USER MOD reduce.3.24.130724 H: found=0, std=0, add=479, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 478 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 307 HIS : no HD1:sc= -0.0212 X(o=-0.021,f=-0.16) USER MOD Single : A 308 ASN : amide:sc= -4.22! K(o=-4.2!,f=-1.7) USER MOD Single : A 311 SER OG : rot 180:sc= 0 USER MOD Single : A 313 SER OG : rot 160:sc= -0.431 USER MOD Single : A 314 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 316 TYR OH : rot 180:sc= 0 USER MOD Single : A 317 ASN : amide:sc= -0.118 K(o=-0.12,f=-2.4!) USER MOD Single : A 318 ASN : amide:sc= -3.63! C(o=-3.6!,f=-2.7!) USER MOD Single : A 320 THR OG1 : rot 180:sc= -0.314 USER MOD Single : A 334 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 337 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 340 SER OG : rot 180:sc= -0.0676 USER MOD Single : A 341 GLN : amide:sc= -0.0258 X(o=-0.026,f=0) USER MOD Single : A 342 MET CE :methyl 167:sc= -5.26! (180deg=-6.06!) USER MOD Single : A 344 THR OG1 : rot 88:sc= 0.512 USER MOD Single : A 348 MET CE :methyl 160:sc= -4.81! (180deg=-6.11!) USER MOD Single : A 349 ASN : amide:sc=-0.000641 X(o=-0.00064,f=0) USER MOD Single : A 354 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 360 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD ----------------------------------------------------------------- ATOM 145 N ARG A 302 7.387 15.071 -6.759 1.00 0.00 N ATOM 146 CA ARG A 302 6.832 13.751 -7.002 1.00 0.00 C ATOM 147 C ARG A 302 7.929 12.689 -6.911 1.00 0.00 C ATOM 148 O ARG A 302 7.720 11.622 -6.335 1.00 0.00 O ATOM 149 CB ARG A 302 6.171 13.675 -8.380 1.00 0.00 C ATOM 150 CG ARG A 302 4.868 12.876 -8.320 1.00 0.00 C ATOM 151 CD ARG A 302 3.739 13.712 -7.715 1.00 0.00 C ATOM 152 NE ARG A 302 2.643 13.871 -8.697 1.00 0.00 N ATOM 153 CZ ARG A 302 1.684 12.958 -8.906 1.00 0.00 C ATOM 154 NH1 ARG A 302 1.680 11.818 -8.203 1.00 0.00 N ATOM 155 NH2 ARG A 302 0.730 13.187 -9.818 1.00 0.00 N ATOM 0 HA ARG A 302 6.076 13.564 -6.239 1.00 0.00 H new ATOM 0 HB2 ARG A 302 5.968 14.682 -8.746 1.00 0.00 H new ATOM 0 HB3 ARG A 302 6.855 13.210 -9.090 1.00 0.00 H new ATOM 0 HG2 ARG A 302 4.589 12.553 -9.323 1.00 0.00 H new ATOM 0 HG3 ARG A 302 5.017 11.975 -7.725 1.00 0.00 H new ATOM 0 HD2 ARG A 302 3.362 13.230 -6.813 1.00 0.00 H new ATOM 0 HD3 ARG A 302 4.118 14.690 -7.420 1.00 0.00 H new ATOM 0 HE ARG A 302 2.616 14.728 -9.249 1.00 0.00 H new ATOM 0 HH11 ARG A 302 2.407 11.645 -7.509 1.00 0.00 H new ATOM 0 HH12 ARG A 302 0.950 11.123 -8.362 1.00 0.00 H new ATOM 