USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 980 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 Single : A 327 TYR OH : rot 180:sc= 0 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 331 GLN : amide:sc= -0.286 X(o=-0.29,f=-0.036) USER MOD Single : A 340 MET CE :methyl 176:sc= -0.016 (180deg=-0.0328) USER MOD Single : A 345 ASN : amide:sc= -2.3 X(o=-2.3,f=-2.5!) USER MOD Single : A 351 LYS NZ :NH3+ -154:sc= 0.00535 (180deg=0) USER MOD Single : A 354 GLN :FLIP amide:sc= -0.265 F(o=-1.7,f=-0.26) USER MOD Single : B 327 TYR OH : rot 180:sc= 0 USER MOD Single : B 329 THR OG1 : rot 180:sc= 0 USER MOD Single : B 331 GLN : amide:sc= -0.0173 X(o=-0.017,f=-0.046) USER MOD Single : B 340 MET CE :methyl 175:sc= 0 (180deg=-0.0211) USER MOD Single : B 345 ASN :FLIP amide:sc= -2.66! C(o=-4.1!,f=-2.7!) USER MOD Single : B 351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 354 GLN :FLIP amide:sc= -0.161 F(o=-1.4,f=-0.16) USER MOD Single : C 327 TYR OH : rot 180:sc= 0 USER MOD Single : C 329 THR OG1 : rot 180:sc= 0 USER MOD Single : C 331 GLN : amide:sc= -1.46 X(o=-1.5,f=-1.2) USER MOD Single : C 340 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 345 ASN : amide:sc= -4.1! C(o=-4.1!,f=-5.3!) USER MOD Single : C 351 LYS NZ :NH3+ -171:sc= 0.417 (180deg=0.375) USER MOD Single : D 327 TYR OH : rot 180:sc= 0 USER MOD Single : D 329 THR OG1 : rot 180:sc= 0 USER MOD Single : D 331 GLN : amide:sc= -0.027 X(o=-0.027,f=-0.021) USER MOD Single : D 340 MET CE :methyl 175:sc= 0 (180deg=-0.0143) USER MOD Single : D 345 ASN :FLIP amide:sc= -2.34! C(o=-4.7!,f=-2.3!) USER MOD Single : D 351 LYS NZ :NH3+ 160:sc= -0.278 (180deg=-0.499) USER MOD Single : D 354 GLN :FLIP amide:sc= 0 F(o=-0.71,f=0) USER MOD ----------------------------------------------------------------- ATOM 121 N GLU A 326 15.304 8.807 10.500 1.00 0.48 N ATOM 122 CA GLU A 326 15.890 7.461 10.243 1.00 0.45 C ATOM 123 C GLU A 326 16.063 7.270 8.734 1.00 0.39 C ATOM 124 O GLU A 326 15.495 7.992 7.939 1.00 0.38 O ATOM 125 CB GLU A 326 14.958 6.377 10.790 1.00 0.46 C ATOM 126 CG GLU A 326 14.816 6.533 12.308 1.00 0.51 C ATOM 127 CD GLU A 326 15.970 5.812 13.010 1.00 1.39 C ATOM 128 OE1 GLU A 326 16.762 5.190 12.322 1.00 2.13 O ATOM 129 OE2 GLU A 326 16.041 5.895 14.226 1.00 2.13 O ATOM 0 HA GLU A 326 16.858 7.385 10.739 1.00 0.45 H new ATOM 0 HB2 GLU A 326 13.980 6.451 10.314 1.00 0.46 H new ATOM 0 HB3 GLU A 326 15.354 5.390 10.552 1.00 0.46 H new ATOM 0 HG2 GLU A 326 14.817 7.589 12.577 1.00 0.51 H new ATOM 0 HG3 GLU A 326 13.862 6.121 12.638 1.00 0.51 H new ATOM 136 N TYR A 327 16.844 6.306 8.332 1.00 0.36 N ATOM 137 CA TYR A 327 17.050 6.077 6.875 1.00 0.31 C ATOM 138 C TYR A 327 17.314 4.592 6.626 1.00 0.28 C ATOM 139 O TYR A 327 18.384 4.085 6.897 1.00 0.30 O ATOM 140 CB TYR A 327 18.248 6.898 6.401 1.00 0.34 C ATOM 141 CG TYR A 327 17.819 8.328 6.179 1.00 0.36 C ATOM 142 CD1 TYR A 327 17.238 8.702 4.961 1.00 0.36 C ATOM 143 CD2 TYR A 327 18.004 9.282 7.190 1.00 0.41 C ATOM 144 CE1 TYR A 327 16.839 10.028 4.752 1.00 0.40 C ATOM 145 CE2 TYR A 327 17.605 10.609 6.981 1.00 0.45 C ATOM 146 CZ TYR A 327 17.023 10.982 5.762 1.00 0.44 C ATOM 147 OH TYR A 327 16.632 12.291 5.557 1.00 0.48 O ATOM 0 H TYR A 327 17.348 5.668 8.948 1.00 0.36 H new ATOM 0 HA TYR A 327 16.159 6.382 6.325 1.00 0.31 H new ATOM 0 HB2 TYR A 327 19.047 6.857 7.141 1.00 0.34 H new ATOM 0 HB3 TYR A 327 18.648 6.479 5.478 1.00 0.34 H new ATOM 0 HD1 TYR A 327 17.097 7.967 4.182 1.00 0.36 H new ATOM 0 HD2 TYR A 327 18.454 8.994 8.129 1.00 0.41 H new ATOM 0 HE1 TYR A 327 16.390 10.315 3.813 1.00 0.40 H new ATOM 0 HE2 TYR A 327 17.746 11.344 7.759 1.00 0.45 H new ATOM 0 HH TYR A 327 16.830 12.821 6.357 1.00 0.48 H new ATOM 157 N PHE A 328 16.342 3.893 6.110 1.00 0.25 N ATOM 158 CA PHE A 328 16.524 2.438 5.845 1.00 0.23 C ATOM 159 C PHE A 328 16.546 2.191 4.337 1.00 0.22 C ATOM 160 O PHE A 328 16.685 3.103 3.547 1.00 0.22 O ATOM 161 CB PHE A 328 15.361 1.664 6.467 1.00 0.22 C ATOM 162 CG PHE A 328 15.319 1.938 7.950 1.00 0.24 C ATOM 163 CD1 PHE A 328 16.103 1.175 8.823 1.00 0.28 C ATOM 164 CD2 PHE A 328 14.498 2.957 8.450 1.00 0.25 C ATOM 165 CE1 PHE A 328 16.068 1.432 10.200 1.00 0.31 C ATOM 166 CE2 PHE A 328 14.463 3.213 9.826 1.00 0.28 C ATOM 167 CZ PHE A 328 15.249 2.451 10.701 1.00 0.30 C ATOM 0 H PHE A 328 15.427 4.267 5.860 1.00 0.25 H new ATOM 0 HA PHE A 328 17.465 2.103 6.281 1.00 0.23 H new ATOM 0 HB2 PHE A 328 14.421 1.962 6.003 1.00 0.22 H new ATOM 0 HB3 PHE A 328 15.481 0.596 6.286 1.00 0.22 H new ATOM 0 HD1 PHE A 328 16.734 0.389 8.436 1.00 0.28 H new ATOM 0 HD2 PHE A 328 13.893 3.544 7.775 1.00 0.25 H new ATOM 0 HE1 PHE A 328 16.673 0.844 10.875 1.00 0.31 H new ATOM 0 HE2 PHE A 328 13.830 3.998 10.213 1.00 0.28 H new ATOM 0 HZ PHE A 328 15.223 2.650 11.762 1.00 0.30 H new ATOM 177 N THR A 329 16.420 0.957 3.936 1.00 0.21 N ATOM 178 CA THR A 329 16.436 0.638 2.483 1.00 0.20 C ATOM 179 C THR A 329 15.650 -0.653 2.250 1.00 0.20 C ATOM 180 O THR A 329 15.422 -1.423 3.161 1.00 0.22 O ATOM 181 CB THR A 329 17.882 0.449 2.016 1.00 0.21 C ATOM 182 OG1 THR A 329 18.533 -0.486 2.863 1.00 0.21 O ATOM 183 CG2 THR A 329 18.616 1.788 2.072 1.00 0.21 C ATOM 0 H THR A 329 16.306 0.154 4.554 1.00 0.21 H new ATOM 0 HA THR A 329 15.982 1.454 1.921 1.00 0.20 H new ATOM 0 HB THR A 329 17.888 0.077 0.992 1.00 0.21 H new ATOM 0 HG1 THR A 329 19.458 -0.609 2.564 1.00 0.21 H new ATOM 0 HG21 THR A 329 19.645 1.653 1.740 1.00 0.21 H new ATOM 0 HG22 THR A 329 18.115 2.505 1.421 1.00 0.21 H new ATOM 0 HG23 THR A 329 18.612 2.163 3.096 1.00 0.21 H new ATOM 191 N LEU A 330 15.227 -0.895 1.039 1.00 0.19 N ATOM 192 CA LEU A 330 14.450 -2.134 0.763 1.00 0.20 C ATOM 193 C LEU A 330 14.683 -2.579 -0.683 1.00 0.19 C ATOM 194 O LEU A 330 14.558 -1.805 -1.611 1.00 0.19 O ATOM 195 CB LEU A 330 12.964 -1.844 0.980 1.00 0.20 C ATOM 196 CG LEU A 330 12.134 -3.047 0.534 1.00 0.21 C ATOM 197 CD1 LEU A 330 12.291 -4.180 1.551 1.00 0.28 C ATOM 198 CD2 LEU A 330 10.660 -2.642 0.445 1.00 0.22 C ATOM 0 H LEU A 330 15.386 -0.290 0.233 1.00 0.19 H new ATOM 0 HA LEU A 330 14.773 -2.929 1.434 1.00 0.20 H new ATOM 0 HB2 LEU A 330 12.775 -1.630 2.032 1.00 0.20 H new ATOM 0 HB3 LEU A 330 12.670 -0.958 0.417 1.00 0.20 H new ATOM 0 HG LEU A 330 12.479 -3.386 -0.443 1.00 0.21 H new ATOM 0 HD11 LEU A 330 11.699 -5.039 1.234 1.00 0.28 H new ATOM 0 HD12 LEU A 330 13.340 -4.467 1.617 1.00 0.28 H new ATOM 0 HD13 LEU A 330 11.945 -3.842 2.528 1.00 0.28 H new ATOM 0 HD21 LEU A 330 10.066 -3.499 0.127 1.00 0.22 H new ATOM 0 HD22 LEU A 330 10.316 -2.304 1.423 1.00 0.22 H new ATOM 0 HD23 LEU A 330 10.548 -1.834 -0.278 1.00 0.22 H new ATOM 210 N GLN A 331 15.015 -3.827 -0.882 1.00 0.21 N ATOM 211 CA GLN A 331 15.251 -4.329 -2.266 1.00 0.22 C ATOM 212 C GLN A 331 13.929 -4.825 -2.853 1.00 0.22 C ATOM 213 O GLN A 331 13.361 -5.793 -2.390 1.00 0.24 O ATOM 214 CB GLN A 331 16.255 -5.483 -2.226 1.00 0.24 C ATOM 215 CG GLN A 331 16.503 -5.993 -3.647 1.00 0.30 C ATOM 216 CD GLN A 331 18.001 -5.945 -3.956 1.00 0.43 C ATOM 217 OE1 GLN A 331 18.798 -6.536 -3.255 1.00 0.91 O ATOM 218 NE2 GLN A 331 18.424 -5.263 -4.987 1.00 0.29 N ATOM 0 H GLN A 331 15.133 -4.521 -0.144 1.00 0.21 H new ATOM 0 HA GLN A 331 15.649 -3.524 -2.885 1.00 0.22 H new ATOM 0 HB2 GLN A 331 17.192 -5.149 -1.779 1.00 0.24 H new ATOM 0 HB3 GLN A 331 15.873 -6.290 -1.600 1.00 0.24 H new ATOM 0 HG2 GLN A 331 16.133 -7.013 -3.748 1.00 0.30 H new ATOM 0 HG3 GLN A 331 15.954 -5.383 -4.364 1.00 0.30 H new ATOM 0 HE21 GLN A 331 17.758 -4.766 -5.578 1.00 0.29 H new ATOM 0 HE22 GLN A 331 19.421 -5.228 -5.201 1.00 0.29 H new ATOM 227 N ILE A 332 13.429 -4.171 -3.865 1.00 0.22 N ATOM 228 CA ILE A 332 12.142 -4.614 -4.469 1.00 0.23 C ATOM 229 C ILE A 332 12.409 -5.349 -5.782 1.00 0.24 C ATOM 230 O ILE A 332 12.831 -4.765 -6.761 1.00 0.26 O ATOM 231 CB ILE A 332 11.259 -3.397 -4.741 1.00 0.22 C ATOM 232 CG1 ILE A 332 11.180 -2.531 -3.483 1.00 0.21 C ATOM 233 CG2 ILE A 332 9.853 -3.862 -5.125 1.00 0.25 C ATOM 234 CD1 ILE A 332 10.522 -1.194 -3.828 1.00 0.24 C ATOM 0 H ILE A 332 13.855 -3.352 -4.298 1.00 0.22 H new ATOM 0 HA ILE A 332 11.636 -5.286 -3.776 1.00 0.23 H new ATOM 0 HB ILE A 332 11.687 -2.815 -5.557 1.00 0.22 H new ATOM 0 HG12 ILE A 332 10.606 -3.043 -2.711 1.00 0.21 H new ATOM 0 HG13 ILE A 332 12.179 -2.364 -3.080 1.00 0.21 H new ATOM 0 HG21 ILE A 332 9.223 -2.994 -5.319 1.00 0.25 H new ATOM 0 HG22 ILE A 332 9.906 -4.479 -6.022 1.00 0.25 H new ATOM 0 HG23 ILE A 332 9.427 -4.444 -4.308 1.00 0.25 H new ATOM 0 HD11 ILE A 332 10.465 -0.575 -2.933 1.00 0.24 H new ATOM 0 HD12 ILE A 332 11.115 -0.682 -4.586 1.00 0.24 H new ATOM 0 HD13 ILE A 332 9.517 -1.371 -4.212 1.00 0.24 H new ATOM 246 N ARG A 333 12.161 -6.627 -5.812 1.00 0.26 N ATOM 247 CA ARG A 333 12.393 -7.401 -7.060 1.00 0.28 C ATOM 248 C ARG A 333 11.307 -7.057 -8.084 1.00 0.27 C ATOM 249 O ARG A 333 10.186 -6.743 -7.733 1.00 0.27 O ATOM 250 CB ARG A 333 12.341 -8.896 -6.745 1.00 0.32 C ATOM 251 CG ARG A 333 13.633 -9.313 -6.038 1.00 0.42 C ATOM 252 CD ARG A 333 13.339 -9.616 -4.569 1.00 0.69 C ATOM 253 NE ARG A 333 14.021 -10.889 -4.171 1.00 1.44 N ATOM 254 CZ ARG A 333 13.903 -11.978 -4.888 1.00 1.96 C ATOM 255 NH1 ARG A 333 13.040 -12.041 -5.867 1.00 2.17 N ATOM 256 NH2 ARG A 333 14.612 -13.029 -4.581 1.00 2.92 N ATOM 0 H ARG A 333 11.807 -7.170 -5.024 1.00 0.26 H new ATOM 0 HA ARG A 333 13.371 -7.148 -7.470 1.00 0.28 H new ATOM 0 HB2 ARG A 333 11.481 -9.116 -6.113 1.00 0.32 H new ATOM 0 HB3 ARG A 333 12.216 -9.468 -7.664 1.00 0.32 H new ATOM 0 HG2 ARG A 333 14.057 -10.192 -6.523 1.00 0.42 H new ATOM 0 HG3 ARG A 333 14.374 -8.518 -6.114 1.00 0.42 H new ATOM 0 HD2 ARG A 333 13.685 -8.795 -3.942 1.00 0.69 H new ATOM 0 HD3 ARG A 333 12.264 -9.704 -4.414 1.00 0.69 H new ATOM 0 HE ARG A 333 14.589 -10.908 -3.324 1.00 1.44 H new ATOM 0 HH11 ARG A 333 12.450 -11.237 -6.079 1.00 2.17 H new ATOM 0 HH12 ARG A 333 12.957 -12.895 -6.419 1.00 2.17 H new ATOM 0 HH21 ARG A 333 15.252 -12.998 -3.788 1.00 2.92 H new ATOM 0 HH22 ARG A 333 14.526 -13.882 -5.134 1.00 2.92 H new ATOM 270 N GLY A 334 11.632 -7.112 -9.347 1.00 0.29 N ATOM 271 CA GLY A 334 10.621 -6.787 -10.392 1.00 0.31 C ATOM 272 C GLY A 334 10.584 -5.275 -10.614 1.00 0.33 C ATOM 273 O GLY A 334 10.532 -4.502 -9.678 1.00 0.40 O ATOM 0 H GLY A 334 12.554 -7.368 -9.700 1.00 0.29 H new ATOM 0 HA2 GLY A 334 10.869 -7.296 -11.323 1.00 0.31 H new ATOM 0 HA3 GLY A 334 9.638 -7.144 -10.085 1.00 0.31 H new ATOM 277 N ARG A 335 10.611 -4.845 -11.844 1.00 0.30 N ATOM 278 CA ARG A 335 10.581 -3.382 -12.120 1.00 0.34 C ATOM 279 C ARG A 335 9.147 -2.864 -11.987 1.00 0.32 C ATOM 280 O ARG A 335 8.908 -1.809 -11.432 1.00 0.30 O ATOM 281 CB ARG A 335 11.092 -3.120 -13.538 1.00 0.38 C ATOM 282 CG ARG A 335 10.931 -1.637 -13.870 1.00 0.47 C ATOM 283 CD ARG A 335 11.897 -1.254 -14.993 1.00 0.94 C ATOM 284 NE ARG A 335 11.426 0.003 -15.641 1.00 1.54 N ATOM 285 CZ ARG A 335 12.222 0.679 -16.424 1.00 2.11 C ATOM 286 NH1 ARG A 335 13.435 0.251 -16.655 1.00 2.43 N ATOM 287 NH2 ARG A 335 11.804 1.784 -16.977 1.00 3.01 N ATOM 0 H ARG A 335 10.653 -5.443 -12.670 1.00 0.30 H new ATOM 0 HA ARG A 335 11.219 -2.865 -11.403 1.00 0.34 H new ATOM 0 HB2 ARG A 335 12.140 -3.410 -13.618 1.00 0.38 H new ATOM 0 HB3 ARG A 335 10.537 -3.727 -14.254 1.00 0.38 H new ATOM 0 HG2 ARG A 335 9.905 -1.431 -14.174 1.00 0.47 H new ATOM 0 HG3 ARG A 335 11.129 -1.032 -12.985 1.00 0.47 H new ATOM 0 HD2 ARG A 335 12.901 -1.116 -14.593 1.00 0.94 H new ATOM 0 HD3 ARG A 335 11.954 -2.056 -15.728 1.00 0.94 H new ATOM 0 HE ARG A 335 10.477 0.337 -15.472 1.00 1.54 H new ATOM 0 HH11 ARG A 335 13.762 -0.613 -16.223 1.00 2.43 H new ATOM 0 HH12 ARG A 335 14.055 0.781 -17.267 1.00 2.43 H new ATOM 0 HH21 ARG A 335 10.857 2.118 -16.797 1.00 3.01 H new ATOM 0 HH22 ARG A 335 12.424 2.314 -17.589 1.00 3.01 H new ATOM 301 N GLU A 336 8.191 -3.592 -12.498 1.00 0.35 N ATOM 302 CA GLU A 336 6.773 -3.135 -12.408 1.00 0.38 C ATOM 303 C GLU A 336 6.382 -2.915 -10.942 1.00 0.38 C ATOM 304 O GLU A 336 5.896 -1.863 -10.573 1.00 0.39 O ATOM 305 CB GLU A 336 5.852 -4.191 -13.028 1.00 0.45 C ATOM 306 CG GLU A 336 6.166 -5.569 -12.440 1.00 1.34 C ATOM 307 CD GLU A 336 5.916 -6.644 -13.498 1.00 1.73 C ATOM 308 OE1 GLU A 336 4.922 -6.538 -14.198 1.00 2.29 O ATOM 309 OE2 GLU A 336 6.720 -7.556 -13.591 1.00 2.21 O ATOM 0 H GLU A 336 8.330 -4.483 -12.974 1.00 0.35 H new ATOM 0 HA GLU A 336 6.669 -2.195 -12.950 1.00 0.38 H new ATOM 0 HB2 GLU A 336 4.810 -3.934 -12.837 1.00 0.45 H new ATOM 0 HB3 GLU A 336 5.983 -4.210 -14.110 1.00 0.45 H new ATOM 0 HG2 GLU A 336 7.203 -5.606 -12.107 1.00 1.34 H new ATOM 0 HG3 GLU A 336 5.543 -5.753 -11.565 1.00 1.34 H new ATOM 316 N ARG A 337 6.583 -3.893 -10.102 1.00 0.43 N ATOM 317 CA ARG A 337 6.213 -3.727 -8.666 1.00 0.50 C ATOM 318 C ARG A 337 7.030 -2.590 -8.048 1.00 0.40 C ATOM 319 O ARG A 337 6.557 -1.866 -7.193 1.00 0.38 O ATOM 320 CB ARG A 337 6.503 -5.025 -7.914 1.00 0.64 C ATOM 321 CG ARG A 337 5.827 -6.191 -8.634 1.00 0.77 C ATOM 322 CD ARG A 337 4.348 -5.871 -8.860 1.00 1.10 C ATOM 323 NE ARG A 337 3.567 -7.141 -8.852 1.00 1.39 N ATOM 324 CZ ARG A 337 2.265 -7.115 -8.749 1.00 2.18 C ATOM 325 NH1 ARG A 337 1.635 -5.974 -8.667 1.00 2.72 N ATOM 326 NH2 ARG A 337 1.594 -8.232 -8.726 1.00 2.93 N ATOM 0 H ARG A 337 6.986 -4.798 -10.346 1.00 0.43 H new ATOM 0 HA ARG A 337 5.152 -3.489 -8.594 1.00 0.50 H new ATOM 0 HB2 ARG A 337 7.579 -5.193 -7.857 1.00 0.64 H new ATOM 0 HB3 ARG A 337 6.137 -4.954 -6.890 1.00 0.64 H new ATOM 0 HG2 ARG A 337 6.319 -6.375 -9.589 1.00 0.77 H new ATOM 0 HG3 ARG A 337 5.926 -7.102 -8.043 1.00 0.77 H new ATOM 0 HD2 ARG A 337 3.985 -5.201 -8.080 1.00 1.10 H new ATOM 0 HD3 ARG A 337 4.216 -5.354 -9.811 1.00 1.10 H new ATOM 0 HE ARG A 337 4.052 -8.035 -8.927 1.00 1.39 H new ATOM 0 HH11 ARG A 337 2.160 -5.099 -8.683 1.00 2.72 H new ATOM 0 HH12 ARG A 337 0.618 -5.957 -8.587 1.00 2.72 H new ATOM 0 HH21 ARG A 337 2.086 -9.124 -8.788 1.00 2.93 H new ATOM 0 HH22 ARG A 337 0.577 -8.215 -8.646 1.00 2.93 H new ATOM 340 N PHE A 338 8.255 -2.430 -8.466 1.00 0.38 N ATOM 341 CA PHE A 338 9.100 -1.344 -7.896 1.00 0.34 C ATOM 342 C PHE A 338 8.389 0.005 -8.055 1.00 0.28 C ATOM 