4.281 1.00 0.00 H new ATOM 0 HG LEU A 163 -3.803 -9.804 -5.349 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -3.151 -8.928 -7.577 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -4.602 -9.955 -7.667 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -4.759 -8.184 -7.743 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -2.686 -7.589 -5.606 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -4.283 -6.810 -5.700 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -3.774 -7.618 -4.199 1.00 0.00 H new ATOM 1224 N GLY A 164 -4.980 -12.432 -5.493 1.00 0.00 N ATOM 1225 CA GLY A 164 -4.227 -13.490 -4.818 1.00 0.00 C ATOM 1226 C GLY A 164 -5.085 -14.471 -4.038 1.00 0.00 C ATOM 1227 O GLY A 164 -4.598 -15.061 -3.075 1.00 0.00 O ATOM 0 H GLY A 164 -4.913 -12.456 -6.511 1.00 0.00 H new ATOM 0 HA2 GLY A 164 -3.652 -14.041 -5.562 1.00 0.00 H new ATOM 0 HA3 GLY A 164 -3.510 -13.031 -4.137 1.00 0.00 H new ATOM 1231 N GLY A 165 -6.362 -14.591 -4.392 1.00 0.00 N ATOM 1232 CA GLY A 165 -7.278 -15.504 -3.744 1.00 0.00 C ATOM 1233 C GLY A 165 -8.179 -14.896 -2.684 1.00 0.00 C ATOM 1234 O GLY A 165 -9.017 -15.650 -2.193 1.00 0.00 O ATOM 0 H GLY A 165 -6.786 -14.049 -5.145 1.00 0.00 H new ATOM 0 HA2 GLY A 165 -7.906 -15.962 -4.508 1.00 0.00 H new ATOM 0 HA3 GLY A 165 -6.699 -16.305 -3.285 1.00 0.00 H new ATOM 1238 N ARG A 166 -8.082 -13.602 -2.338 1.00 0.00 N ATOM 1239 CA ARG A 166 -8.975 -13.007 -1.327 1.00 0.00 C ATOM 1240 C ARG A 166 -9.407 -11.603 -1.717 1.00 0.00 C ATOM 1241 O ARG A 166 -8.777 -10.996 -2.584 1.00 0.00 O ATOM 1242 CB ARG A 166 -8.260 -12.951 0.028 1.00 0.00 C ATOM 1243 CG ARG A 166 -8.551 -14.181 0.893 1.00 0.00 C ATOM 1244 CD ARG A 166 -7.706 -14.022 2.149 1.00 0.00 C ATOM 1245 NE ARG A 166 -8.017 -14.975 3.221 1.00 0.00 N ATOM 1246 CZ ARG A 166 -7.263 -15.105 4.315 1.00 0.00 C ATOM 1247 NH1 ARG A 166 -6.175 -14.354 4.456 1.00 0.00 N ATOM 1248 NH2 ARG A 166 -7.577 -15.971 5.269 1.00 0.00 N ATOM 0 H ARG A 166 -7.403 -12.953 -2.737 1.00 0.00 H new ATOM 0 HA ARG A 166 -9.864 -13.635 -1.261 1.00 0.00 H new ATOM 0 HB2 ARG A 166 -7.185 -12.871 -0.134 1.00 0.00 H new ATOM 0 HB3 ARG A 166 -8.570 -12.053 0.562 1.00 0.00 H new ATOM 0 HG2 ARG A 166 -9.611 -14.241 1.141 1.00 0.00 H new ATOM 0 HG3 ARG A 166 -8.295 -15.099 0.364 1.00 0.00 H new ATOM 0 HD2 ARG A 166 -6.655 -14.129 1.880 1.00 0.00 H new ATOM 0 HD3 ARG A 166 -7.835 -13.010 2.532 1.00 0.00 H new ATOM 0 HE ARG A 166 -8.845 -15.563 3.126 1.00 0.00 H new ATOM 