0 HH21 ARG A 302 0.734 14.056 -10.353 1.00 0.00 H new ATOM 0 HH22 ARG A 302 -0.000 12.493 -9.978 1.00 0.00 H new ATOM 169 N ALA A 303 9.075 13.017 -7.489 1.00 0.00 N ATOM 170 CA ALA A 303 10.206 12.104 -7.481 1.00 0.00 C ATOM 171 C ALA A 303 10.608 11.811 -6.034 1.00 0.00 C ATOM 172 O ALA A 303 11.046 10.705 -5.720 1.00 0.00 O ATOM 173 CB ALA A 303 11.354 12.706 -8.294 1.00 0.00 C ATOM 0 H ALA A 303 9.245 13.902 -7.966 1.00 0.00 H new ATOM 0 HA ALA A 303 9.938 11.156 -7.948 1.00 0.00 H new ATOM 0 HB1 ALA A 303 12.202 12.021 -8.288 1.00 0.00 H new ATOM 0 HB2 ALA A 303 11.026 12.869 -9.321 1.00 0.00 H new ATOM 0 HB3 ALA A 303 11.652 13.657 -7.853 1.00 0.00 H new ATOM 179 N VAL A 304 10.445 12.820 -5.191 1.00 0.00 N ATOM 180 CA VAL A 304 10.785 12.684 -3.786 1.00 0.00 C ATOM 181 C VAL A 304 9.768 11.765 -3.105 1.00 0.00 C ATOM 182 O VAL A 304 10.144 10.863 -2.358 1.00 0.00 O ATOM 183 CB VAL A 304 10.874 14.065 -3.133 1.00 0.00 C ATOM 184 CG1 VAL A 304 10.909 13.949 -1.607 1.00 0.00 C ATOM 185 CG2 VAL A 304 12.086 14.840 -3.652 1.00 0.00 C ATOM 0 H VAL A 304 10.082 13.736 -5.455 1.00 0.00 H new ATOM 0 HA VAL A 304 11.766 12.222 -3.674 1.00 0.00 H new ATOM 0 HB VAL A 304 9.978 14.623 -3.406 1.00 0.00 H new ATOM 0 HG11 VAL A 304 10.972 14.945 -1.168 1.00 0.00 H new ATOM 0 HG12 VAL A 304 10.002 13.456 -1.259 1.00 0.00 H new ATOM 0 HG13 VAL A 304 11.778 13.364 -1.306 1.00 0.00 H new ATOM 0 HG21 VAL A 304 12.126 15.818 -3.172 1.00 0.00 H new ATOM 0 HG22 VAL A 304 12.997 14.286 -3.424 1.00 0.00 H new ATOM 0 HG23 VAL A 304 12.001 14.969 -4.731 1.00 0.00 H new ATOM 195 N ILE A 305 8.501 12.026 -3.389 1.00 0.00 N ATOM 196 CA ILE A 305 7.427 11.234 -2.814 1.00 0.00 C ATOM 197 C ILE A 305 7.567 9.782 -3.275 1.00 0.00 C ATOM 198 O ILE A 305 7.436 8.857 -2.475 1.00 0.00 O ATOM 199 CB ILE A 305 6.068 11.855 -3.142 1.00 0.00 C ATOM 200 CG1 ILE A 305 5.944 13.254 -2.535 1.00 0.00 C ATOM 201 CG2 ILE A 305 4.925 10.937 -2.704 1.00 0.00 C ATOM 202 CD1 ILE A 305 5.419 14.255 -3.566 1.00 0.00 C ATOM 0 H ILE A 305 8.194 12.775 -4.010 1.00 0.00 H new ATOM 0 HA ILE A 305 7.496 11.232 -1.726 1.00 0.00 H new ATOM 0 HB ILE A 305 5.995 11.965 -4.224 1.00 0.00 H new ATOM 0 HG12 ILE A 305 5.272 13.224 -1.677 1.00 0.00 H new ATOM 0 HG13 ILE A 305 6.916 13.582 -2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 305 3.970 11.402 -2.949 1.00 0.00 H new ATOM 0 HG22 ILE A 305 5.007 9.982 -3.222 1.00 0.00 H new ATOM 0 HG23 ILE A 305 4.983 10.772 -1.628 1.00 0.00 H new ATOM 0 HD11 ILE A 305 5.340 15.241 -3.108 1.00 0.00 H new