343 O PHE A 338 8.150 0.704 -7.094 1.00 0.27 O ATOM 344 CB PHE A 338 10.446 -1.305 -8.624 1.00 0.35 C ATOM 345 CG PHE A 338 11.251 -0.127 -8.134 1.00 0.33 C ATOM 346 CD1 PHE A 338 11.823 -0.155 -6.855 1.00 0.33 C ATOM 347 CD2 PHE A 338 11.424 0.995 -8.954 1.00 0.36 C ATOM 348 CE1 PHE A 338 12.571 0.938 -6.398 1.00 0.34 C ATOM 349 CE2 PHE A 338 12.173 2.089 -8.497 1.00 0.37 C ATOM 350 CZ PHE A 338 12.745 2.061 -7.219 1.00 0.35 C ATOM 0 H PHE A 338 8.707 -3.004 -9.177 1.00 0.38 H new ATOM 0 HA PHE A 338 9.267 -1.538 -6.837 1.00 0.34 H new ATOM 0 HB2 PHE A 338 10.993 -2.231 -8.448 1.00 0.35 H new ATOM 0 HB3 PHE A 338 10.287 -1.228 -9.700 1.00 0.35 H new ATOM 0 HD1 PHE A 338 11.687 -1.019 -6.222 1.00 0.33 H new ATOM 0 HD2 PHE A 338 10.981 1.018 -9.938 1.00 0.36 H new ATOM 0 HE1 PHE A 338 13.014 0.915 -5.413 1.00 0.34 H new ATOM 0 HE2 PHE A 338 12.309 2.953 -9.131 1.00 0.37 H new ATOM 0 HZ PHE A 338 13.320 2.904 -6.866 1.00 0.35 H new ATOM 360 N GLU A 339 8.058 0.377 -9.261 1.00 0.28 N ATOM 361 CA GLU A 339 7.370 1.683 -9.482 1.00 0.28 C ATOM 362 C GLU A 339 6.150 1.807 -8.563 1.00 0.25 C ATOM 363 O GLU A 339 5.832 2.877 -8.085 1.00 0.24 O ATOM 364 CB GLU A 339 6.916 1.775 -10.939 1.00 0.34 C ATOM 365 CG GLU A 339 8.128 2.031 -11.837 1.00 0.38 C ATOM 366 CD GLU A 339 7.655 2.296 -13.266 1.00 1.18 C ATOM 367 OE1 GLU A 339 7.134 1.378 -13.876 1.00 1.89 O ATOM 368 OE2 GLU A 339 7.819 3.414 -13.727 1.00 1.97 O ATOM 0 H GLU A 339 8.234 -0.167 -10.105 1.00 0.28 H new ATOM 0 HA GLU A 339 8.066 2.491 -9.256 1.00 0.28 H new ATOM 0 HB2 GLU A 339 6.420 0.851 -11.235 1.00 0.34 H new ATOM 0 HB3 GLU A 339 6.189 2.579 -11.054 1.00 0.34 H new ATOM 0 HG2 GLU A 339 8.695 2.885 -11.466 1.00 0.38 H new ATOM 0 HG3 GLU A 339 8.797 1.171 -11.817 1.00 0.38 H new ATOM 375 N MET A 340 5.457 0.726 -8.320 1.00 0.24 N ATOM 376 CA MET A 340 4.253 0.798 -7.441 1.00 0.22 C ATOM 377 C MET A 340 4.664 1.238 -6.033 1.00 0.19 C ATOM 378 O MET A 340 4.069 2.125 -5.450 1.00 0.19 O ATOM 379 CB MET A 340 3.582 -0.579 -7.373 1.00 0.24 C ATOM 380 CG MET A 340 2.202 -0.447 -6.721 1.00 0.27 C ATOM 381 SD MET A 340 1.319 -2.023 -6.855 1.00 0.29 S ATOM 382 CE MET A 340 2.082 -2.843 -5.433 1.00 0.31 C ATOM 0 H MET A 340 5.671 -0.200 -8.690 1.00 0.24 H new ATOM 0 HA MET A 340 3.551 1.523 -7.853 1.00 0.22 H new ATOM 0 HB2 MET A 340 3.483 -0.996 -8.375 1.00 0.24 H new ATOM 0 HB3 MET A 340 4.202 -1.269 -6.800 1.00 0.24 H new ATOM 0 HG2 MET A 340 2.308 -0.165 -5.673 1.00 0.27 H new ATOM 0 HG3 MET A 340 1.632 0.344 -7.208 1.00 0.27 H new ATOM 0 HE1 MET A 340 1.623 -3.821 -5.287 1.00 0.31 H new ATOM 0 HE2 MET A 340 3.150 -2.967 -5.614 1.00 0.31 H new ATOM 0 HE3 MET A 340 1.934 -2.236 -4.540 1.00 0.31 H new ATOM 392 N PHE A 341 5.671 0.623 -5.477 1.00 0.16 N ATOM 393 CA PHE A 341 6.112 1.001 -4.105 1.00 0.14 C ATOM 394 C PHE A 341 6.590 2.458 -4.091 1.00 0.15 C ATOM 395 O PHE A 341 6.218 3.235 -3.234 1.00 0.15 O ATOM 396 CB PHE A 341 7.260 0.086 -3.673 1.00 0.14 C ATOM 397 CG PHE A 341 6.710 -1.253 -3.236 1.00 0.14 C ATOM 398 CD1 PHE A 341 6.048 -1.370 -2.007 1.00 0.17 C ATOM 399 CD2 PHE A 341 6.870 -2.378 -4.056 1.00 0.15 C ATOM 400 CE1 PHE A 341 5.545 -2.613 -1.600 1.00 0.18 C ATOM 401 CE2 PHE A 341 6.366 -3.621 -3.647 1.00 0.17 C ATOM 402 CZ PHE A 341 5.705 -3.738 -2.419 1.00 0.17 C ATOM 0 H PHE A 341 6.208 -0.126 -5.914 1.00 0.16 H new ATOM 0 HA PHE A 341 5.274 0.893 -3.416 1.00 0.14 H new ATOM 0 HB2 PHE A 341 7.960 -0.049 -4.498 1.00 0.14 H new ATOM 0 HB3 PHE A 341 7.816 0.546 -2.856 1.00 0.14 H new ATOM 0 HD1 PHE A 341 5.925 -0.504 -1.374 1.00 0.17 H new ATOM 0 HD2 PHE A 341 7.381 -2.288 -5.003 1.00 0.15 H new ATOM 0 HE1 PHE A 341 5.033 -2.704 -0.653 1.00 0.18 H new ATOM 0 HE2 PHE A 341 6.488 -4.488 -4.280 1.00 0.17 H new ATOM 0 HZ PHE A 341 5.318 -4.696 -2.103 1.00 0.17 H new ATOM 412 N ARG A 342 7.416 2.828 -5.028 1.00 0.17 N ATOM 413 CA ARG A 342 7.930 4.228 -5.068 1.00 0.19 C ATOM 414 C ARG A 342 6.772 5.220 -4.942 1.00 0.18 C ATOM 415 O ARG A 342 6.866 6.212 -4.248 1.00 0.19 O ATOM 416 CB ARG A 342 8.656 4.462 -6.394 1.00 0.24 C ATOM 417 CG ARG A 342 9.407 5.791 -6.334 1.00 0.32 C ATOM 418 CD ARG A 342 9.674 6.286 -7.754 1.00 0.61 C ATOM 419 NE ARG A 342 9.886 7.761 -7.731 1.00 1.14 N ATOM 420 CZ ARG A 342 10.407 8.366 -8.764 1.00 1.74 C ATOM 421 NH1 ARG A 342 10.749 7.682 -9.821 1.00 2.34 N ATOM 422 NH2 ARG A 342 10.584 9.657 -8.740 1.00 2.42 N ATOM 0 H ARG A 342 7.760 2.220 -5.772 1.00 0.17 H new ATOM 0 HA ARG A 342 8.618 4.378 -4.236 1.00 0.19 H new ATOM 0 HB2 ARG A 342 9.353 3.647 -6.589 1.00 0.24 H new ATOM 0 HB3 ARG A 342 7.940 4.473 -7.216 1.00 0.24 H new ATOM 0 HG2 ARG A 342 8.822 6.528 -5.784 1.00 0.32 H new ATOM 0 HG3 ARG A 342 10.348 5.666 -5.797 1.00 0.32 H new ATOM 0 HD2 ARG A 342 10.551 5.788 -8.166 1.00 0.61 H new ATOM 0 HD3 ARG A 342 8.833 6.038 -8.402 1.00 0.61 H new ATOM 0 HE ARG A 342 9.623 8.300 -6.906 1.00 1.14 H new ATOM 0 HH11 ARG A 342 10.610 6.672 -9.842 1.00 2.34 H new ATOM 0 HH12 ARG A 342 11.156 8.157 -10.627 1.00 2.34 H new ATOM 0 HH21 ARG A 342 10.316 10.193 -7.915 1.00 2.42 H new ATOM 0 HH22 ARG A 342 10.991 10.131 -9.546 1.00 2.42 H new ATOM 436 N GLU A 343 5.685 4.969 -5.615 1.00 0.20 N ATOM 437 CA GLU A 343 4.528 5.907 -5.536 1.00 0.21 C ATOM 438 C GLU A 343 4.060 6.037 -4.084 1.00 0.16 C ATOM 439 O GLU A 343 3.868 7.126 -3.579 1.00 0.15 O ATOM 440 CB GLU A 343 3.379 5.374 -6.392 1.00 0.25 C ATOM 441 CG GLU A 343 2.187 6.327 -6.290 1.00 0.54 C ATOM 442 CD GLU A 343 2.301 7.396 -7.376 1.00 1.48 C ATOM 443 OE1 GLU A 343 2.234 7.039 -8.541 1.00 2.12 O ATOM 444 OE2 GLU A 343 2.456 8.555 -7.026 1.00 2.35 O ATOM 0 H GLU A 343 5.546 4.157 -6.216 1.00 0.20 H new ATOM 0 HA GLU A 343 4.837 6.886 -5.904 1.00 0.21 H new ATOM 0 HB2 GLU A 343 3.697 5.281 -7.430 1.00 0.25 H new ATOM 0 HB3 GLU A 343 3.092 4.378 -6.056 1.00 0.25 H new ATOM 0 HG2 GLU A 343 1.254 5.775 -6.404 1.00 0.54 H new ATOM 0 HG3 GLU A 343 2.163 6.794 -5.305 1.00 0.54 H new ATOM 451 N LEU A 344 3.867 4.936 -3.411 1.00 0.15 N ATOM 452 CA LEU A 344 3.402 5.000 -1.996 1.00 0.13 C ATOM 453 C LEU A 344 4.435 5.742 -1.145 1.00 0.13 C ATOM 454 O LEU A 344 4.098 6.402 -0.181 1.00 0.14 O ATOM 455 CB LEU A 344 3.229 3.580 -1.452 1.00 0.15 C ATOM 456 CG LEU A 344 2.021 2.922 -2.115 1.00 0.15 C ATOM 457 CD1 LEU A 344 2.124 1.403 -1.968 1.00 0.17 C ATOM 458 CD2 LEU A 344 0.737 3.414 -1.441 1.00 0.18 C ATOM 0 H LEU A 344 4.011 3.996 -3.779 1.00 0.15 H new ATOM 0 HA LEU A 344 2.450 5.529 -1.955 1.00 0.13 H new ATOM 0 HB2 LEU A 344 4.127 2.994 -1.645 1.00 0.15 H new ATOM 0 HB3 LEU A 344 3.093 3.608 -0.371 1.00 0.15 H new ATOM 0 HG LEU A 344 1.999 3.185 -3.173 1.00 0.15 H new ATOM 0 HD11 LEU A 344 1.262 0.932 -2.441 1.00 0.17 H new ATOM 0 HD12 LEU A 344 3.038 1.052 -2.448 1.00 0.17 H new ATOM 0 HD13 LEU A 344 2.146 1.140 -0.910 1.00 0.17 H new ATOM 0 HD21 LEU A 344 -0.125 2.944 -1.914 1.00 0.18 H new ATOM 0 HD22 LEU A 344 0.758 3.152 -0.383 1.00 0.18 H new ATOM 0 HD23 LEU A 344 0.663 4.496 -1.545 1.00 0.18 H new ATOM 470 N ASN A 345 5.688 5.638 -1.490 1.00 0.16 N ATOM 471 CA ASN A 345 6.742 6.333 -0.696 1.00 0.19 C ATOM 472 C ASN A 345 6.448 7.835 -0.651 1.00 0.17 C ATOM 473 O ASN A 345 6.375 8.433 0.404 1.00 0.16 O ATOM 474 CB ASN A 345 8.106 6.105 -1.353 1.00 0.26 C ATOM 475 CG ASN A 345 9.206 6.683 -0.462 1.00 0.30 C ATOM 476 OD1 ASN A 345 8.936 7.455 0.435 1.00 1.09 O ATOM 477 ND2 ASN A 345 10.447 6.339 -0.676 1.00 0.69 N ATOM 0 H ASN A 345 6.029 5.102 -2.288 1.00 0.16 H new ATOM 0 HA ASN A 345 6.751 5.935 0.319 1.00 0.19 H new ATOM 0 HB2 ASN A 345 8.273 5.039 -1.509 1.00 0.26 H new ATOM 0 HB3 ASN A 345 8.132 6.579 -2.334 1.00 0.26 H new ATOM 0 HD21 ASN A 345 11.190 6.719 -0.089 1.00 0.69 H new ATOM 0 HD22 ASN A 345 10.674 5.690 -1.430 1.00 0.69 H new ATOM 484 N GLU A 346 6.287 8.449 -1.792 1.00 0.17 N ATOM 485 CA GLU A 346 6.006 9.912 -1.817 1.00 0.17 C ATOM 486 C GLU A 346 4.677 10.204 -1.118 1.00 0.14 C ATOM 487 O GLU A 346 4.472 11.276 -0.591 1.00 0.15 O ATOM 488 CB GLU A 346 5.928 10.395 -3.266 1.00 0.20 C ATOM 489 CG GLU A 346 5.993 11.923 -3.294 1.00 0.24 C ATOM 490 CD GLU A 346 7.431 12.378 -3.039 1.00 0.88 C ATOM 491 OE1 GLU A 346 8.198 12.407 -3.988 1.00 1.65 O ATOM 492 OE2 GLU A 346 7.740 12.691 -1.902 1.00 1.54 O ATOM 0 H GLU A 346 6.338 8.001 -2.707 1.00 0.17 H new ATOM 0 HA GLU A 346 6.809 10.434 -1.297 1.00 0.17 H new ATOM 0 HB2 GLU A 346 6.749 9.974 -3.846 1.00 0.20 H new ATOM 0 HB3 GLU A 346 5.002 10.050 -3.727 1.00 0.20 H new ATOM 0 HG2 GLU A 346 5.649 12.294 -4.259 1.00 0.24 H new ATOM 0 HG3 GLU A 346 5.329 12.340 -2.537 1.00 0.24 H new ATOM 499 N ALA A 347 3.771 9.267 -1.118 1.00 0.13 N ATOM 500 CA ALA A 347 2.454 9.503 -0.458 1.00 0.14 C ATOM 501 C ALA A 347 2.656 9.761 1.039 1.00 0.15 C ATOM 502 O ALA A 347 2.272 10.791 1.557 1.00 0.18 O ATOM 503 CB ALA A 347 1.559 8.277 -0.648 1.00 0.15 C ATOM 0 H ALA A 347 3.884 8.348 -1.546 1.00 0.13 H new ATOM 0 HA ALA A 347 1.981 10.375 -0.910 1.00 0.14 H new ATOM 0 HB1 ALA A 347 0.597 8.450 -0.165 1.00 0.15 H new ATOM 0 HB2 ALA A 347 1.404 8.101 -1.713 1.00 0.15 H new ATOM 0 HB3 ALA A 347 2.037 7.405 -0.202 1.00 0.15 H new ATOM 509 N LEU A 348 3.243 8.830 1.742 1.00 0.16 N ATOM 510 CA LEU A 348 3.452 9.021 3.208 1.00 0.20 C ATOM 511 C LEU A 348 4.330 10.248 3.457 1.00 0.20 C ATOM 512 O LEU A 348 4.018 11.088 4.278 1.00 0.23 O ATOM 513 CB LEU A 348 4.147 7.790 3.796 1.00 0.23 C ATOM 514 CG LEU A 348 3.133 6.660 3.978 1.00 0.25 C ATOM 515 CD1 LEU A 348 1.933 7.168 4.780 1.00 0.30 C ATOM 516 CD2 LEU A 348 2.667 6.178 2.605 1.00 0.21 C ATOM 0 H LEU A 348 3.587 7.946 1.366 1.00 0.16 H new ATOM 0 HA LEU A 348 2.481 9.163 3.683 1.00 0.20 H new ATOM 0 HB2 LEU A 348 4.952 7.466 3.136 1.00 0.23 H new ATOM 0 HB3 LEU A 348 4.602 8.041 4.754 1.00 0.23 H new ATOM 0 HG LEU A 348 3.598 5.835 4.517 1.00 0.25 H new ATOM 0 HD11 LEU A 348 1.212 6.360 4.908 1.00 0.30 H new ATOM 0 HD12 LEU A 348 2.269 7.513 5.758 1.00 0.30 H new ATOM 0 HD13 LEU A 348 1.462 7.993 4.246 1.00 0.30 H new ATOM 0 HD21 LEU A 348 1.944 5.372 2.729 1.00 0.21 H new ATOM 0 HD22 LEU A 348 2.201 7.004 2.068 1.00 0.21 H new ATOM 0 HD23 LEU A 348 3.523 5.813 2.038 1.00 0.21 H new ATOM 528 N GLU A 349 5.431 10.356 2.766 1.00 0.19 N ATOM 529 CA GLU A 349 6.327 11.527 2.980 1.00 0.21 C ATOM 530 C GLU A 349 5.545 12.819 2.743 1.00 0.20 C ATOM 531 O GLU A 349 5.787 13.828 3.373 1.00 0.23 O ATOM 532 CB GLU A 349 7.505 11.458 2.007 1.00 0.21 C ATOM 533 CG GLU A 349 8.516 10.422 2.497 1.00 0.27 C ATOM 534 CD GLU A 349 9.775 10.487 1.630 1.00 1.19 C ATOM 535 OE1 GLU A 349 10.184 11.587 1.295 1.00 1.89 O ATOM 536 OE2 GLU A 349 10.310 9.436 1.317 1.00 1.94 O ATOM 0 H GLU A 349 5.748 9.687 2.065 1.00 0.19 H new ATOM 0 HA GLU A 349 6.702 11.512 4.003 1.00 0.21 H new ATOM 0 HB2 GLU A 349 7.151 11.193 1.011 1.00 0.21 H new ATOM 0 HB3 GLU A 349 7.981 12.435 1.927 1.00 0.21 H new ATOM 0 HG2 GLU A 349 8.770 10.611 3.540 1.00 0.27 H new ATOM 0 HG3 GLU A 349 8.081 9.424 2.451 1.00 0.27 H new ATOM 543 N LEU A 350 4.608 12.795 1.839 1.00 0.21 N ATOM 544 CA LEU A 350 3.809 14.020 1.563 1.00 0.24 C ATOM 545 C LEU A 350 3.008 14.390 2.813 1.00 0.26 C ATOM 546 O LEU A 350 2.959 15.536 3.215 1.00 0.31 O ATOM 547 CB LEU A 350 2.855 13.751 0.397 1.00 0.27 C ATOM 548 CG LEU A 350 2.385 15.078 -0.198 1.00 0.33 C ATOM 549 CD1 LEU A 350 1.503 14.808 -1.419 1.00 0.46 C ATOM 550 CD2 LEU A 350 1.580 15.846 0.854 1.00 0.41 C ATOM 0 H LEU A 350 4.360 11.980 1.279 1.00 0.21 H new ATOM 0 HA LEU A 350 4.473 14.844 1.301 1.00 0.24 H new ATOM 0 HB2 LEU A 350 3.356 13.156 -0.366 1.00 0.27 H new ATOM 0 HB3 LEU A 350 1.998 13.172 0.741 1.00 0.27 H new ATOM 0 HG LEU A 350 3.249 15.669 -0.501 1.00 0.33 H new ATOM 0 HD11 LEU A 350 1.168 15.755 -1.843 1.00 0.46 H new ATOM 0 HD12 LEU A 350 2.075 14.258 -2.166 1.00 0.46 H new ATOM 0 HD13 LEU A 350 0.637 14.218 -1.119 1.00 0.46 H new ATOM 0 HD21 LEU A 350 1.243 16.793 0.434 1.00 0.41 H new ATOM 0 HD22 LEU A 350 0.715 15.254 1.154 1.00 0.41 H new ATOM 0 HD23 LEU A 350 2.208 16.038 1.724 1.00 0.41 H new ATOM 562 N LYS A 351 2.382 13.427 3.433 1.00 0.24 N ATOM 563 CA LYS A 351 1.586 13.718 4.659 1.00 0.27 C ATOM 564 C LYS A 351 2.501 14.301 5.740 1.00 0.30 C ATOM 565 O LYS A 351 2.169 15.270 6.389 1.00 0.37 O ATOM 566 CB LYS A 351 0.954 12.421 5.174 1.00 0.27 C ATOM 567 CG LYS A 351 -0.166 12.751 6.161 1.00 0.30 C ATOM 568 CD LYS A 351 -0.748 11.451 6.725 1.00 0.31 C ATOM 569 CE LYS A 351 -2.267 11.581 6.845 1.00 0.36 C ATOM 570 NZ LYS A 351 -2.901 11.205 5.550 1.00 1.40 N ATOM 0 H LYS A 351 2.388 12.449 3.143 1.00 0.24 H new ATOM 0 HA LYS A 351 0.803 14.438 4.420 1.00 0.27 H new ATOM 0 HB2 LYS A 351 0.558 11.842 4.340 1.00 0.27 H new ATOM 0 HB3 LYS A 351 1.710 11.804 5.660 1.00 0.27 H new ATOM 0 HG2 LYS A 351 0.219 13.371 6.971 1.00 0.30 H new ATOM 0 HG3 LYS A 351 -0.947 13.326 5.663 1.00 0.30 H new ATOM 0 HD2 LYS A 351 -0.494 10.614 6.074 1.00 0.31 H new ATOM 0 HD3 LYS A 351 -0.312 11.239 7.701 1.00 0.31 H new ATOM 0 HE2 LYS A 351 -2.636 10.937 7.643 1.00 0.36 H new ATOM 0 HE3 LYS A 351 -2.535 12.604 7.110 1.00 0.36 H new ATOM 0 HZ1 LYS A 351 -3.820 11.684 5.461 1.00 1.40 H new ATOM 0 HZ2 LYS A 351 -2.283 11.493 4.764 1.00 1.40 H new ATOM 0 HZ3 LYS A 351 -3.043 10.175 5.519 1.00 1.40 H new ATOM 584 N ASP A 352 3.651 13.713 5.940 1.00 0.31 N ATOM 585 CA ASP A 352 4.581 14.235 6.982 1.00 0.38 C ATOM 586 C ASP A 352 4.864 15.717 6.723 1.00 0.42 C ATOM 587 O ASP A 352 4.981 16.504 7.640 1.00 0.50 O ATOM 588 CB ASP A 352 5.894 13.452 6.940 1.00 0.42 C ATOM 589 CG ASP A 352 5.691 12.071 7.566 1.00 0.44 C ATOM 590 OD1 ASP A 352 4.570 11.589 7.544 1.00 1.09 O ATOM 591 OD2 ASP A 352 6.661 11.517 8.058 1.00 1.16 O ATOM 0 H ASP A 352 3.985 12.896 5.428 1.00 0.31 H new ATOM 0 HA ASP A 352 4.121 14.119 7.963 1.00 0.38 H new ATOM 0 HB2 ASP A 352 6.234 13.348 5.910 1.00 0.42 H new ATOM 0 HB3 ASP A 352 6.670 13.996 7.479 1.00 0.42 H new ATOM 596 N ALA A 353 4.980 16.103 5.480 1.00 0.40 N ATOM 597 CA ALA A 353 5.260 17.533 5.168 1.00 0.48 C ATOM 598 C ALA A 353 4.066 18.396 5.586 1.00 0.53 C ATOM 599 O ALA A 353 4.216 19.546 5.947 1.00 0.63 O ATOM 600 CB ALA A 353 5.495 17.689 3.665 1.00 0.48 C ATOM 0 H ALA A 353 4.893 15.490 4.669 1.00 0.40 H