0 HH11 ARG A 166 -5.921 -13.683 3.731 1.00 0.00 H new ATOM 0 HH12 ARG A 166 -5.595 -14.448 5.289 1.00 0.00 H new ATOM 0 HH21 ARG A 166 -8.409 -16.554 5.175 1.00 0.00 H new ATOM 0 HH22 ARG A 166 -6.987 -16.054 6.097 1.00 0.00 H new ATOM 1262 N GLN A 167 -10.495 -11.098 -1.122 1.00 0.00 N ATOM 1263 CA GLN A 167 -10.971 -9.745 -1.396 1.00 0.00 C ATOM 1264 C GLN A 167 -9.932 -8.759 -0.861 1.00 0.00 C ATOM 1265 O GLN A 167 -9.151 -9.078 0.034 1.00 0.00 O ATOM 1266 CB GLN A 167 -12.336 -9.448 -0.743 1.00 0.00 C ATOM 1267 CG GLN A 167 -13.525 -9.898 -1.589 1.00 0.00 C ATOM 1268 CD GLN A 167 -14.843 -9.327 -1.069 1.00 0.00 C ATOM 1269 OE1 GLN A 167 -15.127 -9.381 0.131 1.00 0.00 O ATOM 1270 NE2 GLN A 167 -15.677 -8.769 -1.931 1.00 0.00 N ATOM 0 H GLN A 167 -11.061 -11.612 -0.446 1.00 0.00 H new ATOM 0 HA GLN A 167 -11.106 -9.645 -2.473 1.00 0.00 H new ATOM 0 HB2 GLN A 167 -12.382 -9.943 0.227 1.00 0.00 H new ATOM 0 HB3 GLN A 167 -12.416 -8.377 -0.558 1.00 0.00 H new ATOM 0 HG2 GLN A 167 -13.375 -9.583 -2.622 1.00 0.00 H new ATOM 0 HG3 GLN A 167 -13.577 -10.987 -1.592 1.00 0.00 H new ATOM 0 HE21 GLN A 167 -15.435 -8.728 -2.921 1.00 0.00 H new ATOM 0 HE22 GLN A 167 -16.562 -8.380 -1.606 1.00 0.00 H new ATOM 1279 N ILE A 168 -9.968 -7.537 -1.383 1.00 0.00 N ATOM 1280 CA ILE A 168 -9.078 -6.452 -1.001 1.00 0.00 C ATOM 1281 C ILE A 168 -9.913 -5.222 -0.643 1.00 0.00 C ATOM 1282 O ILE A 168 -11.034 -5.056 -1.131 1.00 0.00 O ATOM 1283 CB ILE A 168 -8.066 -6.169 -2.133 1.00 0.00 C ATOM 1284 CG1 ILE A 168 -8.759 -5.712 -3.439 1.00 0.00 C ATOM 1285 CG2 ILE A 168 -7.209 -7.420 -2.392 1.00 0.00 C ATOM 1286 CD1 ILE A 168 -7.809 -5.168 -4.503 1.00 0.00 C ATOM 0 H ILE A 168 -10.638 -7.269 -2.104 1.00 0.00 H new ATOM 0 HA ILE A 168 -8.497 -6.731 -0.122 1.00 0.00 H new ATOM 0 HB ILE A 168 -7.427 -5.349 -1.806 1.00 0.00 H new ATOM 0 HG12 ILE A 168 -9.309 -6.555 -3.858 1.00 0.00 H new ATOM 0 HG13 ILE A 168 -9.492 -4.942 -3.196 1.00 0.00 H new ATOM 0 HG21 ILE A 168 -6.497 -7.214 -3.191 1.00 0.00 H new ATOM 0 HG22 ILE A 168 -6.668 -7.685 -1.484 1.00 0.00 H new ATOM 0 HG23 ILE A 168 -7.854 -8.249 -2.685 1.00 0.00 H new ATOM 0 HD11 ILE A 168 -8.380 -4.872 -5.383 1.00 0.00 H new ATOM 0 HD12 ILE A 168 -7.277 -4.303 -4.108 1.00 0.00 H new ATOM 0 HD13 ILE A 168 -7.091 -5.940 -4.779 1.00 0.00 H new ATOM 1298 N ARG A 169 -9.374 -4.334 0.187 1.00 0.00 N ATOM 1299 CA ARG A 169 -10.058 -3.106 0.599 1.00 0.00 C ATOM 1300 C ARG A 169 -9.249 -1.940 0.071 1.00 0.00 