ATOM 0 HD12 ILE A 305 6.106 14.301 -4.411 1.00 0.00 H new ATOM 0 HD13 ILE A 305 4.436 13.937 -3.914 1.00 0.00 H new ATOM 214 N GLU A 306 7.831 9.627 -4.564 1.00 0.00 N ATOM 215 CA GLU A 306 7.990 8.304 -5.142 1.00 0.00 C ATOM 216 C GLU A 306 9.141 7.562 -4.460 1.00 0.00 C ATOM 217 O GLU A 306 8.995 6.404 -4.072 1.00 0.00 O ATOM 218 CB GLU A 306 8.211 8.388 -6.654 1.00 0.00 C ATOM 219 CG GLU A 306 6.899 8.681 -7.384 1.00 0.00 C ATOM 220 CD GLU A 306 6.795 7.865 -8.674 1.00 0.00 C ATOM 221 OE1 GLU A 306 7.831 7.281 -9.061 1.00 0.00 O ATOM 222 OE2 GLU A 306 5.683 7.844 -9.244 1.00 0.00 O ATOM 0 H GLU A 306 7.939 10.397 -5.225 1.00 0.00 H new ATOM 0 HA GLU A 306 7.071 7.743 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 306 8.937 9.170 -6.876 1.00 0.00 H new ATOM 0 HB3 GLU A 306 8.631 7.450 -7.016 1.00 0.00 H new ATOM 0 HG2 GLU A 306 6.057 8.448 -6.733 1.00 0.00 H new ATOM 0 HG3 GLU A 306 6.837 9.744 -7.616 1.00 0.00 H new ATOM 229 N HIS A 307 10.261 8.259 -4.335 1.00 0.00 N ATOM 230 CA HIS A 307 11.437 7.681 -3.707 1.00 0.00 C ATOM 231 C HIS A 307 11.180 7.497 -2.210 1.00 0.00 C ATOM 232 O HIS A 307 11.525 6.463 -1.640 1.00 0.00 O ATOM 233 CB HIS A 307 12.678 8.527 -3.996 1.00 0.00 C ATOM 234 CG HIS A 307 13.982 7.795 -3.785 1.00 0.00 C ATOM 235 ND1 HIS A 307 14.289 6.609 -4.430 1.00 0.00 N ATOM 236 CD2 HIS A 307 15.055 8.093 -2.997 1.00 0.00 C ATOM 237 CE1 HIS A 307 15.494 6.220 -4.039 1.00 0.00 C ATOM 238 NE2 HIS A 307 15.966 7.141 -3.150 1.00 0.00 N ATOM 0 H HIS A 307 10.379 9.219 -4.658 1.00 0.00 H new ATOM 0 HA HIS A 307 11.634 6.696 -4.131 1.00 0.00 H new ATOM 0 HB2 HIS A 307 12.633 8.879 -5.027 1.00 0.00 H new ATOM 0 HB3 HIS A 307 12.661 9.410 -3.356 1.00 0.00 H new ATOM 0 HD2 HIS A 307 15.147 8.958 -2.357 1.00 0.00 H new ATOM 0 HE1 HIS A 307 16.011 5.330 -4.366 1.00 0.00 H new ATOM 0 HE2 HIS A 307 16.871 7.104 -2.680 1.00 0.00 H new ATOM 246 N ASN A 308 10.577 8.516 -1.615 1.00 0.00 N ATOM 247 CA ASN A 308 10.270 8.479 -0.196 1.00 0.00 C ATOM 248 C ASN A 308 9.454 7.222 0.113 1.00 0.00 C ATOM 249 O ASN A 308 9.651 6.589 1.149 1.00 0.00 O ATOM 250 CB ASN A 308 9.440 9.696 0.220 1.00 0.00 C ATOM 251 CG ASN A 308 10.317 10.753 0.894 1.00 0.00 C ATOM 252 OD1 ASN A 308 10.978 10.506 1.889 1.00 0.00 O ATOM 253 ND2 ASN A 308 10.285 11.942 0.298 1.00 0.00 N ATOM 0 H ASN A 308 10.293 9.372 -2.091 1.00 0.00 H new ATOM 0 HA ASN A 308 11.212 8.480 0.353 1.00 0.00 H new ATOM 0 HB2 ASN A 308 8.954 10.126 -0.656 1.00 0.00 H new ATOM 0 HB3 ASN A 308 8.649 9.385 0.903 1.00 0.00 H new ATOM 0 