new ATOM 0 HA ALA A 353 6.147 17.854 5.714 1.00 0.48 H new ATOM 0 HB1 ALA A 353 5.700 18.735 3.435 1.00 0.48 H new ATOM 0 HB2 ALA A 353 6.346 17.078 3.364 1.00 0.48 H new ATOM 0 HB3 ALA A 353 4.607 17.366 3.122 1.00 0.48 H new ATOM 606 N GLN A 354 2.880 17.849 5.541 1.00 0.49 N ATOM 607 CA GLN A 354 1.677 18.639 5.935 1.00 0.57 C ATOM 608 C GLN A 354 1.519 18.615 7.457 1.00 0.62 C ATOM 609 O GLN A 354 0.662 19.273 8.012 1.00 0.77 O ATOM 610 CB GLN A 354 0.431 18.032 5.289 1.00 0.54 C ATOM 611 CG GLN A 354 -0.406 19.148 4.665 1.00 1.15 C ATOM 612 CD GLN A 354 -1.402 18.552 3.667 1.00 1.10 C ATOM 613 OE1 GLN A 354 -1.753 17.300 3.777 1.00 1.47 O flip ATOM 614 NE2 GLN A 354 -1.868 19.236 2.778 1.00 0.73 N flip ATOM 0 H GLN A 354 2.692 16.890 5.249 1.00 0.49 H new ATOM 0 HA GLN A 354 1.799 19.668 5.598 1.00 0.57 H new ATOM 0 HB2 GLN A 354 0.718 17.307 4.527 1.00 0.54 H new ATOM 0 HB3 GLN A 354 -0.155 17.495 6.035 1.00 0.54 H new ATOM 0 HG2 GLN A 354 -0.939 19.694 5.443 1.00 1.15 H new ATOM 0 HG3 GLN A 354 0.243 19.864 4.161 1.00 1.15 H new ATOM 0 HE21 GLN A 354 -1.594 20.215 2.691 1.00 0.73 H new ATOM 0 HE22 GLN A 354 -2.533 18.832 2.119 1.00 0.73 H new ATOM 820 N GLU B 326 -15.526 9.457 -10.568 1.00 0.47 N ATOM 821 CA GLU B 326 -16.122 8.106 -10.364 1.00 0.45 C ATOM 822 C GLU B 326 -16.297 7.854 -8.864 1.00 0.39 C ATOM 823 O GLU B 326 -15.718 8.530 -8.036 1.00 0.38 O ATOM 824 CB GLU B 326 -15.199 7.037 -10.954 1.00 0.46 C ATOM 825 CG GLU B 326 -15.057 7.251 -12.462 1.00 0.51 C ATOM 826 CD GLU B 326 -16.220 6.573 -13.189 1.00 1.39 C ATOM 827 OE1 GLU B 326 -17.007 5.918 -12.524 1.00 2.13 O ATOM 828 OE2 GLU B 326 -16.305 6.720 -14.396 1.00 2.13 O ATOM 0 HA GLU B 326 -17.090 8.059 -10.862 1.00 0.45 H new ATOM 0 HB2 GLU B 326 -14.220 7.085 -10.477 1.00 0.46 H new ATOM 0 HB3 GLU B 326 -15.603 6.044 -10.755 1.00 0.46 H new ATOM 0 HG2 GLU B 326 -15.045 8.317 -12.689 1.00 0.51 H new ATOM 0 HG3 GLU B 326 -14.109 6.841 -12.810 1.00 0.51 H new ATOM 835 N TYR B 327 -17.089 6.885 -8.508 1.00 0.37 N ATOM 836 CA TYR B 327 -17.300 6.590 -7.066 1.00 0.32 C ATOM 837 C TYR B 327 -17.570 5.096 -6.893 1.00 0.29 C ATOM 838 O TYR B 327 -18.628 4.601 -7.229 1.00 0.30 O ATOM 839 CB TYR B 327 -18.492 7.403 -6.549 1.00 0.34 C ATOM 840 CG TYR B 327 -18.044 8.818 -6.267 1.00 0.37 C ATOM 841 CD1 TYR B 327 -17.455 9.132 -5.034 1.00 0.36 C ATOM 842 CD2 TYR B 327 -18.214 9.816 -7.236 1.00 0.42 C ATOM 843 CE1 TYR B 327 -17.039 10.444 -4.771 1.00 0.40 C ATOM 844 CE2 TYR B 327 -17.798 11.127 -6.973 1.00 0.45 C ATOM 845 CZ TYR B 327 -17.210 11.442 -5.741 1.00 0.44 C ATOM 846 OH TYR B 327 -16.801 12.734 -5.482 1.00 0.48 O ATOM 0 H TYR B 327 -17.600 6.283 -9.154 1.00 0.37 H new ATOM 0 HA TYR B 327 -16.411 6.862 -6.498 1.00 0.32 H new ATOM 0 HB2 TYR B 327 -19.295 7.403 -7.287 1.00 0.34 H new ATOM 0 HB3 TYR B 327 -18.892 6.948 -5.643 1.00 0.34 H new ATOM 0 HD1 TYR B 327 -17.322 8.363 -4.287 1.00 0.36 H new ATOM 0 HD2 TYR B 327 -18.666 9.574 -8.186 1.00 0.42 H new ATOM 0 HE1 TYR B 327 -16.587 10.687 -3.821 1.00 0.40 H new ATOM 0 HE2 TYR B 327 -17.930 11.896 -7.720 1.00 0.45 H new ATOM 0 HH TYR B 327 -16.991 13.299 -6.259 1.00 0.48 H new ATOM 856 N PHE B 328 -16.613 4.370 -6.380 1.00 0.26 N ATOM 857 CA PHE B 328 -16.804 2.905 -6.192 1.00 0.24 C ATOM 858 C PHE B 328 -16.821 2.581 -4.697 1.00 0.23 C ATOM 859 O PHE B 328 -16.922 3.457 -3.862 1.00 0.23 O ATOM 860 CB PHE B 328 -15.653 2.148 -6.859 1.00 0.23 C ATOM 861 CG PHE B 328 -15.609 2.480 -8.331 1.00 0.25 C ATOM 862 CD1 PHE B 328 -16.394 1.754 -9.238 1.00 0.28 C ATOM 863 CD2 PHE B 328 -14.783 3.513 -8.791 1.00 0.25 C ATOM 864 CE1 PHE B 328 -16.351 2.063 -10.604 1.00 0.32 C ATOM 865 CE2 PHE B 328 -14.742 3.822 -10.158 1.00 0.28 C ATOM 866 CZ PHE B 328 -15.525 3.096 -11.064 1.00 0.31 C ATOM 0 H PHE B 328 -15.706 4.730 -6.083 1.00 0.26 H new ATOM 0 HA PHE B 328 -17.749 2.603 -6.644 1.00 0.24 H new ATOM 0 HB2 PHE B 328 -14.707 2.416 -6.388 1.00 0.23 H new ATOM 0 HB3 PHE B 328 -15.784 1.075 -6.723 1.00 0.23 H new ATOM 0 HD1 PHE B 328 -17.031 0.957 -8.884 1.00 0.28 H new ATOM 0 HD2 PHE B 328 -14.177 4.072 -8.093 1.00 0.25 H new ATOM 0 HE1 PHE B 328 -16.956 1.504 -11.303 1.00 0.32 H new ATOM 0 HE2 PHE B 328 -14.106 4.620 -10.512 1.00 0.28 H new ATOM 0 HZ PHE B 328 -15.492 3.333 -12.117 1.00 0.31 H new ATOM 876 N THR B 329 -16.720 1.328 -4.355 1.00 0.22 N ATOM 877 CA THR B 329 -16.732 0.945 -2.917 1.00 0.21 C ATOM 878 C THR B 329 -15.956 -0.361 -2.741 1.00 0.21 C ATOM 879 O THR B 329 -15.729 -1.088 -3.687 1.00 0.23 O ATOM 880 CB THR B 329 -18.178 0.752 -2.458 1.00 0.22 C ATOM 881 OG1 THR B 329 -18.842 -0.139 -3.343 1.00 0.22 O ATOM 882 CG2 THR B 329 -18.896 2.104 -2.459 1.00 0.22 C ATOM 0 H THR B 329 -16.630 0.551 -5.010 1.00 0.22 H new ATOM 0 HA THR B 329 -16.266 1.729 -2.320 1.00 0.21 H new ATOM 0 HB THR B 329 -18.188 0.335 -1.451 1.00 0.22 H new ATOM 0 HG1 THR B 329 -19.768 -0.264 -3.048 1.00 0.22 H new ATOM 0 HG21 THR B 329 -19.927 1.969 -2.132 1.00 0.22 H new ATOM 0 HG22 THR B 329 -18.387 2.787 -1.779 1.00 0.22 H new ATOM 0 HG23 THR B 329 -18.886 2.520 -3.466 1.00 0.22 H new ATOM 890 N LEU B 330 -15.536 -0.666 -1.544 1.00 0.19 N ATOM 891 CA LEU B 330 -14.769 -1.925 -1.329 1.00 0.20 C ATOM 892 C LEU B 330 -14.998 -2.434 0.096 1.00 0.19 C ATOM 893 O LEU B 330 -14.847 -1.707 1.057 1.00 0.18 O ATOM 894 CB LEU B 330 -13.278 -1.643 -1.539 1.00 0.20 C ATOM 895 CG LEU B 330 -12.460 -2.878 -1.152 1.00 0.21 C ATOM 896 CD1 LEU B 330 -12.630 -3.959 -2.222 1.00 0.28 C ATOM 897 CD2 LEU B 330 -10.980 -2.496 -1.046 1.00 0.22 C ATOM 0 H LEU B 330 -15.690 -0.101 -0.709 1.00 0.19 H new ATOM 0 HA LEU B 330 -15.105 -2.683 -2.036 1.00 0.20 H new ATOM 0 HB2 LEU B 330 -13.090 -1.382 -2.581 1.00 0.20 H new ATOM 0 HB3 LEU B 330 -12.971 -0.788 -0.936 1.00 0.20 H new ATOM 0 HG LEU B 330 -12.809 -3.258 -0.192 1.00 0.21 H new ATOM 0 HD11 LEU B 330 -12.048 -4.838 -1.947 1.00 0.28 H new ATOM 0 HD12 LEU B 330 -13.683 -4.231 -2.301 1.00 0.28 H new ATOM 0 HD13 LEU B 330 -12.281 -3.579 -3.182 1.00 0.28 H new ATOM 0 HD21 LEU B 330 -10.396 -3.374 -0.770 1.00 0.22 H new ATOM 0 HD22 LEU B 330 -10.633 -2.116 -2.007 1.00 0.22 H new ATOM 0 HD23 LEU B 330 -10.857 -1.725 -0.285 1.00 0.22 H new ATOM 909 N GLN B 331 -15.355 -3.681 0.241 1.00 0.20 N ATOM 910 CA GLN B 331 -15.584 -4.235 1.605 1.00 0.21 C ATOM 911 C GLN B 331 -14.261 -4.765 2.161 1.00 0.21 C ATOM 912 O GLN B 331 -13.694 -5.707 1.643 1.00 0.23 O ATOM 913 CB GLN B 331 -16.603 -5.376 1.526 1.00 0.23 C ATOM 914 CG GLN B 331 -16.854 -5.941 2.925 1.00 0.29 C ATOM 915 CD GLN B 331 -18.350 -5.888 3.238 1.00 0.43 C ATOM 916 OE1 GLN B 331 -19.154 -6.441 2.514 1.00 0.91 O ATOM 917 NE2 GLN B 331 -18.760 -5.243 4.296 1.00 0.28 N ATOM 0 H GLN B 331 -15.498 -4.339 -0.525 1.00 0.20 H new ATOM 0 HA GLN B 331 -15.968 -3.453 2.261 1.00 0.21 H new ATOM 0 HB2 GLN B 331 -17.537 -5.013 1.097 1.00 0.23 H new ATOM 0 HB3 GLN B 331 -16.233 -6.162 0.867 1.00 0.23 H new ATOM 0 HG2 GLN B 331 -16.496 -6.969 2.983 1.00 0.29 H new ATOM 0 HG3 GLN B 331 -16.297 -5.367 3.665 1.00 0.29 H new ATOM 0 HE21 GLN B 331 -18.085 -4.779 4.904 1.00 0.28 H new ATOM 0 HE22 GLN B 331 -19.755 -5.203 4.515 1.00 0.28 H new ATOM 926 N ILE B 332 -13.759 -4.169 3.207 1.00 0.21 N ATOM 927 CA ILE B 332 -12.470 -4.648 3.783 1.00 0.22 C ATOM 928 C ILE B 332 -12.740 -5.445 5.060 1.00 0.23 C ATOM 929 O ILE B 332 -13.159 -4.903 6.064 1.00 0.24 O ATOM 930 CB ILE B 332 -11.572 -3.451 4.106 1.00 0.21 C ATOM 931 CG1 ILE B 332 -11.492 -2.528 2.887 1.00 0.20 C ATOM 932 CG2 ILE B 332 -10.168 -3.946 4.455 1.00 0.24 C ATOM 933 CD1 ILE B 332 -10.796 -1.226 3.283 1.00 0.23 C ATOM 0 H ILE B 332 -14.183 -3.375 3.686 1.00 0.21 H new ATOM 0 HA ILE B 332 -11.970 -5.289 3.057 1.00 0.22 H new ATOM 0 HB ILE B 332 -11.989 -2.905 4.952 1.00 0.21 H new ATOM 0 HG12 ILE B 332 -10.943 -3.017 2.082 1.00 0.20 H new ATOM 0 HG13 ILE B 332 -12.493 -2.318 2.509 1.00 0.20 H new ATOM 0 HG21 ILE B 332 -9.528 -3.094 4.685 1.00 0.24 H new ATOM 0 HG22 ILE B 332 -10.220 -4.605 5.321 1.00 0.24 H new ATOM 0 HG23 ILE B 332 -9.754 -4.492 3.608 1.00 0.24 H new ATOM 0 HD11 ILE B 332 -10.738 -0.567 2.417 1.00 0.23 H new ATOM 0 HD12 ILE B 332 -11.363 -0.736 4.074 1.00 0.23 H new ATOM 0 HD13 ILE B 332 -9.790 -1.445 3.641 1.00 0.23 H new ATOM 945 N ARG B 333 -12.501 -6.728 5.033 1.00 0.25 N ATOM 946 CA ARG B 333 -12.740 -7.555 6.249 1.00 0.27 C ATOM 947 C ARG B 333 -11.650 -7.270 7.286 1.00 0.26 C ATOM 948 O ARG B 333 -10.525 -6.952 6.948 1.00 0.26 O ATOM 949 CB ARG B 333 -12.712 -9.037 5.866 1.00 0.32 C ATOM 950 CG ARG B 333 -14.010 -9.405 5.145 1.00 0.42 C ATOM 951 CD ARG B 333 -13.726 -9.643 3.661 1.00 0.70 C ATOM 952 NE ARG B 333 -14.414 -10.895 3.214 1.00 1.46 N ATOM 953 CZ ARG B 333 -14.292 -12.012 3.887 1.00 1.97 C ATOM 954 NH1 ARG B 333 -13.425 -12.117 4.860 1.00 2.17 N ATOM 955 NH2 ARG B 333 -15.008 -13.050 3.546 1.00 2.93 N ATOM 0 H ARG B 333 -12.151 -7.238 4.222 1.00 0.25 H new ATOM 0 HA ARG B 333 -13.713 -7.307 6.674 1.00 0.27 H new ATOM 0 HB2 ARG B 333 -11.856 -9.241 5.222 1.00 0.32 H new ATOM 0 HB3 ARG B 333 -12.593 -9.651 6.758 1.00 0.32 H new ATOM 0 HG2 ARG B 333 -14.443 -10.301 5.590 1.00 0.42 H new ATOM 0 HG3 ARG B 333 -14.741 -8.605 5.261 1.00 0.42 H new ATOM 0 HD2 ARG B 333 -14.075 -8.794 3.073 1.00 0.70 H new ATOM 0 HD3 ARG B 333 -12.652 -9.727 3.494 1.00 0.70 H new ATOM 0 HE ARG B 333 -14.988 -10.878 2.371 1.00 1.46 H new ATOM 0 HH11 ARG B 333 -12.833 -11.323 5.103 1.00 2.17 H new ATOM 0 HH12 ARG B 333 -13.341 -12.993 5.376 1.00 2.17 H new ATOM 0 HH21 ARG B 333 -15.656 -12.987 2.761 1.00 2.93 H new ATOM 0 HH22 ARG B 333 -14.919 -13.924 4.065 1.00 2.93 H new ATOM 969 N GLY B 334 -11.975 -7.376 8.546 1.00 0.29 N ATOM 970 CA GLY B 334 -10.960 -7.108 9.606 1.00 0.30 C ATOM 971 C GLY B 334 -10.898 -5.605 9.883 1.00 0.33 C ATOM 972 O GLY B 334 -10.832 -4.799 8.976 1.00 0.40 O ATOM 0 H GLY B 334 -12.900 -7.637 8.888 1.00 0.29 H new ATOM 0 HA2 GLY B 334 -11.219 -7.646 10.518 1.00 0.30 H new ATOM 0 HA3 GLY B 334 -9.982 -7.471 9.289 1.00 0.30 H new ATOM 976 N ARG B 335 -10.926 -5.222 11.131 1.00 0.30 N ATOM 977 CA ARG B 335 -10.874 -3.772 11.468 1.00 0.34 C ATOM 978 C ARG B 335 -9.432 -3.267 11.359 1.00 0.32 C ATOM 979 O ARG B 335 -9.178 -2.190 10.857 1.00 0.30 O ATOM 980 CB ARG B 335 -11.380 -3.564 12.897 1.00 0.39 C ATOM 981 CG ARG B 335 -11.206 -2.097 13.293 1.00 0.48 C ATOM 982 CD ARG B 335 -12.153 -1.762 14.448 1.00 0.93 C ATOM 983 NE ARG B 335 -11.676 -0.531 15.138 1.00 1.53 N ATOM 984 CZ ARG B 335 -12.464 0.110 15.957 1.00 2.11 C ATOM 985 NH1 ARG B 335 -13.672 -0.328 16.185 1.00 2.43 N ATOM 986 NH2 ARG B 335 -12.039 1.192 16.554 1.00 3.01 N ATOM 0 H ARG B 335 -10.983 -5.852 11.932 1.00 0.30 H new ATOM 0 HA ARG B 335 -11.503 -3.217 10.772 1.00 0.34 H new ATOM 0 HB2 ARG B 335 -12.430 -3.848 12.967 1.00 0.39 H new ATOM 0 HB3 ARG B 335 -10.830 -4.205 13.586 1.00 0.39 H new ATOM 0 HG2 ARG B 335 -10.174 -1.910 13.589 1.00 0.48 H new ATOM 0 HG3 ARG B 335 -11.415 -1.452 12.439 1.00 0.48 H new ATOM 0 HD2 ARG B 335 -13.165 -1.612 14.071 1.00 0.93 H new ATOM 0 HD3 ARG B 335 -12.195 -2.594 15.152 1.00 0.93 H new ATOM 0 HE ARG B 335 -10.730 -0.188 14.970 1.00 1.53 H new ATOM 0 HH11 ARG B 335 -14.003 -1.174 15.722 1.00 2.43 H new ATOM 0 HH12 ARG B 335 -14.285 0.176 16.826 1.00 2.43 H new ATOM 0 HH21 ARG B 335 -11.094 1.533 16.379 1.00 3.01 H new ATOM 0 HH22 ARG B 335 -12.653 1.695 17.195 1.00 3.01 H new ATOM 1000 N GLU B 336 -8.487 -4.033 11.831 1.00 0.35 N ATOM 1001 CA GLU B 336 -7.064 -3.592 11.760 1.00 0.37 C ATOM 1002 C GLU B 336 -6.674 -3.304 10.306 1.00 0.38 C ATOM 1003 O GLU B 336 -6.175 -2.243 9.989 1.00 0.39 O ATOM 1004 CB GLU B 336 -6.157 -4.689 12.326 1.00 0.44 C ATOM 1005 CG GLU B 336 -6.491 -6.029 11.664 1.00 1.33 C ATOM 1006 CD GLU B 336 -6.246 -7.165 12.659 1.00 1.73 C ATOM 1007 OE1 GLU B 336 -5.236 -7.121 13.342 1.00 2.28 O ATOM 1008 OE2 GLU B 336 -7.072 -8.060 12.720 1.00 2.22 O ATOM 0 H GLU B 336 -8.638 -4.945 12.263 1.00 0.35 H new ATOM 0 HA GLU B 336 -6.945 -2.682 12.347 1.00 0.37 H new ATOM 0 HB2 GLU B 336 -5.111 -4.436 12.150 1.00 0.44 H new ATOM 0 HB3 GLU B 336 -6.290 -4.763 13.405 1.00 0.44 H new ATOM 0 HG2 GLU B 336 -7.531 -6.036 11.337 1.00 1.33 H new ATOM 0 HG3 GLU B 336 -5.876 -6.171 10.775 1.00 1.33 H new ATOM 1015 N ARG B 337 -6.890 -4.240 9.418 1.00 0.43 N ATOM 1016 CA ARG B 337 -6.523 -4.012 7.989 1.00 0.49 C ATOM 1017 C ARG B 337 -7.327 -2.840 7.425 1.00 0.40 C ATOM 1018 O ARG B 337 -6.848 -2.084 6.603 1.00 0.38 O ATOM 1019 CB ARG B 337 -6.825 -5.272 7.176 1.00 0.64 C ATOM 1020 CG ARG B 337 -6.167 -6.479 7.841 1.00 0.78 C ATOM 1021 CD ARG B 337 -4.682 -6.191 8.062 1.00 1.08 C ATOM 1022 NE ARG B 337 -3.915 -7.466 7.995 1.00 1.38 N ATOM 1023 CZ ARG B 337 -2.613 -7.444 7.899 1.00 2.18 C ATOM 1024 NH1 ARG B 337 -1.978 -6.303 7.870 1.00 2.72 N ATOM 1025 NH2 ARG B 337 -1.943 -8.563 7.833 1.00 2.93 N ATOM 0 H ARG B 337 -7.304 -5.150 9.620 1.00 0.43 H new ATOM 0 HA ARG B 337 -5.459 -3.782 7.927 1.00 0.49 H new ATOM 0 HB2 ARG B 337 -7.902 -5.424 7.108 1.00 0.64 H new ATOM 0 HB3 ARG B 337 -6.454 -5.158 6.157 1.00 0.64 H new ATOM 0 HG2 ARG B 337 -6.653 -6.693 8.793 1.00 0.78 H new ATOM 0 HG3 ARG B 337 -6.288 -7.363 7.215 1.00 0.78 H new ATOM 0 HD2 ARG B 337 -4.319 -5.495 7.306 1.00 1.08 H new ATOM 0 HD3 ARG B 337 -4.533 -5.715 9.031 1.00 1.08 H new ATOM 0 HE ARG B 337 -4.408 -8.358 8.024 1.00 1.38 H new ATOM 0 HH11 ARG B 337 -2.499 -5.428 7.922 1.00 2.72 H new ATOM 0 HH12 ARG B 337 -0.961 -6.287 7.795 1.00 2.72 H new ATOM 0 HH21 ARG B 337 -2.437 -9.455 7.856 1.00 2.93 H new ATOM 0 HH22 ARG B 337 -0.926 -8.545 7.758 1.00 2.93 H new ATOM 1039 N PHE B 338 -8.548 -2.687 7.852 1.00 0.37 N ATOM 1040 CA PHE B 338 -9.381 -1.569 7.332 1.00 0.33 C ATOM 1041 C PHE B 338 -8.662 -0.238 7.554 1.00 0.27 C ATOM 1042 O PHE B 338 -8.429 0.510 6.628 1.00 0.26 O ATOM 1043 CB PHE B 338 -10.726 -1.552 8.062 1.00 0.34 C ATOM 1044 CG PHE B 338 -11.518 -0.338 7.633 1.00 0.32 C ATOM 1045 CD1 PHE B 338 -12.097 -0.294 6.357 1.00 0.32 C ATOM 1046 CD2 PHE B 338 -11.673 0.745 8.509 1.00 0.34 C ATOM 1047 CE1 PHE B 338 -12.832 0.830 5.958 1.00 0.33 C ATOM 1048 CE2 PHE B 338 -12.408 1.870 8.109 1.00 0.36 C ATOM 1049 CZ PHE B 338 -12.987 1.913 6.834 1.00 