C ATOM 1301 O ARG A 169 -8.044 -1.931 0.289 1.00 0.00 O ATOM 1302 CB ARG A 169 -10.261 -3.074 2.127 1.00 0.00 C ATOM 1303 CG ARG A 169 -9.000 -3.238 2.988 1.00 0.00 C ATOM 1304 CD ARG A 169 -9.300 -3.291 4.496 1.00 0.00 C ATOM 1305 NE ARG A 169 -9.672 -4.647 4.931 1.00 0.00 N ATOM 1306 CZ ARG A 169 -10.882 -5.216 4.917 1.00 0.00 C ATOM 1307 NH1 ARG A 169 -11.963 -4.491 4.666 1.00 0.00 N ATOM 1308 NH2 ARG A 169 -10.997 -6.518 5.139 1.00 0.00 N ATOM 0 H ARG A 169 -8.446 -4.444 0.596 1.00 0.00 H new ATOM 0 HA ARG A 169 -11.063 -3.051 0.181 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -10.732 -2.127 2.389 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.962 -3.864 2.395 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -8.483 -4.152 2.694 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -8.321 -2.409 2.788 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -8.424 -2.958 5.053 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -10.109 -2.599 4.730 1.00 0.00 H new ATOM 0 HE ARG A 169 -8.911 -5.225 5.288 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -11.875 -3.492 4.482 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -12.882 -4.933 4.657 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -10.165 -7.080 5.319 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -11.917 -6.958 5.130 1.00 0.00 H new ATOM 1322 N THR A 170 -9.872 -0.987 -0.607 1.00 0.00 N ATOM 1323 CA THR A 170 -9.234 0.193 -1.180 1.00 0.00 C ATOM 1324 C THR A 170 -9.799 1.441 -0.503 1.00 0.00 C ATOM 1325 O THR A 170 -10.925 1.406 0.001 1.00 0.00 O ATOM 1326 CB THR A 170 -9.511 0.233 -2.697 1.00 0.00 C ATOM 1327 OG1 THR A 170 -10.883 -0.034 -2.921 1.00 0.00 O ATOM 1328 CG2 THR A 170 -8.704 -0.827 -3.449 1.00 0.00 C ATOM 0 H THR A 170 -10.877 -1.014 -0.781 1.00 0.00 H new ATOM 0 HA THR A 170 -8.157 0.156 -1.019 1.00 0.00 H new ATOM 0 HB THR A 170 -9.226 1.220 -3.060 1.00 0.00 H new ATOM 0 HG1 THR A 170 -11.234 0.593 -3.587 1.00 0.00 H new ATOM 0 HG21 THR A 170 -8.927 -0.766 -4.514 1.00 0.00 H new ATOM 0 HG22 THR A 170 -7.640 -0.654 -3.291 1.00 0.00 H new ATOM 0 HG23 THR A 170 -8.970 -1.817 -3.079 1.00 0.00 H new ATOM 1336 N ASN A 171 -9.041 2.539 -0.455 1.00 0.00 N ATOM 1337 CA ASN A 171 -9.459 3.818 0.128 1.00 0.00 C ATOM 1338 C ASN A 171 -8.358 4.856 -0.110 1.00 0.00 C ATOM 1339 O ASN A 171 -7.233 4.506 -0.473 1.00 0.00 O ATOM 1340 CB ASN A 171 -9.736 3.703 1.651 1.00 0.00 C ATOM 1341 CG ASN A 171 -11.213 3.504 1.969 1.00 0.00 C