HD21 ASN A 308 10.836 12.715 0.672 1.00 0.00 H new ATOM 0 HD22 ASN A 308 9.710 12.081 -0.533 1.00 0.00 H new ATOM 260 N LEU A 309 8.555 6.899 -0.805 1.00 0.00 N ATOM 261 CA LEU A 309 7.708 5.729 -0.643 1.00 0.00 C ATOM 262 C LEU A 309 8.578 4.471 -0.646 1.00 0.00 C ATOM 263 O LEU A 309 8.459 3.628 0.242 1.00 0.00 O ATOM 264 CB LEU A 309 6.605 5.716 -1.703 1.00 0.00 C ATOM 265 CG LEU A 309 5.338 6.504 -1.363 1.00 0.00 C ATOM 266 CD1 LEU A 309 4.849 7.304 -2.572 1.00 0.00 C ATOM 267 CD2 LEU A 309 4.251 5.582 -0.808 1.00 0.00 C ATOM 0 H LEU A 309 8.395 7.427 -1.663 1.00 0.00 H new ATOM 0 HA LEU A 309 7.195 5.760 0.318 1.00 0.00 H new ATOM 0 HB2 LEU A 309 7.016 6.111 -2.632 1.00 0.00 H new ATOM 0 HB3 LEU A 309 6.324 4.680 -1.894 1.00 0.00 H new ATOM 0 HG LEU A 309 5.582 7.221 -0.580 1.00 0.00 H new ATOM 0 HD11 LEU A 309 3.948 7.855 -2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 309 5.624 8.005 -2.882 1.00 0.00 H new ATOM 0 HD13 LEU A 309 4.627 6.623 -3.393 1.00 0.00 H new ATOM 0 HD21 LEU A 309 3.362 6.167 -0.575 1.00 0.00 H new ATOM 0 HD22 LEU A 309 4.002 4.824 -1.551 1.00 0.00 H new ATOM 0 HD23 LEU A 309 4.614 5.096 0.098 1.00 0.00 H new ATOM 279 N LEU A 310 9.434 4.383 -1.654 1.00 0.00 N ATOM 280 CA LEU A 310 10.323 3.242 -1.783 1.00 0.00 C ATOM 281 C LEU A 310 11.234 3.169 -0.556 1.00 0.00 C ATOM 282 O LEU A 310 11.426 2.096 0.015 1.00 0.00 O ATOM 283 CB LEU A 310 11.083 3.303 -3.110 1.00 0.00 C ATOM 284 CG LEU A 310 10.293 2.896 -4.355 1.00 0.00 C ATOM 285 CD1 LEU A 310 10.570 1.439 -4.728 1.00 0.00 C ATOM 286 CD2 LEU A 310 8.798 3.166 -4.168 1.00 0.00 C ATOM 0 H LEU A 310 9.530 5.084 -2.389 1.00 0.00 H new ATOM 0 HA LEU A 310 9.751 2.315 -1.811 1.00 0.00 H new ATOM 0 HB2 LEU A 310 11.446 4.321 -3.251 1.00 0.00 H new ATOM 0 HB3 LEU A 310 11.959 2.659 -3.034 1.00 0.00 H new ATOM 0 HG LEU A 310 10.630 3.511 -5.190 1.00 0.00 H new ATOM 0 HD11 LEU A 310 9.996 1.175 -5.616 1.00 0.00 H new ATOM 0 HD12 LEU A 310 11.633 1.311 -4.932 1.00 0.00 H new ATOM 0 HD13 LEU A 310 10.279 0.790 -3.902 1.00 0.00 H new ATOM 0 HD21 LEU A 310 8.259 2.868 -5.067 1.00 0.00 H new ATOM 0 HD22 LEU A 310 8.429 2.594 -3.317 1.00 0.00 H new ATOM 0 HD23 LEU A 310 8.640 4.229 -3.986 1.00 0.00 H new ATOM 298 N SER A 311 11.770 4.323 -0.186 1.00 0.00 N ATOM 299 CA SER A 311 12.655 4.403 0.963 1.00 0.00 C ATOM 300 C SER A 311 11.918 3.948 2.224 1.00 0.00 C ATOM 301 O SER A 311 12.494 3.268 3.072 1.00 0.00 O ATOM 302 CB SER A 311 13.193 5.823 1.146 1.00 0.00 C ATOM 303 OG SER A 311 14.617 5.856 1.171 1.00 0.00 O ATOM 