0.34 C ATOM 0 H PHE B 338 -9.005 -3.287 8.538 1.00 0.37 H new ATOM 0 HA PHE B 338 -9.547 -1.712 6.264 1.00 0.33 H new ATOM 0 HB2 PHE B 338 -11.284 -2.461 7.839 1.00 0.34 H new ATOM 0 HB3 PHE B 338 -10.566 -1.533 9.140 1.00 0.34 H new ATOM 0 HD1 PHE B 338 -11.976 -1.127 5.681 1.00 0.32 H new ATOM 0 HD2 PHE B 338 -11.226 0.713 9.492 1.00 0.34 H new ATOM 0 HE1 PHE B 338 -13.279 0.862 4.975 1.00 0.33 H new ATOM 0 HE2 PHE B 338 -12.528 2.704 8.784 1.00 0.36 H new ATOM 0 HZ PHE B 338 -13.552 2.780 6.526 1.00 0.34 H new ATOM 1059 N GLU B 339 -8.316 0.068 8.774 1.00 0.26 N ATOM 1060 CA GLU B 339 -7.622 1.359 9.052 1.00 0.26 C ATOM 1061 C GLU B 339 -6.400 1.514 8.140 1.00 0.23 C ATOM 1062 O GLU B 339 -6.066 2.605 7.723 1.00 0.23 O ATOM 1063 CB GLU B 339 -7.165 1.385 10.511 1.00 0.32 C ATOM 1064 CG GLU B 339 -8.371 1.611 11.425 1.00 0.35 C ATOM 1065 CD GLU B 339 -7.887 1.804 12.862 1.00 1.18 C ATOM 1066 OE1 GLU B 339 -7.381 0.850 13.429 1.00 1.88 O ATOM 1067 OE2 GLU B 339 -8.030 2.904 13.373 1.00 1.98 O ATOM 0 H GLU B 339 -8.483 -0.519 9.591 1.00 0.26 H new ATOM 0 HA GLU B 339 -8.315 2.179 8.862 1.00 0.26 H new ATOM 0 HB2 GLU B 339 -6.675 0.445 10.765 1.00 0.32 H new ATOM 0 HB3 GLU B 339 -6.431 2.177 10.658 1.00 0.32 H new ATOM 0 HG2 GLU B 339 -8.931 2.487 11.097 1.00 0.35 H new ATOM 0 HG3 GLU B 339 -9.049 0.759 11.369 1.00 0.35 H new ATOM 1074 N MET B 340 -5.723 0.439 7.837 1.00 0.22 N ATOM 1075 CA MET B 340 -4.519 0.541 6.964 1.00 0.21 C ATOM 1076 C MET B 340 -4.927 1.045 5.576 1.00 0.18 C ATOM 1077 O MET B 340 -4.327 1.951 5.035 1.00 0.18 O ATOM 1078 CB MET B 340 -3.857 -0.837 6.841 1.00 0.23 C ATOM 1079 CG MET B 340 -2.479 -0.692 6.187 1.00 0.27 C ATOM 1080 SD MET B 340 -1.608 -2.279 6.253 1.00 0.29 S ATOM 1081 CE MET B 340 -2.379 -3.024 4.794 1.00 0.32 C ATOM 0 H MET B 340 -5.951 -0.503 8.155 1.00 0.22 H new ATOM 0 HA MET B 340 -3.812 1.243 7.405 1.00 0.21 H new ATOM 0 HB2 MET B 340 -3.756 -1.292 7.826 1.00 0.23 H new ATOM 0 HB3 MET B 340 -4.484 -1.501 6.246 1.00 0.23 H new ATOM 0 HG2 MET B 340 -2.588 -0.368 5.152 1.00 0.27 H new ATOM 0 HG3 MET B 340 -1.899 0.075 6.701 1.00 0.27 H new ATOM 0 HE1 MET B 340 -1.917 -3.990 4.592 1.00 0.32 H new ATOM 0 HE2 MET B 340 -3.445 -3.162 4.976 1.00 0.32 H new ATOM 0 HE3 MET B 340 -2.240 -2.369 3.934 1.00 0.32 H new ATOM 1091 N PHE B 341 -5.942 0.465 4.996 1.00 0.16 N ATOM 1092 CA PHE B 341 -6.385 0.910 3.643 1.00 0.14 C ATOM 1093 C PHE B 341 -6.848 2.372 3.701 1.00 0.15 C ATOM 1094 O PHE B 341 -6.467 3.185 2.881 1.00 0.15 O ATOM 1095 CB PHE B 341 -7.545 0.028 3.174 1.00 0.14 C ATOM 1096 CG PHE B 341 -7.008 -1.294 2.681 1.00 0.15 C ATOM 1097 CD1 PHE B 341 -6.340 -1.363 1.451 1.00 0.18 C ATOM 1098 CD2 PHE B 341 -7.175 -2.451 3.454 1.00 0.16 C ATOM 1099 CE1 PHE B 341 -5.842 -2.589 0.993 1.00 0.18 C ATOM 1100 CE2 PHE B 341 -6.675 -3.679 2.994 1.00 0.18 C ATOM 1101 CZ PHE B 341 -6.008 -3.747 1.765 1.00 0.17 C ATOM 0 H PHE B 341 -6.484 -0.298 5.400 1.00 0.16 H new ATOM 0 HA PHE B 341 -5.552 0.825 2.945 1.00 0.14 H new ATOM 0 HB2 PHE B 341 -8.245 -0.135 3.993 1.00 0.14 H new ATOM 0 HB3 PHE B 341 -8.096 0.528 2.378 1.00 0.14 H new ATOM 0 HD1 PHE B 341 -6.209 -0.471 0.856 1.00 0.18 H new ATOM 0 HD2 PHE B 341 -7.688 -2.398 4.403 1.00 0.16 H new ATOM 0 HE1 PHE B 341 -5.329 -2.642 0.044 1.00 0.18 H new ATOM 0 HE2 PHE B 341 -6.805 -4.572 3.588 1.00 0.18 H new ATOM 0 HZ PHE B 341 -5.621 -4.692 1.412 1.00 0.17 H new ATOM 1111 N ARG B 342 -7.669 2.709 4.657 1.00 0.17 N ATOM 1112 CA ARG B 342 -8.166 4.112 4.765 1.00 0.19 C ATOM 1113 C ARG B 342 -6.994 5.095 4.684 1.00 0.18 C ATOM 1114 O ARG B 342 -7.079 6.123 4.041 1.00 0.19 O ATOM 1115 CB ARG B 342 -8.887 4.290 6.103 1.00 0.23 C ATOM 1116 CG ARG B 342 -9.632 5.626 6.105 1.00 0.32 C ATOM 1117 CD ARG B 342 -9.879 6.068 7.547 1.00 0.61 C ATOM 1118 NE ARG B 342 -10.060 7.545 7.587 1.00 1.13 N ATOM 1119 CZ ARG B 342 -10.576 8.111 8.643 1.00 1.74 C ATOM 1120 NH1 ARG B 342 -10.919 7.388 9.675 1.00 2.34 N ATOM 1121 NH2 ARG B 342 -10.750 9.404 8.665 1.00 2.42 N ATOM 0 H ARG B 342 -8.019 2.071 5.372 1.00 0.17 H new ATOM 0 HA ARG B 342 -8.854 4.312 3.943 1.00 0.19 H new ATOM 0 HB2 ARG B 342 -9.587 3.470 6.263 1.00 0.23 H new ATOM 0 HB3 ARG B 342 -8.169 4.260 6.922 1.00 0.23 H new ATOM 0 HG2 ARG B 342 -9.049 6.381 5.577 1.00 0.32 H new ATOM 0 HG3 ARG B 342 -10.580 5.527 5.576 1.00 0.32 H new ATOM 0 HD2 ARG B 342 -10.764 5.571 7.945 1.00 0.61 H new ATOM 0 HD3 ARG B 342 -9.039 5.776 8.177 1.00 0.61 H new ATOM 0 HE ARG B 342 -9.780 8.115 6.788 1.00 1.13 H new ATOM 0 HH11 ARG B 342 -10.784 6.377 9.657 1.00 2.34 H new ATOM 0 HH12 ARG B 342 -11.322 7.834 10.499 1.00 2.34 H new ATOM 0 HH21 ARG B 342 -10.483 9.968 7.858 1.00 2.42 H new ATOM 0 HH22 ARG B 342 -11.153 9.850 9.489 1.00 2.42 H new ATOM 1135 N GLU B 343 -5.904 4.798 5.336 1.00 0.19 N ATOM 1136 CA GLU B 343 -4.739 5.728 5.297 1.00 0.21 C ATOM 1137 C GLU B 343 -4.278 5.922 3.852 1.00 0.16 C ATOM 1138 O GLU B 343 -4.073 7.032 3.400 1.00 0.15 O ATOM 1139 CB GLU B 343 -3.588 5.147 6.116 1.00 0.25 C ATOM 1140 CG GLU B 343 -2.395 6.103 6.053 1.00 0.53 C ATOM 1141 CD GLU B 343 -2.495 7.124 7.188 1.00 1.47 C ATOM 1142 OE1 GLU B 343 -2.422 6.715 8.334 1.00 2.11 O ATOM 1143 OE2 GLU B 343 -2.642 8.297 6.889 1.00 2.35 O ATOM 0 H GLU B 343 -5.769 3.954 5.893 1.00 0.19 H new ATOM 0 HA GLU B 343 -5.039 6.689 5.716 1.00 0.21 H new ATOM 0 HB2 GLU B 343 -3.899 5.002 7.151 1.00 0.25 H new ATOM 0 HB3 GLU B 343 -3.306 4.168 5.727 1.00 0.25 H new ATOM 0 HG2 GLU B 343 -1.463 5.544 6.135 1.00 0.53 H new ATOM 0 HG3 GLU B 343 -2.376 6.615 5.091 1.00 0.53 H new ATOM 1150 N LEU B 344 -4.105 4.853 3.124 1.00 0.15 N ATOM 1151 CA LEU B 344 -3.648 4.977 1.710 1.00 0.13 C ATOM 1152 C LEU B 344 -4.678 5.764 0.898 1.00 0.13 C ATOM 1153 O LEU B 344 -4.341 6.456 -0.042 1.00 0.14 O ATOM 1154 CB LEU B 344 -3.487 3.581 1.105 1.00 0.15 C ATOM 1155 CG LEU B 344 -2.284 2.883 1.738 1.00 0.14 C ATOM 1156 CD1 LEU B 344 -2.401 1.371 1.519 1.00 0.17 C ATOM 1157 CD2 LEU B 344 -0.999 3.394 1.080 1.00 0.18 C ATOM 0 H LEU B 344 -4.260 3.898 3.447 1.00 0.15 H new ATOM 0 HA LEU B 344 -2.693 5.502 1.686 1.00 0.13 H new ATOM 0 HB2 LEU B 344 -4.390 2.995 1.273 1.00 0.15 H new ATOM 0 HB3 LEU B 344 -3.351 3.655 0.026 1.00 0.15 H new ATOM 0 HG LEU B 344 -2.257 3.096 2.807 1.00 0.14 H new ATOM 0 HD11 LEU B 344 -1.544 0.871 1.970 1.00 0.17 H new ATOM 0 HD12 LEU B 344 -3.318 1.006 1.981 1.00 0.17 H new ATOM 0 HD13 LEU B 344 -2.424 1.159 0.450 1.00 0.17 H new ATOM 0 HD21 LEU B 344 -0.138 2.898 1.529 1.00 0.18 H new ATOM 0 HD22 LEU B 344 -1.026 3.177 0.012 1.00 0.18 H new ATOM 0 HD23 LEU B 344 -0.917 4.470 1.230 1.00 0.18 H new ATOM 1169 N ASN B 345 -5.929 5.661 1.245 1.00 0.16 N ATOM 1170 CA ASN B 345 -6.972 6.401 0.484 1.00 0.19 C ATOM 1171 C ASN B 345 -6.659 7.900 0.506 1.00 0.17 C ATOM 1172 O ASN B 345 -6.571 8.541 -0.522 1.00 0.17 O ATOM 1173 CB ASN B 345 -8.337 6.151 1.127 1.00 0.26 C ATOM 1174 CG ASN B 345 -9.433 6.782 0.269 1.00 0.30 C ATOM 1175 OD1 ASN B 345 -10.676 6.447 0.477 1.00 1.09 O flip ATOM 1176 ND2 ASN B 345 -9.156 7.586 -0.599 1.00 0.68 N flip ATOM 0 H ASN B 345 -6.274 5.097 2.022 1.00 0.16 H new ATOM 0 HA ASN B 345 -6.986 6.054 -0.549 1.00 0.19 H new ATOM 0 HB2 ASN B 345 -8.512 5.080 1.228 1.00 0.26 H new ATOM 0 HB3 ASN B 345 -8.360 6.573 2.132 1.00 0.26 H new ATOM 0 HD21 ASN B 345 -8.183 7.847 -0.761 1.00 0.68 H new ATOM 0 HD22 ASN B 345 -9.896 8.000 -1.166 1.00 0.68 H new ATOM 1183 N GLU B 346 -6.498 8.463 1.671 1.00 0.17 N ATOM 1184 CA GLU B 346 -6.199 9.920 1.762 1.00 0.16 C ATOM 1185 C GLU B 346 -4.867 10.227 1.070 1.00 0.14 C ATOM 1186 O GLU B 346 -4.653 11.317 0.585 1.00 0.15 O ATOM 1187 CB GLU B 346 -6.118 10.331 3.235 1.00 0.20 C ATOM 1188 CG GLU B 346 -6.174 11.854 3.345 1.00 0.23 C ATOM 1189 CD GLU B 346 -7.602 12.335 3.079 1.00 0.89 C ATOM 1190 OE1 GLU B 346 -8.394 12.319 4.008 1.00 1.66 O ATOM 1191 OE2 GLU B 346 -7.880 12.713 1.953 1.00 1.55 O ATOM 0 H GLU B 346 -6.561 7.977 2.565 1.00 0.17 H new ATOM 0 HA GLU B 346 -6.993 10.480 1.268 1.00 0.16 H new ATOM 0 HB2 GLU B 346 -6.941 9.885 3.793 1.00 0.20 H new ATOM 0 HB3 GLU B 346 -5.194 9.958 3.677 1.00 0.20 H new ATOM 0 HG2 GLU B 346 -5.852 12.169 4.338 1.00 0.23 H new ATOM 0 HG3 GLU B 346 -5.488 12.306 2.629 1.00 0.23 H new ATOM 1198 N ALA B 347 -3.968 9.281 1.028 1.00 0.13 N ATOM 1199 CA ALA B 347 -2.649 9.530 0.370 1.00 0.14 C ATOM 1200 C ALA B 347 -2.850 9.855 -1.115 1.00 0.15 C ATOM 1201 O ALA B 347 -2.445 10.897 -1.590 1.00 0.17 O ATOM 1202 CB ALA B 347 -1.770 8.287 0.498 1.00 0.15 C ATOM 0 H ALA B 347 -4.088 8.347 1.420 1.00 0.13 H new ATOM 0 HA ALA B 347 -2.167 10.376 0.860 1.00 0.14 H new ATOM 0 HB1 ALA B 347 -0.809 8.470 0.018 1.00 0.15 H new ATOM 0 HB2 ALA B 347 -1.612 8.060 1.552 1.00 0.15 H new ATOM 0 HB3 ALA B 347 -2.262 7.442 0.015 1.00 0.15 H new ATOM 1208 N LEU B 348 -3.459 8.965 -1.852 1.00 0.16 N ATOM 1209 CA LEU B 348 -3.669 9.219 -3.308 1.00 0.20 C ATOM 1210 C LEU B 348 -4.531 10.470 -3.499 1.00 0.20 C ATOM 1211 O LEU B 348 -4.199 11.352 -4.268 1.00 0.22 O ATOM 1212 CB LEU B 348 -4.376 8.016 -3.942 1.00 0.23 C ATOM 1213 CG LEU B 348 -3.372 6.883 -4.174 1.00 0.25 C ATOM 1214 CD1 LEU B 348 -2.169 7.410 -4.962 1.00 0.29 C ATOM 1215 CD2 LEU B 348 -2.898 6.339 -2.825 1.00 0.21 C ATOM 0 H LEU B 348 -3.820 8.074 -1.510 1.00 0.16 H new ATOM 0 HA LEU B 348 -2.701 9.370 -3.786 1.00 0.20 H new ATOM 0 HB2 LEU B 348 -5.181 7.673 -3.292 1.00 0.23 H new ATOM 0 HB3 LEU B 348 -4.832 8.308 -4.888 1.00 0.23 H new ATOM 0 HG LEU B 348 -3.853 6.086 -4.742 1.00 0.25 H new ATOM 0 HD11 LEU B 348 -1.458 6.600 -5.125 1.00 0.29 H new ATOM 0 HD12 LEU B 348 -2.505 7.796 -5.924 1.00 0.29 H new ATOM 0 HD13 LEU B 348 -1.687 8.209 -4.399 1.00 0.29 H new ATOM 0 HD21 LEU B 348 -2.183 5.532 -2.989 1.00 0.21 H new ATOM 0 HD22 LEU B 348 -2.420 7.138 -2.258 1.00 0.21 H new ATOM 0 HD23 LEU B 348 -3.753 5.958 -2.266 1.00 0.21 H new ATOM 1227 N GLU B 349 -5.638 10.556 -2.814 1.00 0.19 N ATOM 1228 CA GLU B 349 -6.520 11.748 -2.967 1.00 0.20 C ATOM 1229 C GLU B 349 -5.721 13.020 -2.671 1.00 0.19 C ATOM 1230 O GLU B 349 -5.958 14.062 -3.251 1.00 0.21 O ATOM 1231 CB GLU B 349 -7.692 11.645 -1.987 1.00 0.22 C ATOM 1232 CG GLU B 349 -8.714 10.631 -2.509 1.00 0.27 C ATOM 1233 CD GLU B 349 -9.972 10.682 -1.640 1.00 1.21 C ATOM 1234 OE1 GLU B 349 -10.366 11.775 -1.269 1.00 1.90 O ATOM 1235 OE2 GLU B 349 -10.521 9.629 -1.361 1.00 1.95 O ATOM 0 H GLU B 349 -5.970 9.852 -2.155 1.00 0.19 H new ATOM 0 HA GLU B 349 -6.900 11.787 -3.988 1.00 0.20 H new ATOM 0 HB2 GLU B 349 -7.331 11.340 -1.005 1.00 0.22 H new ATOM 0 HB3 GLU B 349 -8.163 12.620 -1.865 1.00 0.22 H new ATOM 0 HG2 GLU B 349 -8.966 10.853 -3.546 1.00 0.27 H new ATOM 0 HG3 GLU B 349 -8.288 9.628 -2.493 1.00 0.27 H new ATOM 1242 N LEU B 350 -4.776 12.944 -1.776 1.00 0.20 N ATOM 1243 CA LEU B 350 -3.962 14.148 -1.445 1.00 0.23 C ATOM 1244 C LEU B 350 -3.156 14.569 -2.673 1.00 0.24 C ATOM 1245 O LEU B 350 -3.078 15.735 -3.010 1.00 0.29 O ATOM 1246 CB LEU B 350 -3.007 13.819 -0.293 1.00 0.26 C ATOM 1247 CG LEU B 350 -2.525 15.115 0.360 1.00 0.31 C ATOM 1248 CD1 LEU B 350 -1.648 14.789 1.571 1.00 0.45 C ATOM 1249 CD2 LEU B 350 -1.714 15.927 -0.651 1.00 0.40 C ATOM 0 H LEU B 350 -4.532 12.100 -1.259 1.00 0.20 H new ATOM 0 HA LEU B 350 -4.622 14.963 -1.146 1.00 0.23 H new ATOM 0 HB2 LEU B 350 -3.512 13.194 0.444 1.00 0.26 H new ATOM 0 HB3 LEU B 350 -2.156 13.249 -0.665 1.00 0.26 H new ATOM 0 HG LEU B 350 -3.389 15.695 0.685 1.00 0.31 H new ATOM 0 HD11 LEU B 350 -1.307 15.715 2.033 1.00 0.45 H new ATOM 0 HD12 LEU B 350 -2.226 14.214 2.295 1.00 0.45 H new ATOM 0 HD13 LEU B 350 -0.786 14.205 1.249 1.00 0.45 H new ATOM 0 HD21 LEU B 350 -1.371 16.850 -0.185 1.00 0.40 H new ATOM 0 HD22 LEU B 350 -0.853 15.344 -0.979 1.00 0.40 H new ATOM 0 HD23 LEU B 350 -2.339 16.166 -1.511 1.00 0.40 H new ATOM 1261 N LYS B 351 -2.556 13.627 -3.346 1.00 0.23 N ATOM 1262 CA LYS B 351 -1.755 13.960 -4.555 1.00 0.26 C ATOM 1263 C LYS B 351 -2.659 14.598 -5.610 1.00 0.28 C ATOM 1264 O LYS B 351 -2.316 15.592 -6.219 1.00 0.35 O ATOM 1265 CB LYS B 351 -1.139 12.679 -5.118 1.00 0.26 C ATOM 1266 CG LYS B 351 -0.024 13.036 -6.099 1.00 0.29 C ATOM 1267 CD LYS B 351 0.533 11.754 -6.717 1.00 0.30 C ATOM 1268 CE LYS B 351 2.052 11.877 -6.852 1.00 0.34 C ATOM 1269 NZ LYS B 351 2.696 11.459 -5.575 1.00 1.38 N ATOM 0 H LYS B 351 -2.587 12.636 -3.108 1.00 0.23 H new ATOM 0 HA LYS B 351 -0.964 14.661 -4.288 1.00 0.26 H new ATOM 0 HB2 LYS B 351 -0.742 12.067 -4.308 1.00 0.26 H new ATOM 0 HB3 LYS B 351 -1.903 12.086 -5.620 1.00 0.26 H new ATOM 0 HG2 LYS B 351 -0.407 13.693 -6.880 1.00 0.29 H new ATOM 0 HG3 LYS B 351 0.768 13.580 -5.585 1.00 0.29 H new ATOM 0 HD2 LYS B 351 0.280 10.896 -6.094 1.00 0.30 H new ATOM 0 HD3 LYS B 351 0.082 11.582 -7.694 1.00 0.30 H new ATOM 0 HE2 LYS B 351 2.407 11.254 -7.673 1.00 0.34 H new ATOM 0 HE3 LYS B 351 2.325 12.905 -7.091 1.00 0.34 H new ATOM 0 HZ1 LYS B 351 3.729 11.542 -5.664 1.00 1.38 H new ATOM 0 HZ2 LYS B 351 2.365 12.071 -4.802 1.00 1.38 H new ATOM 0 HZ3 LYS B 351 2.444 10.472 -5.366 1.00 1.38 H new ATOM 1283 N ASP B 352 -3.813 14.032 -5.835 1.00 0.29 N ATOM 1284 CA ASP B 352 -4.740 14.605 -6.851 1.00 0.36 C ATOM 1285 C ASP B 352 -5.011 16.077 -6.527 1.00 0.40 C ATOM 1286 O ASP B 352 -5.129 16.904 -7.410 1.00 0.47 O ATOM 1287 CB ASP B 352 -6.058 13.831 -6.831 1.00 0.40 C ATOM 1288 CG ASP B 352 -5.874 12.480 -7.529 1.00 0.43 C ATOM 1289 OD1 ASP B 352 -4.760 11.979 -7.527 1.00 1.08 O ATOM 1290 OD2 ASP B 352 -6.850 11.968 -8.054 1.00 1.16 O ATOM 0 H ASP B 352 -4.154 13.197 -5.359 1.00 0.29 H new ATOM 0 HA ASP B 352 -4.286 14.528 -7.839 1.00 0.36 H new ATOM 0 HB2 ASP B 352 -6.386 13.678 -5.803 1.00 0.40 H new ATOM 0 HB3 ASP B 352 -6.837 14.407 -7.331 1.00 0.40 H new ATOM 1295 N ALA B 353 -5.115 16.412 -5.269 1.00 0.38 N ATOM 1296 CA ALA B 353 -5.384 17.830 -4.895 1.00 0.46 C ATOM 1297 C ALA B 353 -4.184 18.697 -5.279 1.00 0.51 C ATOM 1298 O ALA B 353 -4.322 19.862 -5.600 1.00 0.61 O ATOM 1299 CB ALA B 353 -5.616 17.926 -3.385 1.00 0.46 C ATOM 0 H ALA B 353 -5.025 15.766 -4.485 1.00 0.38 H new ATOM 0 HA ALA B 353 -6.271 18.180 -5.423 1.00 0.46 H new ATOM 0 HB1 ALA B 353 -5.813 18.963 -3.112 1.00 0.46 H new ATOM 0 HB2 ALA