ATOM 1342 OD1 ASN A 171 -12.053 4.282 1.541 1.00 0.00 O ATOM 1343 ND2 ASN A 171 -11.576 2.552 2.821 1.00 0.00 N ATOM 0 H ASN A 171 -8.093 2.565 -0.831 1.00 0.00 H new ATOM 0 HA ASN A 171 -10.389 4.121 -0.354 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -9.166 2.868 2.057 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -9.380 4.605 2.150 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -12.550 2.474 3.114 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -10.881 1.899 3.183 1.00 0.00 H new ATOM 1350 N TRP A 172 -8.656 6.140 0.099 1.00 0.00 N ATOM 1351 CA TRP A 172 -7.686 7.218 -0.060 1.00 0.00 C ATOM 1352 C TRP A 172 -6.660 7.118 1.069 1.00 0.00 C ATOM 1353 O TRP A 172 -7.049 7.102 2.237 1.00 0.00 O ATOM 1354 CB TRP A 172 -8.372 8.591 0.024 1.00 0.00 C ATOM 1355 CG TRP A 172 -9.043 9.098 -1.216 1.00 0.00 C ATOM 1356 CD1 TRP A 172 -10.292 9.617 -1.287 1.00 0.00 C ATOM 1357 CD2 TRP A 172 -8.487 9.209 -2.564 1.00 0.00 C ATOM 1358 NE1 TRP A 172 -10.553 10.013 -2.583 1.00 0.00 N ATOM 1359 CE2 TRP A 172 -9.467 9.811 -3.405 1.00 0.00 C ATOM 1360 CE3 TRP A 172 -7.255 8.864 -3.164 1.00 0.00 C ATOM 1361 CZ2 TRP A 172 -9.236 10.070 -4.761 1.00 0.00 C ATOM 1362 CZ3 TRP A 172 -7.041 9.059 -4.539 1.00 0.00 C ATOM 1363 CH2 TRP A 172 -8.022 9.669 -5.340 1.00 0.00 C ATOM 0 H TRP A 172 -9.582 6.459 0.384 1.00 0.00 H new ATOM 0 HA TRP A 172 -7.210 7.122 -1.036 1.00 0.00 H new ATOM 0 HB2 TRP A 172 -9.117 8.548 0.818 1.00 0.00 H new ATOM 0 HB3 TRP A 172 -7.625 9.324 0.328 1.00 0.00 H new ATOM 0 HD1 TRP A 172 -10.978 9.707 -0.458 1.00 0.00 H new ATOM 0 HE1 TRP A 172 -11.441 10.407 -2.894 1.00 0.00 H new ATOM 0 HE3 TRP A 172 -6.466 8.444 -2.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 172 -9.984 10.573 -5.356 1.00 0.00 H new ATOM 0 HZ3 TRP A 172 -6.112 8.736 -4.986 1.00 0.00 H new ATOM 0 HH2 TRP A 172 -7.843 9.828 -6.393 1.00 0.00 H new ATOM 1374 N ALA A 173 -5.363 7.067 0.744 1.00 0.00 N ATOM 1375 CA ALA A 173 -4.324 6.984 1.765 1.00 0.00 C ATOM 1376 C ALA A 173 -3.974 8.376 2.297 1.00 0.00 C ATOM 1377 O ALA A 173 -4.020 8.616 3.501 1.00 0.00 O ATOM 1378 CB ALA A 173 -3.060 6.323 1.195 1.00 0.00 C ATOM 0 H ALA A 173 -5.014 7.082 -0.214 1.00 0.00 H new ATOM 0 HA ALA A 173 -4.709 6.377 2.584 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -2.296 6.270 1.971 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -3.299 5.317 0.851 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -2.687 6.913 0.358 1.00 0.00 H new