B 353 -6.471 17.310 -3.108 1.00 0.46 H new ATOM 0 HB3 ALA B 353 -4.729 17.574 -2.858 1.00 0.46 H new ATOM 1305 N GLN B 354 -3.004 18.142 -5.247 1.00 0.47 N ATOM 1306 CA GLN B 354 -1.799 18.938 -5.610 1.00 0.55 C ATOM 1307 C GLN B 354 -1.647 18.972 -7.134 1.00 0.60 C ATOM 1308 O GLN B 354 -0.784 19.644 -7.664 1.00 0.75 O ATOM 1309 CB GLN B 354 -0.555 18.297 -4.988 1.00 0.52 C ATOM 1310 CG GLN B 354 0.299 19.378 -4.321 1.00 1.14 C ATOM 1311 CD GLN B 354 1.287 18.727 -3.349 1.00 1.08 C ATOM 1312 OE1 GLN B 354 1.618 17.475 -3.514 1.00 1.45 O flip ATOM 1313 NE2 GLN B 354 1.763 19.365 -2.432 1.00 0.72 N flip ATOM 0 H GLN B 354 -2.823 17.173 -4.985 1.00 0.47 H new ATOM 0 HA GLN B 354 -1.911 19.955 -5.233 1.00 0.55 H new ATOM 0 HB2 GLN B 354 -0.848 17.546 -4.254 1.00 0.52 H new ATOM 0 HB3 GLN B 354 0.024 17.783 -5.755 1.00 0.52 H new ATOM 0 HG2 GLN B 354 0.839 19.947 -5.078 1.00 1.14 H new ATOM 0 HG3 GLN B 354 -0.340 20.083 -3.788 1.00 1.14 H new ATOM 0 HE21 GLN B 354 1.504 20.343 -2.303 1.00 0.72 H new ATOM 0 HE22 GLN B 354 2.421 18.923 -1.791 1.00 0.72 H new ATOM 1519 N GLU C 326 14.546 -8.270 -12.468 1.00 0.49 N ATOM 1520 CA GLU C 326 15.468 -7.144 -12.139 1.00 0.44 C ATOM 1521 C GLU C 326 15.603 -7.017 -10.620 1.00 0.38 C ATOM 1522 O GLU C 326 15.015 -7.767 -9.868 1.00 0.37 O ATOM 1523 CB GLU C 326 14.903 -5.837 -12.704 1.00 0.47 C ATOM 1524 CG GLU C 326 15.090 -5.805 -14.220 1.00 0.53 C ATOM 1525 CD GLU C 326 15.603 -4.426 -14.641 1.00 1.38 C ATOM 1526 OE1 GLU C 326 16.667 -4.044 -14.183 1.00 2.13 O ATOM 1527 OE2 GLU C 326 14.919 -3.772 -15.412 1.00 2.17 O ATOM 0 HA GLU C 326 16.446 -7.342 -12.578 1.00 0.44 H new ATOM 0 HB2 GLU C 326 13.845 -5.751 -12.457 1.00 0.47 H new ATOM 0 HB3 GLU C 326 15.407 -4.985 -12.248 1.00 0.47 H new ATOM 0 HG2 GLU C 326 15.796 -6.577 -14.527 1.00 0.53 H new ATOM 0 HG3 GLU C 326 14.145 -6.021 -14.718 1.00 0.53 H new ATOM 1534 N TYR C 327 16.374 -6.066 -10.167 1.00 0.36 N ATOM 1535 CA TYR C 327 16.550 -5.880 -8.699 1.00 0.32 C ATOM 1536 C TYR C 327 16.794 -4.400 -8.397 1.00 0.29 C ATOM 1537 O TYR C 327 17.820 -3.847 -8.741 1.00 0.31 O ATOM 1538 CB TYR C 327 17.747 -6.700 -8.217 1.00 0.35 C ATOM 1539 CG TYR C 327 17.328 -8.137 -8.023 1.00 0.37 C ATOM 1540 CD1 TYR C 327 16.762 -8.538 -6.806 1.00 0.36 C ATOM 1541 CD2 TYR C 327 17.502 -9.068 -9.056 1.00 0.42 C ATOM 1542 CE1 TYR C 327 16.370 -9.870 -6.620 1.00 0.40 C ATOM 1543 CE2 TYR C 327 17.109 -10.400 -8.871 1.00 0.45 C ATOM 1544 CZ TYR C 327 16.542 -10.801 -7.653 1.00 0.44 C ATOM 1545 OH TYR C 327 16.154 -12.113 -7.472 1.00 0.48 O ATOM 0 H TYR C 327 16.890 -5.409 -10.752 1.00 0.36 H new ATOM 0 HA TYR C 327 15.650 -6.214 -8.183 1.00 0.32 H new ATOM 0 HB2 TYR C 327 18.558 -6.641 -8.943 1.00 0.35 H new ATOM 0 HB3 TYR C 327 18.128 -6.292 -7.281 1.00 0.35 H new ATOM 0 HD1 TYR C 327 16.628 -7.820 -6.011 1.00 0.36 H new ATOM 0 HD2 TYR C 327 17.939 -8.759 -9.994 1.00 0.42 H new ATOM 0 HE1 TYR C 327 15.935 -10.179 -5.681 1.00 0.40 H new ATOM 0 HE2 TYR C 327 17.243 -11.118 -9.667 1.00 0.45 H new ATOM 0 HH TYR C 327 16.342 -12.625 -8.286 1.00 0.48 H new ATOM 1555 N PHE C 328 15.858 -3.752 -7.757 1.00 0.26 N ATOM 1556 CA PHE C 328 16.040 -2.306 -7.436 1.00 0.24 C ATOM 1557 C PHE C 328 16.149 -2.127 -5.920 1.00 0.23 C ATOM 1558 O PHE C 328 16.261 -3.082 -5.177 1.00 0.24 O ATOM 1559 CB PHE C 328 14.837 -1.511 -7.951 1.00 0.23 C ATOM 1560 CG PHE C 328 14.805 -1.565 -9.459 1.00 0.25 C ATOM 1561 CD1 PHE C 328 15.643 -0.727 -10.207 1.00 0.29 C ATOM 1562 CD2 PHE C 328 13.940 -2.455 -10.112 1.00 0.26 C ATOM 1563 CE1 PHE C 328 15.614 -0.777 -11.608 1.00 0.33 C ATOM 1564 CE2 PHE C 328 13.913 -2.505 -11.513 1.00 0.29 C ATOM 1565 CZ PHE C 328 14.750 -1.668 -12.260 1.00 0.32 C ATOM 0 H PHE C 328 14.977 -4.160 -7.443 1.00 0.26 H new ATOM 0 HA PHE C 328 16.950 -1.944 -7.914 1.00 0.24 H new ATOM 0 HB2 PHE C 328 13.914 -1.922 -7.542 1.00 0.23 H new ATOM 0 HB3 PHE C 328 14.901 -0.476 -7.615 1.00 0.23 H new ATOM 0 HD1 PHE C 328 16.311 -0.043 -9.705 1.00 0.29 H new ATOM 0 HD2 PHE C 328 13.295 -3.102 -9.536 1.00 0.26 H new ATOM 0 HE1 PHE C 328 16.257 -0.129 -12.185 1.00 0.33 H new ATOM 0 HE2 PHE C 328 13.246 -3.190 -12.016 1.00 0.29 H new ATOM 0 HZ PHE C 328 14.730 -1.709 -13.339 1.00 0.32 H new ATOM 1575 N THR C 329 16.114 -0.909 -5.460 1.00 0.22 N ATOM 1576 CA THR C 329 16.211 -0.654 -3.994 1.00 0.21 C ATOM 1577 C THR C 329 15.505 0.666 -3.675 1.00 0.20 C ATOM 1578 O THR C 329 15.261 1.470 -4.553 1.00 0.22 O ATOM 1579 CB THR C 329 17.683 -0.573 -3.583 1.00 0.21 C ATOM 1580 OG1 THR C 329 18.404 0.181 -4.549 1.00 0.23 O ATOM 1581 CG2 THR C 329 18.267 -1.985 -3.499 1.00 0.22 C ATOM 0 H THR C 329 16.022 -0.074 -6.038 1.00 0.22 H new ATOM 0 HA THR C 329 15.736 -1.465 -3.442 1.00 0.21 H new ATOM 0 HB THR C 329 17.763 -0.088 -2.610 1.00 0.21 H new ATOM 0 HG1 THR C 329 19.346 0.235 -4.285 1.00 0.23 H new ATOM 0 HG21 THR C 329 19.315 -1.928 -3.206 1.00 0.22 H new ATOM 0 HG22 THR C 329 17.714 -2.564 -2.759 1.00 0.22 H new ATOM 0 HG23 THR C 329 18.188 -2.470 -4.472 1.00 0.22 H new ATOM 1589 N LEU C 330 15.159 0.896 -2.438 1.00 0.19 N ATOM 1590 CA LEU C 330 14.451 2.163 -2.103 1.00 0.19 C ATOM 1591 C LEU C 330 14.769 2.595 -0.670 1.00 0.19 C ATOM 1592 O LEU C 330 14.648 1.829 0.265 1.00 0.18 O ATOM 1593 CB LEU C 330 12.945 1.939 -2.231 1.00 0.19 C ATOM 1594 CG LEU C 330 12.206 3.236 -1.909 1.00 0.20 C ATOM 1595 CD1 LEU C 330 12.266 4.168 -3.120 1.00 0.28 C ATOM 1596 CD2 LEU C 330 10.746 2.920 -1.576 1.00 0.22 C ATOM 0 H LEU C 330 15.334 0.269 -1.653 1.00 0.19 H new ATOM 0 HA LEU C 330 14.781 2.943 -2.788 1.00 0.19 H new ATOM 0 HB2 LEU C 330 12.700 1.610 -3.241 1.00 0.19 H new ATOM 0 HB3 LEU C 330 12.626 1.148 -1.552 1.00 0.19 H new ATOM 0 HG LEU C 330 12.675 3.722 -1.054 1.00 0.20 H new ATOM 0 HD11 LEU C 330 11.739 5.095 -2.892 1.00 0.28 H new ATOM 0 HD12 LEU C 330 13.306 4.391 -3.356 1.00 0.28 H new ATOM 0 HD13 LEU C 330 11.795 3.684 -3.976 1.00 0.28 H new ATOM 0 HD21 LEU C 330 10.217 3.845 -1.346 1.00 0.22 H new ATOM 0 HD22 LEU C 330 10.275 2.435 -2.431 1.00 0.22 H new ATOM 0 HD23 LEU C 330 10.705 2.255 -0.714 1.00 0.22 H new ATOM 1608 N GLN C 331 15.152 3.830 -0.492 1.00 0.20 N ATOM 1609 CA GLN C 331 15.455 4.330 0.878 1.00 0.20 C ATOM 1610 C GLN C 331 14.171 4.887 1.499 1.00 0.21 C ATOM 1611 O GLN C 331 13.608 5.850 1.017 1.00 0.23 O ATOM 1612 CB GLN C 331 16.504 5.440 0.792 1.00 0.23 C ATOM 1613 CG GLN C 331 17.031 5.752 2.192 1.00 0.27 C ATOM 1614 CD GLN C 331 18.461 5.225 2.325 1.00 0.75 C ATOM 1615 OE1 GLN C 331 19.245 5.325 1.403 1.00 1.48 O ATOM 1616 NE2 GLN C 331 18.837 4.664 3.442 1.00 0.72 N ATOM 0 H GLN C 331 15.268 4.515 -1.238 1.00 0.20 H new ATOM 0 HA GLN C 331 15.839 3.517 1.494 1.00 0.20 H new ATOM 0 HB2 GLN C 331 17.324 5.131 0.144 1.00 0.23 H new ATOM 0 HB3 GLN C 331 16.067 6.335 0.349 1.00 0.23 H new ATOM 0 HG2 GLN C 331 17.010 6.827 2.369 1.00 0.27 H new ATOM 0 HG3 GLN C 331 16.391 5.292 2.945 1.00 0.27 H new ATOM 0 HE21 GLN C 331 18.179 4.580 4.217 1.00 0.72 H new ATOM 0 HE22 GLN C 331 19.789 4.310 3.540 1.00 0.72 H new ATOM 1625 N ILE C 332 13.695 4.290 2.558 1.00 0.20 N ATOM 1626 CA ILE C 332 12.440 4.793 3.191 1.00 0.21 C ATOM 1627 C ILE C 332 12.773 5.573 4.465 1.00 0.22 C ATOM 1628 O ILE C 332 13.268 5.026 5.431 1.00 0.24 O ATOM 1629 CB ILE C 332 11.532 3.608 3.537 1.00 0.20 C ATOM 1630 CG1 ILE C 332 11.302 2.761 2.284 1.00 0.22 C ATOM 1631 CG2 ILE C 332 10.187 4.124 4.049 1.00 0.22 C ATOM 1632 CD1 ILE C 332 10.657 1.430 2.677 1.00 0.19 C ATOM 0 H ILE C 332 14.118 3.480 3.011 1.00 0.20 H new ATOM 0 HA ILE C 332 11.927 5.454 2.493 1.00 0.21 H new ATOM 0 HB ILE C 332 12.008 3.003 4.309 1.00 0.20 H new ATOM 0 HG12 ILE C 332 10.660 3.295 1.584 1.00 0.22 H new ATOM 0 HG13 ILE C 332 12.249 2.582 1.775 1.00 0.22 H new ATOM 0 HG21 ILE C 332 9.543 3.280 4.294 1.00 0.22 H new ATOM 0 HG22 ILE C 332 10.346 4.731 4.941 1.00 0.22 H new ATOM 0 HG23 ILE C 332 9.712 4.730 3.277 1.00 0.22 H new ATOM 0 HD11 ILE C 332 10.493 0.827 1.784 1.00 0.19 H new ATOM 0 HD12 ILE C 332 11.316 0.894 3.361 1.00 0.19 H new ATOM 0 HD13 ILE C 332 9.702 1.619 3.167 1.00 0.19 H new ATOM 1644 N ARG C 333 12.497 6.850 4.475 1.00 0.24 N ATOM 1645 CA ARG C 333 12.786 7.668 5.685 1.00 0.25 C ATOM 1646 C ARG C 333 11.780 7.319 6.780 1.00 0.25 C ATOM 1647 O ARG C 333 10.637 7.012 6.508 1.00 0.26 O ATOM 1648 CB ARG C 333 12.661 9.153 5.338 1.00 0.28 C ATOM 1649 CG ARG C 333 13.922 9.614 4.609 1.00 0.40 C ATOM 1650 CD ARG C 333 13.536 10.582 3.492 1.00 0.89 C ATOM 1651 NE ARG C 333 14.034 10.063 2.187 1.00 1.35 N ATOM 1652 CZ ARG C 333 13.573 10.555 1.070 1.00 2.02 C ATOM 1653 NH1 ARG C 333 12.669 11.499 1.091 1.00 2.54 N ATOM 1654 NH2 ARG C 333 14.010 10.101 -0.072 1.00 2.74 N ATOM 0 H ARG C 333 12.083 7.361 3.695 1.00 0.24 H new ATOM 0 HA ARG C 333 13.797 7.460 6.034 1.00 0.25 H new ATOM 0 HB2 ARG C 333 11.785 9.318 4.711 1.00 0.28 H new ATOM 0 HB3 ARG C 333 12.518 9.739 6.246 1.00 0.28 H new ATOM 0 HG2 ARG C 333 14.602 10.100 5.308 1.00 0.40 H new ATOM 0 HG3 ARG C 333 14.451 8.755 4.195 1.00 0.40 H new ATOM 0 HD2 ARG C 333 12.453 10.701 3.458 1.00 0.89 H new ATOM 0 HD3 ARG C 333 13.959 11.567 3.688 1.00 0.89 H new ATOM 0 HE ARG C 333 14.736 9.323 2.167 1.00 1.35 H new ATOM 0 HH11 ARG C 333 12.322 11.853 1.982 1.00 2.54 H new ATOM 0 HH12 ARG C 333 12.311 11.882 0.216 1.00 2.54 H new ATOM 0 HH21 ARG C 333 14.712 9.361 -0.092 1.00 2.74 H new ATOM 0 HH22 ARG C 333 13.650 10.486 -0.945 1.00 2.74 H new ATOM 1668 N GLY C 334 12.190 7.365 8.016 1.00 0.28 N ATOM 1669 CA GLY C 334 11.243 7.038 9.119 1.00 0.29 C ATOM 1670 C GLY C 334 11.197 5.524 9.334 1.00 0.30 C ATOM 1671 O GLY C 334 10.983 4.759 8.413 1.00 0.35 O ATOM 0 H GLY C 334 13.135 7.613 8.310 1.00 0.28 H new ATOM 0 HA2 GLY C 334 11.555 7.535 10.037 1.00 0.29 H new ATOM 0 HA3 GLY C 334 10.247 7.410 8.878 1.00 0.29 H new ATOM 1675 N ARG C 335 11.390 5.088 10.545 1.00 0.27 N ATOM 1676 CA ARG C 335 11.352 3.629 10.834 1.00 0.30 C ATOM 1677 C ARG C 335 9.894 3.166 10.907 1.00 0.29 C ATOM 1678 O ARG C 335 9.568 2.050 10.553 1.00 0.28 O ATOM 1679 CB ARG C 335 12.037 3.371 12.176 1.00 0.34 C ATOM 1680 CG ARG C 335 12.194 1.867 12.405 1.00 0.41 C ATOM 1681 CD ARG C 335 12.851 1.634 13.766 1.00 0.93 C ATOM 1682 NE ARG C 335 13.171 0.189 13.933 1.00 1.26 N ATOM 1683 CZ ARG C 335 14.007 -0.192 14.862 1.00 1.89 C ATOM 1684 NH1 ARG C 335 14.570 0.693 15.641 1.00 2.51 N ATOM 1685 NH2 ARG C 335 14.281 -1.459 15.013 1.00 2.53 N ATOM 0 H ARG C 335 11.574 5.683 11.353 1.00 0.27 H new ATOM 0 HA ARG C 335 11.867 3.080 10.046 1.00 0.30 H new ATOM 0 HB2 ARG C 335 13.014 3.853 12.193 1.00 0.34 H new ATOM 0 HB3 ARG C 335 11.451 3.810 12.983 1.00 0.34 H new ATOM 0 HG2 ARG C 335 11.221 1.377 12.369 1.00 0.41 H new ATOM 0 HG3 ARG C 335 12.802 1.428 11.614 1.00 0.41 H new ATOM 0 HD2 ARG C 335 13.761 2.229 13.847 1.00 0.93 H new ATOM 0 HD3 ARG C 335 12.184 1.962 14.563 1.00 0.93 H new ATOM 0 HE ARG C 335 12.737 -0.503 13.322 1.00 1.26 H new ATOM 0 HH11 ARG C 335 14.357 1.684 15.525 1.00 2.51 H new ATOM 0 HH12 ARG C 335 15.222 0.393 16.366 1.00 2.51 H new ATOM 0 HH21 ARG C 335 13.843 -2.151 14.406 1.00 2.53 H new ATOM 0 HH22 ARG C 335 14.934 -1.757 15.738 1.00 2.53 H new ATOM 1699 N GLU C 336 9.016 4.016 11.371 1.00 0.31 N ATOM 1700 CA GLU C 336 7.579 3.629 11.476 1.00 0.34 C ATOM 1701 C GLU C 336 7.046 3.214 10.102 1.00 0.34 C ATOM 1702 O GLU C 336 6.625 2.091 9.902 1.00 0.34 O ATOM 1703 CB GLU C 336 6.768 4.820 11.991 1.00 0.39 C ATOM 1704 CG GLU C 336 5.517 4.310 12.711 1.00 1.29 C ATOM 1705 CD GLU C 336 5.538 4.772 14.169 1.00 1.90 C ATOM 1706 OE1 GLU C 336 6.604 4.756 14.759 1.00 2.40 O ATOM 1707 OE2 GLU C 336 4.485 5.133 14.671 1.00 2.62 O ATOM 0 H GLU C 336 9.233 4.963 11.682 1.00 0.31 H new ATOM 0 HA GLU C 336 7.486 2.791 12.166 1.00 0.34 H new ATOM 0 HB2 GLU C 336 7.373 5.420 12.671 1.00 0.39 H new ATOM 0 HB3 GLU C 336 6.485 5.467 11.161 1.00 0.39 H new ATOM 0 HG2 GLU C 336 4.622 4.683 12.214 1.00 1.29 H new ATOM 0 HG3 GLU C 336 5.477 3.222 12.665 1.00 1.29 H new ATOM 1714 N ARG C 337 7.050 4.114 9.158 1.00 0.40 N ATOM 1715 CA ARG C 337 6.532 3.776 7.801 1.00 0.45 C ATOM 1716 C ARG C 337 7.351 2.631 7.201 1.00 0.38 C ATOM 1717 O ARG C 337 6.872 1.883 6.372 1.00 0.37 O ATOM 1718 CB ARG C 337 6.637 5.008 6.900 1.00 0.57 C ATOM 1719 CG ARG C 337 5.586 6.036 7.322 1.00 0.66 C ATOM 1720 CD ARG C 337 6.283 7.263 7.912 1.00 1.24 C ATOM 1721 NE ARG C 337 5.284 8.117 8.615 1.00 1.26 N ATOM 1722 CZ ARG C 337 5.685 9.046 9.441 1.00 2.05 C ATOM 1723 NH1 ARG C 337 6.959 9.232 9.652 1.00 2.81 N ATOM 1724 NH2 ARG C 337 4.808 9.792 10.056 1.00 2.60 N ATOM 0 H ARG C 337 7.390 5.070 9.267 1.00 0.40 H new ATOM 0 HA ARG C 337 5.490 3.465 7.879 1.00 0.45 H new ATOM 0 HB2 ARG C 337 7.635 5.441 6.972 1.00 0.57 H new ATOM 0 HB3 ARG C 337 6.487 4.724 5.858 1.00 0.57 H new ATOM 0 HG2 ARG C 337 4.980 6.326 6.464 1.00 0.66 H new ATOM 0 HG3 ARG C 337 4.909 5.600 8.057 1.00 0.66 H new ATOM 0 HD2 ARG C 337 7.063 6.951 8.607 1.00 1.24 H new ATOM 0 HD3 ARG C 337 6.770 7.832 7.121 1.00 1.24 H new ATOM 0 HE ARG C 337 4.287 7.976 8.451 1.00 1.26 H new ATOM 0 HH11 ARG C 337 7.646 8.651 9.171 1.00 2.81 H new ATOM 0 HH12 ARG C 337 7.268 9.958 10.298 1.00 2.81 H new ATOM 0 HH21 ARG C 337 3.812 9.649 9.891 1.00 2.60 H new ATOM 0 HH22 ARG C 337 5.119 10.518 10.701 1.00 2.60 H new ATOM 1738 N PHE C 338 8.581 2.490 7.608 1.00 0.36 N ATOM 1739 CA PHE C 338 9.427 1.394 7.057 1.00 0.34 C ATOM 1740 C PHE C 338 8.736 0.046 7.272 1.00 0.28 C ATOM 1741 O PHE C 338 8.464 -0.680 6.338 1.00 0.26 O ATOM 1742 CB PHE C 338 10.778 1.388 7.772 1.00 0.35 C ATOM 1743 CG PHE C 338 11.620 0.247 7.252 1.00 0.35 C ATOM 1744 CD1 PHE C 338 12.117 0.280 5.942 1.00 0.36 C ATOM 1745 CD2 PHE C 338 11.905 -0.847 8.081 1.00 0.37 C ATOM 1746 CE1 PHE C 338 12.899 -0.780 5.462 1.00 0.38 C ATOM 1747 CE2 PHE C 338 12.687 -1.906 7.600 1.00 0.39 C ATOM 1748 CZ PHE C 338 13.184 -1.873 6.291 1.00 0.40 C ATOM 0 H PHE C 338 9.038 3.086 8.298 1.00 0.36 H new ATOM 0 HA PHE C 338 9.575 1.557 5.989 1.00 0.34 H new ATOM 0 HB2 PHE C 338 11.291 2.336 7.610 1.00 0.35 H new ATOM 0 HB3 PHE C 338 10.632 1.285 8.847 1.00 0.35 H new ATOM 0 HD1 PHE C 338 11.898 1.122 5.302 1.00 0.36 H new ATOM 0 HD2 PHE C 338 11.522 -0.874 9.090 1.00 0.37 H new ATOM 0 HE1 PHE C 338 13.282 -0.754 4.453 1.00 0.38 H new ATOM 0 HE2 PHE C 338 12.907 -2.748 8.239 1.00 0.39 H new ATOM 0 HZ PHE C 338 13.786 -2.689 5.921 1.00 0.40 H new ATOM 1758 N GLU C 339 8.460 -0.297 8.500 1.00 0.28 N ATOM 1759 CA GLU C 339 7.796 -1.603 8.781 1.00 0.25 C ATOM 1760 C GLU C 339 6.542 -1.746 7.916 1.00 0.22 C ATOM 1761 O GLU C 339 6.195 -2.828 7.488 1.00 0.21 O ATOM 1762 CB GLU C 339 7.405 -1.670 10.260 1.00 0.29 C ATOM 1763 CG GLU C 339 8.659 -1.573 11.130 1.00 0.33 C ATOM 1764 CD GLU C 339 9.315 -2.951 11.235 1.00 1.24 C ATOM 1765 OE1 GLU C 339 8.850 -3.746 12.037 1.00 1.99 O ATOM 1766 OE2 GLU C 339 10.272 -3.189 10.517 1.00 2.05 O ATOM 0 H GLU C 339 8.665 0.271 9.322 1.00 0.28 H new ATOM 0 HA GLU C 339 8.487 -2.413 8.548 1.00 0.25 H new ATOM 0 HB2 GLU C 339 6.719 -0.858 10.502 1.00 0.29 H new ATOM 0 HB3 GLU C 339 6.880 -2.603 10.465 1.00 0.29 H new ATOM 0 HG2 GLU C 339 9.359 -0.857 10.699 1.00 0.33 H new ATOM 0 HG3 GLU C 339 8.398 -1.206 12.123 1.00 0.33 H new ATOM 1773 N MET C 340 5.858 -0.667 7.659 1.00 0.23 N ATOM 1774 CA MET C 340 4.625 -0.752 6.828 1.00 0.22 C ATOM 1775 C MET C 340 4.983 -1.201 5.409 1.00 0.19 C ATOM 1776 O MET C 340 4.381 -2.106 4.866 1.00 0.19 O ATOM 1777 CB MET C 340 3.947 0.618 6.771 1.00 0.25 C ATOM 1778 CG MET C 340 2.719 0.537 5.861 1.00 0.28 C ATOM 1779 SD MET C 340 1.681 1.999 6.113 1.00 0.31 S ATOM 1780 CE MET C 340 2.432 3.036 4.832 1.00 0.32 C ATOM 0 H MET C 340 6.098 0.268 7.987 1.00 0.23 H new ATOM 0 HA MET C 340 3.945 -1.477 7.275 1.00 0.22 H new ATOM 0 HB2 MET C 340 3.652 0.932 7.772 1.00 0.25 H new ATOM 0 HB3 MET C 340 4.644 1.366 6.394 1.00 0.25 H new ATOM 0 HG2 MET C 340 3.030 0.474 4.818 1.00 0.28 H new ATOM 0 HG3 MET C 340 2.151 -0.367 6.079 1.00 0.28 H new ATOM 0 HE1 MET C 340 1.935 4.006 4.811 1.00 0.32 H new ATOM 0 HE2 MET C 340 3.491 3.175 5.051 1.00 0.32 H new ATOM 0 HE3 MET C 340 2.323 2.552 3.862 1.00 0.32 H new ATOM 1790 N PHE C 341 5.953 -0.573 4.800 1.00 0.17 N ATOM 1791 CA PHE C 341 6.335 -0.962 3.414 1.00 0.16 C ATOM 1792 C PHE C 341 6.795 -2.422 3.392 1.00 0.16 C ATOM 1793 O PHE C 341 6.494 -3.160 2.478 1.00 0.17 O ATOM 1794 CB PHE C 341 7.467 -0.058 2.925 1.00 0.16 C ATOM 1795 CG PHE C 341 6.893 1.279 2.518 1.00 0.16 C ATOM 1796 CD1 PHE C 341 6.048 1.368 1.404 1.00 0.18 C ATOM 1797 CD2 PHE C 341 7.197 2.428 3.259 1.00 0.16 C ATOM 1798 CE1 PHE C 341 5.510 2.605 1.029 1.00 0.18 C ATOM 1799 CE2 PHE C 341 6.658 3.667 2.885 1.00 0.17 C ATOM 1800 CZ PHE C 341 5.814 3.755 1.770 1.00 0.17 C ATOM 0 H PHE C 341 6.496 0.191 5.202 1.00 0.17 H new ATOM 0 HA PHE C 341 5.472 -0.851 2.758 1.00 0.16 H new ATOM 0 HB2 PHE C 341 8.208 0.075 3.713 1.00 0.16 H new ATOM 0 HB3 PHE C 341 7.979 -0.520 2.081 1.00 0.16 H new ATOM 0 HD1 PHE C 341 5.811 0.482 0.834 1.00 0.18 H new ATOM 0 HD2 PHE C 341 7.847 2.360 4.119 1.00 0.16 H new ATOM 0 HE1 PHE C 341 4.861 2.673 0.169 1.00 0.18 H new ATOM 0 HE2 PHE C 341 6.893 4.553 3.456 1.00 0.17 H new ATOM 0 HZ PHE C 341 5.398 4.709 1.482 1.00 0.17 H new ATOM 1810 N ARG C 342 7.521 -2.845 4.388 1.00 0.18 N ATOM 1811 CA ARG C 342 7.995 -4.258 4.421 1.00 0.20 C ATOM 1812 C ARG C 342 6.812 -5.208 4.212 1.00 0.20 C ATOM 1813 O ARG C 342 6.885 -6.153 3.450 1.00 0.20 O ATOM 1814 CB ARG C 342 8.634 -4.540 5.781 1.00 0.24 C ATOM 1815 CG ARG C 342 9.328 -5.902 5.750 1.00 0.34 C ATOM 1816 CD ARG C 342 10.669 -5.782 5.025 1.00 0.96 C ATOM 1817 NE ARG C 342 11.760 -6.219 5.941 1.00 1.54 N ATOM 1818 CZ ARG C 342 12.943 -6.502 5.467 1.00 2.04 C ATOM 1819 NH1 ARG C 342 13.173 -6.420 4.183 1.00 2.35 N ATOM 1820 NH2 ARG C 342 13.894 -6.874 6.278 1.00 2.91 N ATOM 0 H ARG C 342 7.808 -2.273 5.182 1.00 0.18 H new ATOM 0 HA ARG C 342 8.725 -4.413 3.627 1.00 0.20 H new ATOM 0 HB2 ARG C 342 9.354 -3.759 6.024 1.00 0.24 H new ATOM 0 HB3 ARG C 342 7.873 -4.526 6.561 1.00 0.24 H new ATOM 0 HG2 ARG C 342 9.484 -6.264 6.766 1.00 0.34 H new ATOM 0 HG3 ARG C 342 8.695 -6.632 5.245 1.00 0.34 H new ATOM 0 HD2 ARG C 342 10.666 -6.396 4.124 1.00 0.96 H new ATOM 0 HD3 ARG C 342 10.834 -4.752 4.708 1.00 0.96 H new ATOM 0 HE ARG C 342 11.582 -6.297 6.942 1.00 1.54 H new ATOM 0 HH11 ARG C 342 12.427 -6.134 3.549 1.00 2.35 H new ATOM 0 HH12 ARG C 342 14.098 -6.642 3.815 1.00 2.35 H new ATOM 0 HH21 ARG C 342 13.712 -6.943 7.279 1.00 2.91 H new ATOM 0 HH22 ARG C 342 14.819 -7.096 5.911 1.00 2.91 H new ATOM 1834 N GLU C 343 5.726 -4.969 4.893 1.00 0.21 N ATOM 1835 CA GLU C 343 4.535 -5.859 4.757 1.00 0.23 C ATOM 1836 C GLU C 343 4.051 -5.889 3.303 1.00 0.18 C ATOM 1837 O GLU C 343 3.792 -6.940 2.747 1.00 0.18 O ATOM 1838 CB GLU C 343 3.416 -5.328 5.653 1.00 0.27 C ATOM 1839 CG GLU C 343 2.176 -6.213 5.508 1.00 0.31 C ATOM 1840 CD GLU C 343 2.188 -7.288 6.596 1.00 1.31 C ATOM 1841 OE1 GLU C 343 1.680 -7.019 7.673 1.00 2.07 O ATOM 1842 OE2 GLU C 343 2.705 -8.362 6.335 1.00 2.14 O ATOM 0 H GLU C 343 5.610 -4.191 5.542 1.00 0.21 H new ATOM 0 HA GLU C 343 4.809 -6.871 5.054 1.00 0.23 H new ATOM 0 HB2 GLU C 343 3.745 -5.313 6.692 1.00 0.27 H new ATOM 0 HB3 GLU C 343 3.175 -4.300 5.380 1.00 0.27 H new ATOM 0 HG2 GLU C 343 1.273 -5.608 5.589 1.00 0.31 H new ATOM 0 HG3 GLU C 343 2.161 -6.678 4.522 1.00 0.31 H new ATOM 1849 N LEU C 344 3.914 -4.751 2.685 1.00 0.17 N ATOM 1850 CA LEU C 344 3.433 -4.721 1.274 1.00 0.15 C ATOM 1851 C LEU C 344 4.412 -5.470 0.367 1.00 0.14 C ATOM 1852 O LEU C 344 4.018 -6.105 -0.591 1.00 0.15 O ATOM 1853 CB LEU C 344 3.327 -3.270 0.809 1.00 0.17 C ATOM 1854 CG LEU C 344 2.100 -2.615 1.444 1.00 0.16 C ATOM 1855 CD1 LEU C 344 2.258 -1.093 1.404 1.00 0.22 C ATOM 1856 CD2 LEU C 344 0.848 -3.020 0.659 1.00 0.20 C ATOM 0 H LEU C 344 4.114 -3.839 3.095 1.00 0.17 H new ATOM 0 HA LEU C 344 2.457 -5.203 1.220 1.00 0.15 H new ATOM 0 HB2 LEU C 344 4.228 -2.722 1.086 1.00 0.17 H new ATOM 0 HB3 LEU C 344 3.251 -3.231 -0.278 1.00 0.17 H new ATOM 0 HG LEU C 344 2.004 -2.942 2.479 1.00 0.16 H new ATOM 0 HD11 LEU C 344 1.384 -0.624 1.856 1.00 0.22 H new ATOM 0 HD12 LEU C 344 3.152 -0.805 1.958 1.00 0.22 H new ATOM 0 HD13 LEU C 344 2.351 -0.764 0.369 1.00 0.22 H new ATOM 0 HD21 LEU C 344 -0.029 -2.555 1.108 1.00 0.20 H new ATOM 0 HD22 LEU C 344 0.944 -2.689 -0.375 1.00 0.20 H new ATOM 0 HD23 LEU C 344 0.737 -4.104 0.685 1.00 0.20 H new ATOM 1868 N ASN C 345 5.683 -5.395 0.653 1.00 0.17 N ATOM 1869 CA ASN C 345 6.681 -6.095 -0.202 1.00 0.20 C ATOM 1870 C ASN C 345 6.378 -7.595 -0.249 1.00 0.17 C ATOM 1871 O ASN C 345 6.152 -8.157 -1.302 1.00 0.18 O ATOM 1872 CB ASN C 345 8.086 -5.876 0.367 1.00 0.26 C ATOM 1873 CG ASN C 345 9.112 -6.579 -0.527 1.00 0.29 C ATOM 1874 OD1 ASN C 345 8.771 -7.482 -1.267 1.00 1.08 O ATOM 1875 ND2 ASN C 345 10.361 -6.203 -0.491 1.00 0.71 N ATOM 0 H ASN C 345 6.073 -4.879 1.442 1.00 0.17 H new ATOM 0 HA ASN C 345 6.627 -5.690 -1.213 1.00 0.20 H new ATOM 0 HB2 ASN C 345 8.306 -4.810 0.423 1.00 0.26 H new ATOM 0 HB3 ASN C 345 8.144 -6.267 1.383 1.00 0.26 H new ATOM 0 HD21 ASN C 345 11.050 -6.666 -1.083 1.00 0.71 H new ATOM 0 HD22 ASN C 345 10.648 -5.446 0.129 1.00 0.71 H new ATOM 1882 N GLU C 346 6.383 -8.251 0.880 1.00 0.18 N ATOM 1883 CA GLU C 346 6.108 -9.719 0.893 1.00 0.17 C ATOM 1884 C GLU C 346 4.711 -9.999 0.335 1.00 0.15 C ATOM 1885 O GLU C 346 4.425 -11.087 -0.122 1.00 0.16 O ATOM 1886 CB GLU C 346 6.199 -10.244 2.328 1.00 0.21 C ATOM 1887 CG GLU C 346 5.765 -11.710 2.362 1.00 0.25 C ATOM 1888 CD GLU C 346 6.712 -12.505 3.265 1.00 1.42 C ATOM 1889 OE1 GLU C 346 7.913 -12.390 3.080 1.00 2.20 O ATOM 1890 OE2 GLU C 346 6.219 -13.216 4.125 1.00 2.21 O ATOM 0 H GLU C 346 6.565 -7.836 1.794 1.00 0.18 H new ATOM 0 HA GLU C 346 6.847 -10.223 0.270 1.00 0.17 H new ATOM 0 HB2 GLU C 346 7.220 -10.147 2.698 1.00 0.21 H new ATOM 0 HB3 GLU C 346 5.564 -9.650 2.985 1.00 0.21 H new ATOM 0 HG2 GLU C 346 4.743 -11.789 2.731 1.00 0.25 H new ATOM 0 HG3 GLU C 346 5.773 -12.126 1.354 1.00 0.25 H new ATOM 1897 N ALA C 347 3.836 -9.034 0.375 1.00 0.13 N ATOM 1898 CA ALA C 347 2.457 -9.257 -0.149 1.00 0.14 C ATOM 1899 C ALA C 347 2.508 -9.596 -1.644 1.00 0.16 C ATOM 1900 O ALA C 347 2.023 -10.624 -2.072 1.00 0.18 O ATOM 1901 CB ALA C 347 1.622 -7.993 0.057 1.00 0.15 C ATOM 0 H ALA C 347 4.014 -8.101 0.747 1.00 0.13 H new ATOM 0 HA ALA C 347 2.004 -10.089 0.390 1.00 0.14 H new ATOM 0 HB1 ALA C 347 0.615 -8.156 -0.326 1.00 0.15 H new ATOM 0 HB2 ALA C 347 1.573 -7.759 1.120 1.00 0.15 H new ATOM 0 HB3 ALA C 347 2.083 -7.162 -0.476 1.00 0.15 H new ATOM 1907 N LEU C 348 3.078 -8.732 -2.441 1.00 0.18 N ATOM 1908 CA LEU C 348 3.143 -8.995 -3.909 1.00 0.22 C ATOM 1909 C LEU C 348 3.951 -10.266 -4.185 1.00 0.22 C ATOM 1910 O LEU C 348 3.499 -11.156 -4.873 1.00 0.25 O ATOM 1911 CB LEU C 348 3.814 -7.813 -4.613 1.00 0.25 C ATOM 1912 CG LEU C 348 2.800 -6.686 -4.809 1.00 0.27 C ATOM 1913 CD1 LEU C 348 1.594 -7.210 -5.588 1.00 0.32 C ATOM 1914 CD2 LEU C 348 2.341 -6.170 -3.445 1.00 0.23 C ATOM 0 H LEU C 348 3.502 -7.855 -2.139 1.00 0.18 H new ATOM 0 HA LEU C 348 2.129 -9.125 -4.286 1.00 0.22 H new ATOM 0 HB2 LEU C 348 4.658 -7.457 -4.022 1.00 0.25 H new ATOM 0 HB3 LEU C 348 4.211 -8.130 -5.577 1.00 0.25 H new ATOM 0 HG LEU C 348 3.266 -5.874 -5.367 1.00 0.27 H new ATOM 0 HD11 LEU C 348 0.872 -6.405 -5.726 1.00 0.32 H new ATOM 0 HD12 LEU C 348 1.921 -7.576 -6.561 1.00 0.32 H new ATOM 0 HD13 LEU C 348 1.128 -8.024 -5.032 1.00 0.32 H new ATOM 0 HD21 LEU C 348 1.618 -5.366 -3.585 1.00 0.23 H new ATOM 0 HD22 LEU C 348 1.877 -6.983 -2.886 1.00 0.23 H new ATOM 0 HD23 LEU C 348 3.200 -5.793 -2.891 1.00 0.23 H new ATOM 1926 N GLU C 349 5.145 -10.353 -3.668 1.00 0.22 N ATOM 1927 CA GLU C 349 5.982 -11.563 -3.921 1.00 0.24 C ATOM 1928 C GLU C 349 5.225 -12.822 -3.492 1.00 0.22 C ATOM 1929 O GLU C 349 5.393 -13.884 -4.060 1.00 0.23 O ATOM 1930 CB GLU C 349 7.282 -11.454 -3.121 1.00 0.26 C ATOM 1931 CG GLU C 349 7.990 -10.145 -3.471 1.00 0.33 C ATOM 1932 CD GLU C 349 8.206 -10.067 -4.985 1.00 1.35 C ATOM 1933 OE1 GLU C 349 9.121 -10.716 -5.467 1.00 2.19 O ATOM 1934 OE2 GLU C 349 7.456 -9.358 -5.633 1.00 2.04 O ATOM 0 H GLU C 349 5.579 -9.640 -3.081 1.00 0.22 H new ATOM 0 HA GLU C 349 6.207 -11.628 -4.986 1.00 0.24 H new ATOM 0 HB2 GLU C 349 7.068 -11.489 -2.053 1.00 0.26 H new ATOM 0 HB3 GLU C 349 7.931 -12.301 -3.344 1.00 0.26 H new ATOM 0 HG2 GLU C 349 7.395 -9.296 -3.134 1.00 0.33 H new ATOM 0 HG3 GLU C 349 8.948 -10.088 -2.953 1.00 0.33 H new ATOM 1941 N LEU C 350 4.394 -12.716 -2.494 1.00 0.22 N ATOM 1942 CA LEU C 350 3.630 -13.908 -2.030 1.00 0.23 C ATOM 1943 C LEU C 350 2.669 -14.357 -3.136 1.00 0.23 C ATOM 1944 O LEU C 350 2.615 -15.518 -3.493 1.00 0.26 O ATOM 1945 CB LEU C 350 2.855 -13.530 -0.761 1.00 0.26 C ATOM 1946 CG LEU C 350 1.710 -14.514 -0.502 1.00 0.30 C ATOM 1947 CD1 LEU C 350 0.507 -14.134 -1.361 1.00 0.46 C ATOM 1948 CD2 LEU C 350 2.148 -15.944 -0.837 1.00 0.38 C ATOM 0 H LEU C 350 4.210 -11.855 -1.979 1.00 0.22 H new ATOM 0 HA LEU C 350 4.307 -14.732 -1.805 1.00 0.23 H new ATOM 0 HB2 LEU C 350 3.532 -13.521 0.093 1.00 0.26 H new ATOM 0 HB3 LEU C 350 2.456 -12.521 -0.862 1.00 0.26 H new ATOM 0 HG LEU C 350 1.438 -14.468 0.553 1.00 0.30 H new ATOM 0 HD11 LEU C 350 -0.308 -14.834 -1.177 1.00 0.46 H new ATOM 0 HD12 LEU C 350 0.183 -13.125 -1.107 1.00 0.46 H new ATOM 0 HD13 LEU C 350 0.786 -14.171 -2.414 1.00 0.46 H new ATOM 0 HD21 LEU C 350 1.323 -16.631 -0.648 1.00 0.38 H new ATOM 0 HD22 LEU C 350 2.433 -16.000 -1.887 1.00 0.38 H new ATOM 0 HD23 LEU C 350 2.999 -16.219 -0.215 1.00 0.38 H new ATOM 1960 N LYS C 351 1.916 -13.444 -3.683 1.00 0.23 N ATOM 1961 CA LYS C 351 0.961 -13.803 -4.770 1.00 0.25 C ATOM 1962 C LYS C 351 1.731 -14.363 -5.972 1.00 0.27 C ATOM 1963 O LYS C 351 1.345 -15.351 -6.567 1.00 0.32 O ATOM 1964 CB LYS C 351 0.207 -12.544 -5.195 1.00 0.26 C ATOM 1965 CG LYS C 351 -0.834 -12.898 -6.257 1.00 0.28 C ATOM 1966 CD LYS C 351 -1.482 -11.615 -6.780 1.00 0.35 C ATOM 1967 CE LYS C 351 -2.939 -11.900 -7.147 1.00 0.41 C ATOM 1968 NZ LYS C 351 -3.831 -11.006 -6.360 1.00 1.35 N ATOM 0 H LYS C 351 1.921 -12.458 -3.422 1.00 0.23 H new ATOM 0 HA LYS C 351 0.261 -14.557 -4.411 1.00 0.25 H new ATOM 0 HB2 LYS C 351 -0.280 -12.092 -4.331 1.00 0.26 H new ATOM 0 HB3 LYS C 351 0.906 -11.806 -5.589 1.00 0.26 H new ATOM 0 HG2 LYS C 351 -0.363 -13.441 -7.077 1.00 0.28 H new ATOM 0 HG3 LYS C 351 -1.593 -13.555 -5.833 1.00 0.28 H new ATOM 0 HD2 LYS C 351 -1.432 -10.833 -6.022 1.00 0.35 H new ATOM 0 HD3 LYS C 351 -0.940 -11.249 -7.652 1.00 0.35 H new ATOM 0 HE2 LYS C 351 -3.095 -11.740 -8.214 1.00 0.41 H new ATOM 0 HE3 LYS C 351 -3.180 -12.943 -6.943 1.00 0.41 H new ATOM 0 HZ1 LYS C 351 -4.820 -11.299 -6.492 1.00 1.35 H new ATOM 0 HZ2 LYS C 351 -3.583 -11.068 -5.352 1.00 1.35 H new ATOM 0 HZ3 LYS C 351 -3.714 -10.025 -6.685 1.00 1.35 H new ATOM 1982 N ASP C 352 2.813 -13.730 -6.333 1.00 0.28 N ATOM 1983 CA ASP C 352 3.616 -14.200 -7.497 1.00 0.34 C ATOM 1984 C ASP C 352 4.028 -15.661 -7.299 1.00 0.36 C ATOM 1985 O ASP C 352 4.170 -16.407 -8.247 1.00 0.43 O ATOM 1986 CB ASP C 352 4.874 -13.336 -7.625 1.00 0.39 C ATOM 1987 CG ASP C 352 4.526 -12.016 -8.315 1.00 0.46 C ATOM 1988 OD1 ASP C 352 3.420 -11.908 -8.821 1.00 1.10 O ATOM 1989 OD2 ASP C 352 5.370 -11.135 -8.325 1.00 1.19 O ATOM 0 H ASP C 352 3.178 -12.900 -5.867 1.00 0.28 H new ATOM 0 HA ASP C 352 3.013 -14.118 -8.401 1.00 0.34 H new ATOM 0 HB2 ASP C 352 5.295 -13.142 -6.639 1.00 0.39 H new ATOM 0 HB3 ASP C 352 5.635 -13.867 -8.197 1.00 0.39 H new ATOM 1994 N ALA C 353 4.229 -16.077 -6.079 1.00 0.35 N ATOM 1995 CA ALA C 353 4.638 -17.489 -5.843 1.00 0.43 C ATOM 1996 C ALA C 353 3.512 -18.425 -6.282 1.00 0.47 C ATOM 1997 O ALA C 353 3.746 -19.466 -6.866 1.00 0.57 O ATOM 1998 CB ALA C 353 4.926 -17.698 -4.354 1.00 0.45 C ATOM 0 H ALA C 353 4.128 -15.504 -5.241 1.00 0.35 H new ATOM 0 HA ALA C 353 5.537 -17.707 -6.419 1.00 0.43 H new ATOM 0 HB1 ALA C 353 5.225 -18.732 -4.183 1.00 0.45 H new ATOM 0 HB2 ALA C 353 5.730 -17.031 -4.042 1.00 0.45 H new ATOM 0 HB3 ALA C 353 4.028 -17.480 -3.776 1.00 0.45 H new ATOM 2218 N GLU D 326 -14.725 -9.192 11.089 1.00 0.46 N ATOM 2219 CA GLU D 326 -15.309 -7.832 10.946 1.00 0.43 C ATOM 2220 C GLU D 326 -15.614 -7.571 9.473 1.00 0.38 C ATOM 2221 O GLU D 326 -15.120 -8.255 8.597 1.00 0.37 O ATOM 2222 CB GLU D 326 -14.309 -6.786 11.447 1.00 0.44 C ATOM 2223 CG GLU D 326 -14.043 -6.999 12.938 1.00 0.49 C ATOM 2224 CD GLU D 326 -15.132 -6.304 13.757 1.00 1.38 C ATOM 2225 OE1 GLU D 326 -15.951 -5.623 13.160 1.00 2.13 O ATOM 2226 OE2 GLU D 326 -15.127 -6.460 14.967 1.00 2.12 O ATOM 0 HA GLU D 326 -16.225 -7.766 11.533 1.00 0.43 H new ATOM 0 HB2 GLU D 326 -13.377 -6.863 10.887 1.00 0.44 H new ATOM 0 HB3 GLU D 326 -14.701 -5.783 11.277 1.00 0.44 H new ATOM 0 HG2 GLU D 326 -14.026 -8.065 13.166 1.00 0.49 H new ATOM 0 HG3 GLU D 326 -13.064 -6.601 13.204 1.00 0.49 H new ATOM 2233 N TYR D 327 -16.418 -6.587 9.188 1.00 0.35 N ATOM 2234 CA TYR D 327 -16.746 -6.286 7.769 1.00 0.31 C ATOM 2235 C TYR D 327 -17.006 -4.786 7.615 1.00 0.28 C ATOM 2236 O TYR D 327 -18.027 -4.277 8.030 1.00 0.29 O ATOM 2237 CB TYR D 327 -17.990 -7.075 7.358 1.00 0.33 C ATOM 2238 CG TYR D 327 -17.593 -8.495 7.034 1.00 0.35 C ATOM 2239 CD1 TYR D 327 -17.119 -8.811 5.755 1.00 0.35 C ATOM 2240 CD2 TYR D 327 -17.698 -9.497 8.011 1.00 0.40 C ATOM 2241 CE1 TYR D 327 -16.748 -10.127 5.451 1.00 0.39 C ATOM 2242 CE2 TYR D 327 -17.326 -10.813 7.706 1.00 0.43 C ATOM 2243 CZ TYR D 327 -16.852 -11.128 6.425 1.00 0.43 C ATOM 2244 OH TYR D 327 -16.484 -12.425 6.126 1.00 0.47 O ATOM 0 H TYR D 327 -16.862 -5.979 9.876 1.00 0.35 H new ATOM 0 HA TYR D 327 -15.911 -6.573 7.129 1.00 0.31 H new ATOM 0 HB2 TYR D 327 -18.724 -7.065 8.164 1.00 0.33 H new ATOM 0 HB3 TYR D 327 -18.461 -6.610 6.492 1.00 0.33 H new ATOM 0 HD1 TYR D 327 -17.039 -8.040 5.003 1.00 0.35 H new ATOM 0 HD2 TYR D 327 -18.065 -9.254 8.997 1.00 0.40 H new ATOM 0 HE1 TYR D 327 -16.381 -10.370 4.465 1.00 0.39 H new ATOM 0 HE2 TYR D 327 -17.404 -11.584 8.458 1.00 0.43 H new ATOM 0 HH TYR D 327 -16.617 -12.993 6.914 1.00 0.47 H new ATOM 2254 N PHE D 328 -16.086 -4.075 7.025 1.00 0.25 N ATOM 2255 CA PHE D 328 -16.276 -2.609 6.854 1.00 0.23 C ATOM 2256 C PHE D 328 -16.426 -2.280 5.366 1.00 0.22 C ATOM 2257 O PHE D 328 -16.636 -3.150 4.544 1.00 0.22 O ATOM 2258 CB PHE D 328 -15.063 -1.864 7.424 1.00 0.22 C ATOM 2259 CG PHE D 328 -14.897 -2.202 8.890 1.00 0.24 C ATOM 2260 CD1 PHE D 328 -15.582 -1.460 9.864 1.00 0.27 C ATOM 2261 CD2 PHE D 328 -14.056 -3.255 9.277 1.00 0.24 C ATOM 2262 CE1 PHE D 328 -15.425 -1.773 11.221 1.00 0.30 C ATOM 2263 CE2 PHE D 328 -13.900 -3.566 10.634 1.00 0.27 C ATOM 2264 CZ PHE D 328 -14.585 -2.826 11.606 1.00 0.30 C ATOM 0 H PHE D 328 -15.211 -4.446 6.654 1.00 0.25 H new ATOM 0 HA PHE D 328 -17.175 -2.297 7.385 1.00 0.23 H new ATOM 0 HB2 PHE D 328 -14.164 -2.140 6.874 1.00 0.22 H new ATOM 0 HB3 PHE D 328 -15.194 -0.789 7.302 1.00 0.22 H new ATOM 0 HD1 PHE D 328 -16.230 -0.648 9.568 1.00 0.27 H new ATOM 0 HD2 PHE D 328 -13.528 -3.827 8.528 1.00 0.24 H new ATOM 0 HE1 PHE D 328 -15.952 -1.202 11.971 1.00 0.30 H new ATOM 0 HE2 PHE D 328 -13.251 -4.377 10.931 1.00 0.27 H new ATOM 0 HZ PHE D 328 -14.466 -3.067 12.652 1.00 0.30 H new ATOM 2274 N THR D 329 -16.328 -1.028 5.018 1.00 0.21 N ATOM 2275 CA THR D 329 -16.473 -0.631 3.591 1.00 0.21 C ATOM 2276 C THR D 329 -15.700 0.667 3.354 1.00 0.21 C ATOM 2277 O THR D 329 -15.393 1.391 4.280 1.00 0.22 O ATOM 2278 CB THR D 329 -17.954 -0.417 3.272 1.00 0.21 C ATOM 2279 OG1 THR D 329 -18.515 0.480 4.221 1.00 0.22 O ATOM 2280 CG2 THR D 329 -18.688 -1.756 3.338 1.00 0.21 C ATOM 0 H THR D 329 -16.153 -0.259 5.664 1.00 0.21 H new ATOM 0 HA THR D 329 -16.077 -1.414 2.945 1.00 0.21 H new ATOM 0 HB THR D 329 -18.055 0.002 2.271 1.00 0.21 H new ATOM 0 HG1 THR D 329 -19.463 0.620 4.018 1.00 0.22 H new ATOM 0 HG21 THR D 329 -19.743 -1.604 3.111 1.00 0.21 H new ATOM 0 HG22 THR D 329 -18.256 -2.444 2.611 1.00 0.21 H new ATOM 0 HG23 THR D 329 -18.589 -2.176 4.339 1.00 0.21 H new ATOM 2288 N LEU D 330 -15.376 0.967 2.127 1.00 0.19 N ATOM 2289 CA LEU D 330 -14.617 2.218 1.854 1.00 0.20 C ATOM 2290 C LEU D 330 -14.959 2.732 0.453 1.00 0.20 C ATOM 2291 O LEU D 330 -14.908 2.001 -0.516 1.00 0.19 O ATOM 2292 CB LEU D 330 -13.118 1.919 1.943 1.00 0.20 C ATOM 2293 CG LEU D 330 -12.324 3.141 1.485 1.00 0.21 C ATOM 2294 CD1 LEU D 330 -12.380 4.218 2.569 1.00 0.28 C ATOM 2295 CD2 LEU D 330 -10.866 2.739 1.239 1.00 0.22 C ATOM 0 H LEU D 330 -15.602 0.404 1.307 1.00 0.19 H new ATOM 0 HA LEU D 330 -14.884 2.979 2.587 1.00 0.20 H new ATOM 0 HB2 LEU D 330 -12.849 1.661 2.967 1.00 0.20 H new ATOM 0 HB3 LEU D 330 -12.871 1.058 1.321 1.00 0.20 H new ATOM 0 HG LEU D 330 -12.754 3.530 0.562 1.00 0.21 H new ATOM 0 HD11 LEU D 330 -11.814 5.091 2.244 1.00 0.28 H new ATOM 0 HD12 LEU D 330 -13.417 4.503 2.745 1.00 0.28 H new ATOM 0 HD13 LEU D 330 -11.949 3.829 3.491 1.00 0.28 H new ATOM 0 HD21 LEU D 330 -10.299 3.610 0.912 1.00 0.22 H new ATOM 0 HD22 LEU D 330 -10.435 2.351 2.162 1.00 0.22 H new ATOM 0 HD23 LEU D 330 -10.826 1.970 0.468 1.00 0.22 H new ATOM 2307 N GLN D 331 -15.305 3.985 0.341 1.00 0.21 N ATOM 2308 CA GLN D 331 -15.647 4.547 -0.996 1.00 0.22 C ATOM 2309 C GLN D 331 -14.374 5.066 -1.666 1.00 0.22 C ATOM 2310 O GLN D 331 -13.756 6.003 -1.203 1.00 0.23 O ATOM 2311 CB GLN D 331 -16.645 5.695 -0.824 1.00 0.23 C ATOM 2312 CG GLN D 331 -17.007 6.273 -2.195 1.00 0.30 C ATOM 2313 CD GLN D 331 -18.526 6.238 -2.377 1.00 0.44 C ATOM 2314 OE1 GLN D 331 -19.257 6.797 -1.584 1.00 0.93 O ATOM 2315 NE2 GLN D 331 -19.037 5.601 -3.396 1.00 0.28 N ATOM 0 H GLN D 331 -15.366 4.644 1.117 1.00 0.21 H new ATOM 0 HA GLN D 331 -16.093 3.771 -1.618 1.00 0.22 H new ATOM 0 HB2 GLN D 331 -17.543 5.337 -0.321 1.00 0.23 H new ATOM 0 HB3 GLN D 331 -16.215 6.472 -0.193 1.00 0.23 H new ATOM 0 HG2 GLN D 331 -16.643 7.297 -2.277 1.00 0.30 H new ATOM 0 HG3 GLN D 331 -16.522 5.698 -2.984 1.00 0.30 H new ATOM 0 HE21 GLN D 331 -18.425 5.131 -4.063 1.00 0.28 H new ATOM 0 HE22 GLN D 331 -20.048 5.573 -3.525 1.00 0.28 H new ATOM 2324 N ILE D 332 -13.971 4.463 -2.750 1.00 0.21 N ATOM 2325 CA ILE D 332 -12.733 4.925 -3.434 1.00 0.22 C ATOM 2326 C ILE D 332 -13.099 5.733 -4.681 1.00 0.24 C ATOM 2327 O ILE D 332 -13.609 5.204 -5.647 1.00 0.25 O ATOM 2328 CB ILE D 332 -11.889 3.717 -3.843 1.00 0.22 C ATOM 2329 CG1 ILE D 332 -11.722 2.781 -2.644 1.00 0.20 C ATOM 2330 CG2 ILE D 332 -10.517 4.196 -4.306 1.00 0.25 C ATOM 2331 CD1 ILE D 332 -11.057 1.481 -3.097 1.00 0.24 C ATOM 0 H ILE D 332 -14.444 3.673 -3.190 1.00 0.21 H new ATOM 0 HA ILE D 332 -12.163 5.554 -2.750 1.00 0.22 H new ATOM 0 HB ILE D 332 -12.385 3.183 -4.654 1.00 0.22 H new ATOM 0 HG12 ILE D 332 -11.117 3.262 -1.876 1.00 0.20 H new ATOM 0 HG13 ILE D 332 -12.693 2.568 -2.198 1.00 0.20 H new ATOM 0 HG21 ILE D 332 -9.912 3.338 -4.599 1.00 0.25 H new ATOM 0 HG22 ILE D 332 -10.634 4.865 -5.158 1.00 0.25 H new ATOM 0 HG23 ILE D 332 -10.024 4.728 -3.492 1.00 0.25 H new ATOM 0 HD11 ILE D 332 -10.939 0.816 -2.242 1.00 0.24 H new ATOM 0 HD12 ILE D 332 -11.679 0.997 -3.850 1.00 0.24 H new ATOM 0 HD13 ILE D 332 -10.078 1.702 -3.523 1.00 0.24 H new ATOM 2343 N ARG D 333 -12.839 7.011 -4.667 1.00 0.25 N ATOM 2344 CA ARG D 333 -13.169 7.848 -5.854 1.00 0.27 C ATOM 2345 C ARG D 333 -12.179 7.548 -6.983 1.00 0.27 C ATOM 2346 O ARG D 333 -11.033 7.221 -6.748 1.00 0.27 O ATOM 2347 CB ARG D 333 -13.080 9.328 -5.477 1.00 0.32 C ATOM 2348 CG ARG D 333 -14.311 9.719 -4.656 1.00 0.42 C ATOM 2349 CD ARG D 333 -13.904 9.938 -3.198 1.00 0.69 C ATOM 2350 NE ARG D 333 -14.517 11.206 -2.688 1.00 1.45 N ATOM 2351 CZ ARG D 333 -14.433 12.321 -3.369 1.00 1.96 C ATOM 2352 NH1 ARG D 333 -13.646 12.413 -4.410 1.00 2.18 N ATOM 2353 NH2 ARG D 333 -15.097 13.372 -2.967 1.00 2.93 N ATOM 0 H ARG D 333 -12.413 7.511 -3.887 1.00 0.25 H new ATOM 0 HA ARG D 333 -14.181 7.619 -6.188 1.00 0.27 H new ATOM 0 HB2 ARG D 333 -12.172 9.514 -4.903 1.00 0.32 H new ATOM 0 HB3 ARG D 333 -13.020 9.941 -6.377 1.00 0.32 H new ATOM 0 HG2 ARG D 333 -14.757 10.628 -5.060 1.00 0.42 H new ATOM 0 HG3 ARG D 333 -15.067 8.937 -4.720 1.00 0.42 H new ATOM 0 HD2 ARG D 333 -14.229 9.095 -2.589 1.00 0.69 H new ATOM 0 HD3 ARG D 333 -12.818 9.989 -3.117 1.00 0.69 H new ATOM 0 HE ARG D 333 -15.009 11.201 -1.794 1.00 1.45 H new ATOM 0 HH11 ARG D 333 -13.088 11.610 -4.700 1.00 2.18 H new ATOM 0 HH12 ARG D 333 -13.590 13.288 -4.931 1.00 2.18 H new ATOM 0 HH21 ARG D 333 -15.675 13.320 -2.128 1.00 2.93 H new ATOM 0 HH22 ARG D 333 -15.037 14.245 -3.492 1.00 2.93 H new ATOM 2367 N GLY D 334 -12.611 7.659 -8.211 1.00 0.30 N ATOM 2368 CA GLY D 334 -11.693 7.380 -9.353 1.00 0.32 C ATOM 2369 C GLY D 334 -11.684 5.880 -9.648 1.00 0.34 C ATOM 2370 O GLY D 334 -11.550 5.064 -8.758 1.00 0.41 O ATOM 0 H GLY D 334 -13.559 7.931 -8.472 1.00 0.30 H new ATOM 0 HA2 GLY D 334 -12.015 7.933 -10.235 1.00 0.32 H new ATOM 0 HA3 GLY D 334 -10.685 7.720 -9.114 1.00 0.32 H new ATOM 2374 N ARG D 335 -11.830 5.507 -10.889 1.00 0.31 N ATOM 2375 CA ARG D 335 -11.833 4.058 -11.234 1.00 0.35 C ATOM 2376 C ARG D 335 -10.395 3.534 -11.258 1.00 0.33 C ATOM 2377 O ARG D 335 -10.115 2.441 -10.808 1.00 0.31 O ATOM 2378 CB ARG D 335 -12.469 3.861 -12.614 1.00 0.39 C ATOM 2379 CG ARG D 335 -12.360 2.389 -13.016 1.00 0.49 C ATOM 2380 CD ARG D 335 -13.403 2.073 -14.090 1.00 0.94 C ATOM 2381 NE ARG D 335 -13.008 0.829 -14.811 1.00 1.55 N ATOM 2382 CZ ARG D 335 -13.866 0.209 -15.573 1.00 2.13 C ATOM 2383 NH1 ARG D 335 -15.078 0.673 -15.711 1.00 2.45 N ATOM 2384 NH2 ARG D 335 -13.511 -0.880 -16.199 1.00 3.03 N ATOM 0 H ARG D 335 -11.947 6.142 -11.678 1.00 0.31 H new ATOM 0 HA ARG D 335 -12.407 3.510 -10.487 1.00 0.35 H new ATOM 0 HB2 ARG D 335 -13.515 4.167 -12.592 1.00 0.39 H new ATOM 0 HB3 ARG D 335 -11.968 4.489 -13.351 1.00 0.39 H new ATOM 0 HG2 ARG D 335 -11.359 2.177 -13.393 1.00 0.49 H new ATOM 0 HG3 ARG D 335 -12.514 1.751 -12.146 1.00 0.49 H new ATOM 0 HD2 ARG D 335 -14.385 1.946 -13.633 1.00 0.94 H new ATOM 0 HD3 ARG D 335 -13.483 2.904 -14.791 1.00 0.94 H new ATOM 0 HE ARG D 335 -12.062 0.461 -14.708 1.00 1.55 H new ATOM 0 HH11 ARG D 335 -15.357 1.523 -15.222 1.00 2.45 H new ATOM 0 HH12 ARG D 335 -15.746 0.185 -16.308 1.00 2.45 H new ATOM 0 HH21 ARG D 335 -12.564 -1.244 -16.092 1.00 3.03 H new ATOM 0 HH22 ARG D 335 -14.180 -1.367 -16.795 1.00 3.03 H new ATOM 2398 N GLU D 336 -9.482 4.300 -11.788 1.00 0.36 N ATOM 2399 CA GLU D 336 -8.065 3.840 -11.849 1.00 0.38 C ATOM 2400 C GLU D 336 -7.552 3.533 -10.437 1.00 0.38 C ATOM 2401 O GLU D 336 -7.044 2.461 -10.171 1.00 0.39 O ATOM 2402 CB GLU D 336 -7.194 4.931 -12.483 1.00 0.45 C ATOM 2403 CG GLU D 336 -7.451 6.269 -11.786 1.00 1.31 C ATOM 2404 CD GLU D 336 -7.275 7.411 -12.789 1.00 1.71 C ATOM 2405 OE1 GLU D 336 -6.315 7.370 -13.540 1.00 2.26 O ATOM 2406 OE2 GLU D 336 -8.103 8.308 -12.786 1.00 2.21 O ATOM 0 H GLU D 336 -9.655 5.225 -12.182 1.00 0.36 H new ATOM 0 HA GLU D 336 -8.012 2.935 -12.454 1.00 0.38 H new ATOM 0 HB2 GLU D 336 -6.141 4.663 -12.399 1.00 0.45 H new ATOM 0 HB3 GLU D 336 -7.418 5.016 -13.546 1.00 0.45 H new ATOM 0 HG2 GLU D 336 -8.459 6.287 -11.372 1.00 1.31 H new ATOM 0 HG3 GLU D 336 -6.761 6.395 -10.952 1.00 1.31 H new ATOM 2413 N ARG D 337 -7.676 4.464 -9.533 1.00 0.43 N ATOM 2414 CA ARG D 337 -7.190 4.226 -8.144 1.00 0.49 C ATOM 2415 C ARG D 337 -7.956 3.057 -7.520 1.00 0.40 C ATOM 2416 O ARG D 337 -7.410 2.278 -6.764 1.00 0.38 O ATOM 2417 CB ARG D 337 -7.411 5.487 -7.306 1.00 0.63 C ATOM 2418 CG ARG D 337 -6.781 6.692 -8.011 1.00 0.77 C ATOM 2419 CD ARG D 337 -5.325 6.377 -8.376 1.00 1.09 C ATOM 2420 NE ARG D 337 -4.531 7.641 -8.373 1.00 1.38 N ATOM 2421 CZ ARG D 337 -3.226 7.600 -8.380 1.00 2.18 C ATOM 2422 NH1 ARG D 337 -2.604 6.452 -8.401 1.00 2.72 N ATOM 2423 NH2 ARG D 337 -2.543 8.712 -8.372 1.00 2.92 N ATOM 0 H ARG D 337 -8.093 5.381 -9.695 1.00 0.43 H new ATOM 0 HA ARG D 337 -6.127 3.985 -8.170 1.00 0.49 H new ATOM 0 HB2 ARG D 337 -8.478 5.656 -7.160 1.00 0.63 H new ATOM 0 HB3 ARG D 337 -6.970 5.360 -6.317 1.00 0.63 H new ATOM 0 HG2 ARG D 337 -7.347 6.935 -8.910 1.00 0.77 H new ATOM 0 HG3 ARG D 337 -6.822 7.567 -7.362 1.00 0.77 H new ATOM 0 HD2 ARG D 337 -4.904 5.668 -7.663 1.00 1.09 H new ATOM 0 HD3 ARG D 337 -5.278 5.907 -9.358 1.00 1.09 H new ATOM 0 HE ARG D 337 -5.010 8.541 -8.365 1.00 1.38 H new ATOM 0 HH11 ARG D 337 -3.138 5.583 -8.412 1.00 2.72 H new ATOM 0 HH12 ARG D 337 -1.584 6.424 -8.406 1.00 2.72 H new ATOM 0 HH21 ARG D 337 -3.029 9.609 -8.360 1.00 2.92 H new ATOM 0 HH22 ARG D 337 -1.523 8.684 -8.377 1.00 2.92 H new ATOM 2437 N PHE D 338 -9.218 2.929 -7.825 1.00 0.37 N ATOM 2438 CA PHE D 338 -10.019 1.814 -7.242 1.00 0.33 C ATOM 2439 C PHE D 338 -9.342 0.473 -7.534 1.00 0.27 C ATOM 2440 O PHE D 338 -9.041 -0.285 -6.637 1.00 0.26 O ATOM 2441 CB PHE D 338 -11.422 1.820 -7.853 1.00 0.34 C ATOM 2442 CG PHE D 338 -12.188 0.612 -7.366 1.00 0.33 C ATOM 2443 CD1 PHE D 338 -12.655 0.567 -6.046 1.00 0.33 C ATOM 2444 CD2 PHE D 338 -12.432 -0.463 -8.232 1.00 0.35 C ATOM 2445 CE1 PHE D 338 -13.364 -0.553 -5.591 1.00 0.34 C ATOM 2446 CE2 PHE D 338 -13.143 -1.582 -7.777 1.00 0.37 C ATOM 2447 CZ PHE D 338 -13.607 -1.627 -6.456 1.00 0.35 C ATOM 0 H PHE D 338 -9.730 3.548 -8.453 1.00 0.37 H new ATOM 0 HA PHE D 338 -10.088 1.951 -6.163 1.00 0.33 H new ATOM 0 HB2 PHE D 338 -11.948 2.734 -7.575 1.00 0.34 H new ATOM 0 HB3 PHE D 338 -11.357 1.808 -8.941 1.00 0.34 H new ATOM 0 HD1 PHE D 338 -12.469 1.396 -5.379 1.00 0.33 H new ATOM 0 HD2 PHE D 338 -12.072 -0.429 -9.250 1.00 0.35 H new ATOM 0 HE1 PHE D 338 -13.723 -0.588 -4.573 1.00 0.34 H new ATOM 0 HE2 PHE D 338 -13.333 -2.409 -8.445 1.00 0.37 H new ATOM 0 HZ PHE D 338 -14.152 -2.490 -6.105 1.00 0.35 H new ATOM 2457 N GLU D 339 -9.107 0.172 -8.780 1.00 0.28 N ATOM 2458 CA GLU D 339 -8.459 -1.124 -9.128 1.00 0.28 C ATOM 2459 C GLU D 339 -7.165 -1.306 -8.324 1.00 0.24 C ATOM 2460 O GLU D 339 -6.819 -2.403 -7.930 1.00 0.24 O ATOM 2461 CB GLU D 339 -8.132 -1.141 -10.621 1.00 0.34 C ATOM 2462 CG GLU D 339 -9.419 -1.349 -11.424 1.00 0.38 C ATOM 2463 CD GLU D 339 -9.069 -1.545 -12.900 1.00 1.18 C ATOM 2464 OE1 GLU D 339 -8.609 -0.595 -13.513 1.00 1.87 O ATOM 2465 OE2 GLU D 339 -9.269 -2.643 -13.394 1.00 1.99 O ATOM 0 H GLU D 339 -9.336 0.769 -9.575 1.00 0.28 H new ATOM 0 HA GLU D 339 -9.143 -1.937 -8.887 1.00 0.28 H new ATOM 0 HB2 GLU D 339 -7.658 -0.203 -10.911 1.00 0.34 H new ATOM 0 HB3 GLU D 339 -7.422 -1.938 -10.839 1.00 0.34 H new ATOM 0 HG2 GLU D 339 -9.959 -2.218 -11.048 1.00 0.38 H new ATOM 0 HG3 GLU D 339 -10.078 -0.489 -11.306 1.00 0.38 H new ATOM 2472 N MET D 340 -6.443 -0.247 -8.082 1.00 0.23 N ATOM 2473 CA MET D 340 -5.168 -0.372 -7.314 1.00 0.22 C ATOM 2474 C MET D 340 -5.462 -0.874 -5.897 1.00 0.18 C ATOM 2475 O MET D 340 -4.825 -1.788 -5.410 1.00 0.19 O ATOM 2476 CB MET D 340 -4.479 0.995 -7.245 1.00 0.24 C ATOM 2477 CG MET D 340 -3.052 0.827 -6.717 1.00 0.27 C ATOM 2478 SD MET D 340 -2.167 2.402 -6.859 1.00 0.29 S ATOM 2479 CE MET D 340 -2.789 3.157 -5.336 1.00 0.31 C ATOM 0 H MET D 340 -6.679 0.699 -8.382 1.00 0.23 H new ATOM 0 HA MET D 340 -4.513 -1.084 -7.815 1.00 0.22 H new ATOM 0 HB2 MET D 340 -4.460 1.454 -8.234 1.00 0.24 H new ATOM 0 HB3 MET D 340 -5.042 1.664 -6.594 1.00 0.24 H new ATOM 0 HG2 MET D 340 -3.073 0.502 -5.677 1.00 0.27 H new ATOM 0 HG3 MET D 340 -2.532 0.053 -7.282 1.00 0.27 H new ATOM 0 HE1 MET D 340 -2.295 4.116 -5.177 1.00 0.31 H new ATOM 0 HE2 MET D 340 -3.865 3.312 -5.420 1.00 0.31 H new ATOM 0 HE3 MET D 340 -2.582 2.498 -4.493 1.00 0.31 H new ATOM 2489 N PHE D 341 -6.415 -0.285 -5.231 1.00 0.16 N ATOM 2490 CA PHE D 341 -6.740 -0.729 -3.846 1.00 0.14 C ATOM 2491 C PHE D 341 -7.228 -2.182 -3.866 1.00 0.15 C ATOM 2492 O PHE D 341 -6.790 -3.004 -3.086 1.00 0.16 O ATOM 2493 CB PHE D 341 -7.839 0.167 -3.273 1.00 0.14 C ATOM 2494 CG PHE D 341 -7.240 1.482 -2.830 1.00 0.14 C ATOM 2495 CD1 PHE D 341 -6.466 1.541 -1.664 1.00 0.17 C ATOM 2496 CD2 PHE D 341 -7.459 2.643 -3.585 1.00 0.15 C ATOM 2497 CE1 PHE D 341 -5.910 2.760 -1.253 1.00 0.18 C ATOM 2498 CE2 PHE D 341 -6.902 3.862 -3.174 1.00 0.16 C ATOM 2499 CZ PHE D 341 -6.128 3.920 -2.008 1.00 0.17 C ATOM 0 H PHE D 341 -6.983 0.485 -5.585 1.00 0.16 H new ATOM 0 HA PHE D 341 -5.846 -0.659 -3.226 1.00 0.14 H new ATOM 0 HB2 PHE D 341 -8.609 0.341 -4.024 1.00 0.14 H new ATOM 0 HB3 PHE D 341 -8.322 -0.327 -2.430 1.00 0.14 H new ATOM 0 HD1 PHE D 341 -6.298 0.647 -1.082 1.00 0.17 H new ATOM 0 HD2 PHE D 341 -8.057 2.598 -4.483 1.00 0.15 H new ATOM 0 HE1 PHE D 341 -5.313 2.805 -0.354 1.00 0.18 H new ATOM 0 HE2 PHE D 341 -7.070 4.756 -3.756 1.00 0.16 H new ATOM 0 HZ PHE D 341 -5.699 4.859 -1.691 1.00 0.17 H new ATOM 2509 N ARG D 342 -8.136 -2.498 -4.746 1.00 0.17 N ATOM 2510 CA ARG D 342 -8.665 -3.892 -4.816 1.00 0.20 C ATOM 2511 C ARG D 342 -7.507 -4.894 -4.838 1.00 0.19 C ATOM 2512 O ARG D 342 -7.552 -5.919 -4.187 1.00 0.19 O ATOM 2513 CB ARG D 342 -9.501 -4.050 -6.089 1.00 0.24 C ATOM 2514 CG ARG D 342 -10.271 -5.370 -6.032 1.00 0.32 C ATOM 2515 CD ARG D 342 -10.644 -5.808 -7.450 1.00 0.62 C ATOM 2516 NE ARG D 342 -10.855 -7.283 -7.471 1.00 1.13 N ATOM 2517 CZ ARG D 342 -11.461 -7.848 -8.480 1.00 1.73 C ATOM 2518 NH1 ARG D 342 -11.882 -7.127 -9.484 1.00 2.34 N ATOM 2519 NH2 ARG D 342 -11.650 -9.140 -8.484 1.00 2.41 N ATOM 0 H ARG D 342 -8.537 -1.849 -5.423 1.00 0.17 H new ATOM 0 HA ARG D 342 -9.284 -4.085 -3.940 1.00 0.20 H new ATOM 0 HB2 ARG D 342 -10.195 -3.215 -6.187 1.00 0.24 H new ATOM 0 HB3 ARG D 342 -8.854 -4.031 -6.966 1.00 0.24 H new ATOM 0 HG2 ARG D 342 -9.663 -6.137 -5.552 1.00 0.32 H new ATOM 0 HG3 ARG D 342 -11.171 -5.252 -5.428 1.00 0.32 H new ATOM 0 HD2 ARG D 342 -11.549 -5.295 -7.775 1.00 0.62 H new ATOM 0 HD3 ARG D 342 -9.853 -5.532 -8.148 1.00 0.62 H new ATOM 0 HE ARG D 342 -10.524 -7.854 -6.693 1.00 1.13 H new ATOM 0 HH11 ARG D 342 -11.738 -6.117 -9.483 1.00 2.34 H new ATOM 0 HH12 ARG D 342 -12.355 -7.574 -10.270 1.00 2.34 H new ATOM 0 HH21 ARG D 342 -11.324 -9.705 -7.700 1.00 2.41 H new ATOM 0 HH22 ARG D 342 -12.123 -9.584 -9.271 1.00 2.41 H new ATOM 2533 N GLU D 343 -6.472 -4.615 -5.584 1.00 0.20 N ATOM 2534 CA GLU D 343 -5.322 -5.563 -5.644 1.00 0.21 C ATOM 2535 C GLU D 343 -4.740 -5.763 -4.243 1.00 0.16 C ATOM 2536 O GLU D 343 -4.520 -6.874 -3.804 1.00 0.16 O ATOM 2537 CB GLU D 343 -4.241 -4.996 -6.568 1.00 0.26 C ATOM 2538 CG GLU D 343 -3.052 -5.961 -6.621 1.00 0.54 C ATOM 2539 CD GLU D 343 -3.266 -6.977 -7.743 1.00 1.48 C ATOM 2540 OE1 GLU D 343 -3.282 -6.567 -8.893 1.00 2.11 O ATOM 2541 OE2 GLU D 343 -3.407 -8.149 -7.436 1.00 2.35 O ATOM 0 H GLU D 343 -6.373 -3.774 -6.153 1.00 0.20 H new ATOM 0 HA GLU D 343 -5.668 -6.522 -6.030 1.00 0.21 H new ATOM 0 HB2 GLU D 343 -4.646 -4.846 -7.569 1.00 0.26 H new ATOM 0 HB3 GLU D 343 -3.915 -4.021 -6.207 1.00 0.26 H new ATOM 0 HG2 GLU D 343 -2.128 -5.407 -6.789 1.00 0.54 H new ATOM 0 HG3 GLU D 343 -2.945 -6.476 -5.666 1.00 0.54 H new ATOM 2548 N LEU D 344 -4.484 -4.697 -3.537 1.00 0.15 N ATOM 2549 CA LEU D 344 -3.909 -4.832 -2.167 1.00 0.14 C ATOM 2550 C LEU D 344 -4.876 -5.617 -1.275 1.00 0.14 C ATOM 2551 O LEU D 344 -4.466 -6.345 -0.392 1.00 0.15 O ATOM 2552 CB LEU D 344 -3.678 -3.442 -1.569 1.00 0.15 C ATOM 2553 CG LEU D 344 -2.527 -2.758 -2.305 1.00 0.15 C ATOM 2554 CD1 LEU D 344 -2.592 -1.248 -2.071 1.00 0.17 C ATOM 2555 CD2 LEU D 344 -1.197 -3.296 -1.777 1.00 0.19 C ATOM 0 H LEU D 344 -4.647 -3.739 -3.848 1.00 0.15 H new ATOM 0 HA LEU D 344 -2.960 -5.365 -2.227 1.00 0.14 H new ATOM 0 HB2 LEU D 344 -4.585 -2.843 -1.652 1.00 0.15 H new ATOM 0 HB3 LEU D 344 -3.447 -3.525 -0.507 1.00 0.15 H new ATOM 0 HG LEU D 344 -2.608 -2.962 -3.373 1.00 0.15 H new ATOM 0 HD11 LEU D 344 -1.770 -0.763 -2.597 1.00 0.17 H new ATOM 0 HD12 LEU D 344 -3.540 -0.862 -2.445 1.00 0.17 H new ATOM 0 HD13 LEU D 344 -2.512 -1.041 -1.004 1.00 0.17 H new ATOM 0 HD21 LEU D 344 -0.374 -2.809 -2.301 1.00 0.19 H new ATOM 0 HD22 LEU D 344 -1.120 -3.091 -0.709 1.00 0.19 H new ATOM 0 HD23 LEU D 344 -1.148 -4.372 -1.944 1.00 0.19 H new ATOM 2567 N ASN D 345 -6.155 -5.474 -1.495 1.00 0.17 N ATOM 2568 CA ASN D 345 -7.143 -6.212 -0.657 1.00 0.20 C ATOM 2569 C ASN D 345 -6.855 -7.716 -0.721 1.00 0.17 C ATOM 2570 O ASN D 345 -6.692 -8.368 0.291 1.00 0.17 O ATOM 2571 CB ASN D 345 -8.556 -5.940 -1.182 1.00 0.26 C ATOM 2572 CG ASN D 345 -9.583 -6.562 -0.232 1.00 0.30 C ATOM 2573 OD1 ASN D 345 -10.837 -6.217 -0.332 1.00 1.09 O flip ATOM 2574 ND2 ASN D 345 -9.239 -7.371 0.607 1.00 0.68 N flip ATOM 0 H ASN D 345 -6.558 -4.878 -2.218 1.00 0.17 H new ATOM 0 HA ASN D 345 -7.064 -5.875 0.377 1.00 0.20 H new ATOM 0 HB2 ASN D 345 -8.724 -4.866 -1.264 1.00 0.26 H new ATOM 0 HB3 ASN D 345 -8.670 -6.358 -2.182 1.00 0.26 H new ATOM 0 HD21 ASN D 345 -8.258 -7.640 0.684 1.00 0.68 H new ATOM 0 HD22 ASN D 345 -9.931 -7.781 1.234 1.00 0.68 H new ATOM 2581 N GLU D 346 -6.797 -8.274 -1.900 1.00 0.17 N ATOM 2582 CA GLU D 346 -6.529 -9.736 -2.022 1.00 0.17 C ATOM 2583 C GLU D 346 -5.147 -10.067 -1.452 1.00 0.14 C ATOM 2584 O GLU D 346 -4.901 -11.168 -1.004 1.00 0.15 O ATOM 2585 CB GLU D 346 -6.583 -10.147 -3.494 1.00 0.20 C ATOM 2586 CG GLU D 346 -6.683 -11.670 -3.597 1.00 0.24 C ATOM 2587 CD GLU D 346 -8.084 -12.121 -3.178 1.00 0.90 C ATOM 2588 OE1 GLU D 346 -8.974 -12.076 -4.012 1.00 1.69 O ATOM 2589 OE2 GLU D 346 -8.243 -12.505 -2.032 1.00 1.54 O ATOM 0 H GLU D 346 -6.924 -7.781 -2.784 1.00 0.17 H new ATOM 0 HA GLU D 346 -7.287 -10.282 -1.461 1.00 0.17 H new ATOM 0 HB2 GLU D 346 -7.440 -9.682 -3.981 1.00 0.20 H new ATOM 0 HB3 GLU D 346 -5.692 -9.795 -4.014 1.00 0.20 H new ATOM 0 HG2 GLU D 346 -6.477 -11.990 -4.618 1.00 0.24 H new ATOM 0 HG3 GLU D 346 -5.933 -12.138 -2.959 1.00 0.24 H new ATOM 2596 N ALA D 347 -4.239 -9.133 -1.476 1.00 0.13 N ATOM 2597 CA ALA D 347 -2.872 -9.408 -0.941 1.00 0.14 C ATOM 2598 C ALA D 347 -2.945 -9.741 0.552 1.00 0.16 C ATOM 2599 O ALA D 347 -2.521 -10.794 0.985 1.00 0.18 O ATOM 2600 CB ALA D 347 -1.985 -8.178 -1.146 1.00 0.16 C ATOM 0 H ALA D 347 -4.381 -8.192 -1.842 1.00 0.13 H new ATOM 0 HA ALA D 347 -2.449 -10.259 -1.474 1.00 0.14 H new ATOM 0 HB1 ALA D 347 -0.988 -8.379 -0.755 1.00 0.16 H new ATOM 0 HB2 ALA D 347 -1.919 -7.950 -2.210 1.00 0.16 H new ATOM 0 HB3 ALA D 347 -2.416 -7.327 -0.619 1.00 0.16 H new ATOM 2606 N LEU D 348 -3.469 -8.843 1.345 1.00 0.17 N ATOM 2607 CA LEU D 348 -3.557 -9.097 2.813 1.00 0.21 C ATOM 2608 C LEU D 348 -4.418 -10.334 3.080 1.00 0.21 C ATOM 2609 O LEU D 348 -4.042 -11.213 3.829 1.00 0.23 O ATOM 2610 CB LEU D 348 -4.193 -7.888 3.504 1.00 0.24 C ATOM 2611 CG LEU D 348 -3.158 -6.773 3.652 1.00 0.26 C ATOM 2612 CD1 LEU D 348 -1.902 -7.321 4.332 1.00 0.31 C ATOM 2613 CD2 LEU D 348 -2.796 -6.230 2.270 1.00 0.22 C ATOM 0 H LEU D 348 -3.840 -7.944 1.039 1.00 0.17 H new ATOM 0 HA LEU D 348 -2.553 -9.263 3.204 1.00 0.21 H new ATOM 0 HB2 LEU D 348 -5.044 -7.532 2.924 1.00 0.24 H new ATOM 0 HB3 LEU D 348 -4.573 -8.176 4.484 1.00 0.24 H new ATOM 0 HG LEU D 348 -3.575 -5.971 4.261 1.00 0.26 H new ATOM 0 HD11 LEU D 348 -1.167 -6.523 4.436 1.00 0.31 H new ATOM 0 HD12 LEU D 348 -2.161 -7.706 5.318 1.00 0.31 H new ATOM 0 HD13 LEU D 348 -1.482 -8.125 3.727 1.00 0.31 H new ATOM 0 HD21 LEU D 348 -2.058 -5.435 2.373 1.00 0.22 H new ATOM 0 HD22 LEU D 348 -2.381 -7.033 1.661 1.00 0.22 H new ATOM 0 HD23 LEU D 348 -3.690 -5.835 1.789 1.00 0.22 H new ATOM 2625 N GLU D 349 -5.576 -10.408 2.482 1.00 0.20 N ATOM 2626 CA GLU D 349 -6.460 -11.585 2.712 1.00 0.21 C ATOM 2627 C GLU D 349 -5.710 -12.869 2.349 1.00 0.19 C ATOM 2628 O GLU D 349 -5.907 -13.905 2.953 1.00 0.21 O ATOM 2629 CB GLU D 349 -7.710 -11.462 1.839 1.00 0.22 C ATOM 2630 CG GLU D 349 -8.658 -10.428 2.448 1.00 0.28 C ATOM 2631 CD GLU D 349 -9.996 -10.462 1.707 1.00 1.21 C ATOM 2632 OE1 GLU D 349 -10.443 -11.550 1.382 1.00 1.91 O ATOM 2633 OE2 GLU D 349 -10.552 -9.401 1.478 1.00 1.95 O ATOM 0 H GLU D 349 -5.948 -9.704 1.844 1.00 0.20 H new ATOM 0 HA GLU D 349 -6.750 -11.619 3.762 1.00 0.21 H new ATOM 0 HB2 GLU D 349 -7.432 -11.165 0.828 1.00 0.22 H new ATOM 0 HB3 GLU D 349 -8.209 -12.428 1.762 1.00 0.22 H new ATOM 0 HG2 GLU D 349 -8.811 -10.639 3.506 1.00 0.28 H new ATOM 0 HG3 GLU D 349 -8.219 -9.433 2.381 1.00 0.28 H new ATOM 2640 N LEU D 350 -4.852 -12.807 1.370 1.00 0.19 N ATOM 2641 CA LEU D 350 -4.088 -14.019 0.966 1.00 0.21 C ATOM 2642 C LEU D 350 -3.182 -14.451 2.119 1.00 0.22 C ATOM 2643 O LEU D 350 -3.087 -15.617 2.446 1.00 0.28 O ATOM 2644 CB LEU D 350 -3.232 -13.697 -0.261 1.00 0.24 C ATOM 2645 CG LEU D 350 -2.837 -14.998 -0.960 1.00 0.29 C ATOM 2646 CD1 LEU D 350 -2.095 -14.680 -2.259 1.00 0.43 C ATOM 2647 CD2 LEU D 350 -1.929 -15.814 -0.036 1.00 0.38 C ATOM 0 H LEU D 350 -4.646 -11.966 0.831 1.00 0.19 H new ATOM 0 HA LEU D 350 -4.781 -14.824 0.723 1.00 0.21 H new ATOM 0 HB2 LEU D 350 -3.786 -13.057 -0.947 1.00 0.24 H new ATOM 0 HB3 LEU D 350 -2.340 -13.147 0.038 1.00 0.24 H new ATOM 0 HG LEU D 350 -3.734 -15.573 -1.191 1.00 0.29 H new ATOM 0 HD11 LEU D 350 -1.815 -15.609 -2.755 1.00 0.43 H new ATOM 0 HD12 LEU D 350 -2.743 -14.100 -2.916 1.00 0.43 H new ATOM 0 HD13 LEU D 350 -1.197 -14.104 -2.034 1.00 0.43 H new ATOM 0 HD21 LEU D 350 -1.646 -16.743 -0.532 1.00 0.38 H new ATOM 0 HD22 LEU D 350 -1.033 -15.238 0.195 1.00 0.38 H new ATOM 0 HD23 LEU D 350 -2.461 -16.043 0.887 1.00 0.38 H new ATOM 2659 N LYS D 351 -2.513 -13.515 2.736 1.00 0.22 N ATOM 2660 CA LYS D 351 -1.609 -13.858 3.868 1.00 0.24 C ATOM 2661 C LYS D 351 -2.420 -14.490 5.002 1.00 0.28 C ATOM 2662 O LYS D 351 -2.026 -15.482 5.581 1.00 0.33 O ATOM 2663 CB LYS D 351 -0.924 -12.586 4.375 1.00 0.25 C ATOM 2664 CG LYS D 351 0.258 -12.965 5.266 1.00 0.28 C ATOM 2665 CD LYS D 351 0.888 -11.698 5.843 1.00 0.30 C ATOM 2666 CE LYS D 351 2.411 -11.844 5.848 1.00 0.35 C ATOM 2667 NZ LYS D 351 2.952 -11.455 4.516 1.00 1.40 N ATOM 0 H LYS D 351 -2.555 -12.523 2.503 1.00 0.22 H new ATOM 0 HA LYS D 351 -0.855 -14.567 3.527 1.00 0.24 H new ATOM 0 HB2 LYS D 351 -0.581 -11.985 3.533 1.00 0.25 H new ATOM 0 HB3 LYS D 351 -1.634 -11.976 4.934 1.00 0.25 H new ATOM 0 HG2 LYS D 351 -0.076 -13.618 6.073 1.00 0.28 H new ATOM 0 HG3 LYS D 351 0.997 -13.522 4.690 1.00 0.28 H new ATOM 0 HD2 LYS D 351 0.597 -10.831 5.250 1.00 0.30 H new ATOM 0 HD3 LYS D 351 0.525 -11.527 6.856 1.00 0.30 H new ATOM 0 HE2 LYS D 351 2.845 -11.216 6.626 1.00 0.35 H new ATOM 0 HE3 LYS D 351 2.688 -12.873 6.078 1.00 0.35 H new ATOM 0 HZ1 LYS D 351 3.962 -11.226 4.605 1.00 1.40 H new ATOM 0 HZ2 LYS D 351 2.834 -12.244 3.849 1.00 1.40 H new ATOM 0 HZ3 LYS D 351 2.438 -10.623 4.162 1.00 1.40 H new ATOM 2681 N ASP D 352 -3.549 -13.919 5.324 1.00 0.29 N ATOM 2682 CA ASP D 352 -4.387 -14.480 6.423 1.00 0.36 C ATOM 2683 C ASP D 352 -4.707 -15.948 6.130 1.00 0.39 C ATOM 2684 O ASP D 352 -4.758 -16.773 7.021 1.00 0.47 O ATOM 2685 CB ASP D 352 -5.691 -13.686 6.522 1.00 0.40 C ATOM 2686 CG ASP D 352 -5.424 -12.346 7.211 1.00 0.44 C ATOM 2687 OD1 ASP D 352 -4.311 -11.857 7.100 1.00 1.08 O ATOM 2688 OD2 ASP D 352 -6.336 -11.831 7.836 1.00 1.17 O ATOM 0 H ASP D 352 -3.928 -13.087 4.873 1.00 0.29 H new ATOM 0 HA ASP D 352 -3.842 -14.410 7.365 1.00 0.36 H new ATOM 0 HB2 ASP D 352 -6.104 -13.519 5.527 1.00 0.40 H new ATOM 0 HB3 ASP D 352 -6.433 -14.254 7.084 1.00 0.40 H new ATOM 2693 N ALA D 353 -4.928 -16.278 4.889 1.00 0.37 N ATOM 2694 CA ALA D 353 -5.250 -17.689 4.536 1.00 0.44 C ATOM 2695 C ALA D 353 -4.034 -18.580 4.807 1.00 0.49 C ATOM 2696 O ALA D 353 -4.165 -19.745 5.128 1.00 0.59 O ATOM 2697 CB ALA D 353 -5.616 -17.766 3.053 1.00 0.44 C ATOM 0 H ALA D 353 -4.900 -15.630 4.102 1.00 0.37 H new ATOM 0 HA ALA D 353 -6.089 -18.032 5.141 1.00 0.44 H new ATOM 0 HB1 ALA D 353 -5.853 -18.797 2.790 1.00 0.44 H new ATOM 0 HB2 ALA D 353 -6.483 -17.134 2.859 1.00 0.44 H new ATOM 0 HB3 ALA D 353 -4.774 -17.422 2.452 1.00 0.44 H new ATOM 2703 N GLN D 354 -2.854 -18.042 4.680 1.00 0.45 N ATOM 2704 CA GLN D 354 -1.633 -18.858 4.929 1.00 0.53 C ATOM 2705 C GLN D 354 -1.343 -18.903 6.431 1.00 0.58 C ATOM 2706 O GLN D 354 -0.447 -19.591 6.881 1.00 0.73 O ATOM 2707 CB GLN D 354 -0.443 -18.233 4.197 1.00 0.50 C ATOM 2708 CG GLN D 354 0.329 -19.324 3.456 1.00 1.12 C ATOM 2709 CD GLN D 354 1.232 -18.689 2.394 1.00 1.06 C ATOM 2710 OE1 GLN D 354 1.591 -17.441 2.519 1.00 1.44 O flip ATOM 2711 NE2 GLN D 354 1.618 -19.338 1.442 1.00 0.70 N flip ATOM 0 H GLN D 354 -2.682 -17.072 4.415 1.00 0.45 H new ATOM 0 HA GLN D 354 -1.794 -19.871 4.562 1.00 0.53 H new ATOM 0 HB2 GLN D 354 -0.791 -17.477 3.493 1.00 0.50 H new ATOM 0 HB3 GLN D 354 0.211 -17.729 4.908 1.00 0.50 H new ATOM 0 HG2 GLN D 354 0.929 -19.900 4.160 1.00 1.12 H new ATOM 0 HG3 GLN D 354 -0.366 -20.020 2.987 1.00 1.12 H new ATOM 0 HE21 GLN D 354 1.338 -20.314 1.343 1.00 0.70 H new ATOM 0 HE22 GLN D 354 2.222 -18.907 0.742 1.00 0.70 H new