0 H SER A 311 11.608 5.210 -0.662 1.00 0.00 H new ATOM 0 HA SER A 311 13.504 3.742 0.787 1.00 0.00 H new ATOM 0 HB2 SER A 311 12.830 6.455 0.336 1.00 0.00 H new ATOM 0 HB3 SER A 311 12.804 6.241 2.075 1.00 0.00 H new ATOM 0 HG SER A 311 14.921 6.780 1.288 1.00 0.00 H new ATOM 309 N ALA A 312 10.656 4.341 2.308 1.00 0.00 N ATOM 310 CA ALA A 312 9.834 3.982 3.451 1.00 0.00 C ATOM 311 C ALA A 312 9.567 2.475 3.428 1.00 0.00 C ATOM 312 O ALA A 312 9.249 1.882 4.458 1.00 0.00 O ATOM 313 CB ALA A 312 8.544 4.803 3.431 1.00 0.00 C ATOM 0 H ALA A 312 10.182 4.905 1.603 1.00 0.00 H new ATOM 0 HA ALA A 312 10.351 4.211 4.383 1.00 0.00 H new ATOM 0 HB1 ALA A 312 7.928 4.533 4.289 1.00 0.00 H new ATOM 0 HB2 ALA A 312 8.787 5.864 3.479 1.00 0.00 H new ATOM 0 HB3 ALA A 312 7.996 4.597 2.511 1.00 0.00 H new ATOM 319 N SER A 313 9.705 1.900 2.243 1.00 0.00 N ATOM 320 CA SER A 313 9.482 0.474 2.073 1.00 0.00 C ATOM 321 C SER A 313 10.442 -0.315 2.965 1.00 0.00 C ATOM 322 O SER A 313 10.036 -1.268 3.629 1.00 0.00 O ATOM 323 CB SER A 313 9.656 0.061 0.610 1.00 0.00 C ATOM 324 OG SER A 313 8.941 -1.134 0.305 1.00 0.00 O ATOM 0 H SER A 313 9.968 2.395 1.391 1.00 0.00 H new ATOM 0 HA SER A 313 8.456 0.250 2.366 1.00 0.00 H new ATOM 0 HB2 SER A 313 9.310 0.866 -0.038 1.00 0.00 H new ATOM 0 HB3 SER A 313 10.715 -0.086 0.398 1.00 0.00 H new ATOM 0 HG SER A 313 8.804 -1.195 -0.663 1.00 0.00 H new ATOM 330 N LYS A 314 11.697 0.110 2.952 1.00 0.00 N ATOM 331 CA LYS A 314 12.718 -0.546 3.751 1.00 0.00 C ATOM 332 C LYS A 314 12.776 0.109 5.133 1.00 0.00 C ATOM 333 O LYS A 314 13.029 -0.562 6.132 1.00 0.00 O ATOM 334 CB LYS A 314 14.058 -0.546 3.014 1.00 0.00 C ATOM 335 CG LYS A 314 14.714 0.836 3.067 1.00 0.00 C ATOM 336 CD LYS A 314 15.328 1.204 1.715 1.00 0.00 C ATOM 337 CE LYS A 314 15.502 2.718 1.586 1.00 0.00 C ATOM 338 NZ LYS A 314 16.859 3.122 2.016 1.00 0.00 N ATOM 0 H LYS A 314 12.030 0.901 2.401 1.00 0.00 H new ATOM 0 HA LYS A 314 12.466 -1.595 3.905 1.00 0.00 H new ATOM 0 HB2 LYS A 314 14.723 -1.285 3.461 1.00 0.00 H new ATOM 0 HB3 LYS A 314 13.906 -0.841 1.976 1.00 0.00 H new ATOM 0 HG2 LYS A 314 13.973 1.584 3.349 1.00 0.00 H new ATOM 0 HG3 LYS A 314 15.486 0.847 3.836 1.00 0.00 H new ATOM 0 HD2 LYS A 314 16.295 0.713 1.605 1.00 0.00 H new ATOM 0 HD3 LYS A 314 14.691 0.838 0.910 1.00 0.00 H new ATOM 0 HE2 LYS A 314 15.336 3.022 0.553 1.00 0.00 H new ATOM 0 HE3 LYS A 314 14.755 3.229 2.193 1.00 0.00 H new ATOM 0 HZ1 LYS A 314 16.960 4.153 1.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 314 17.004 2.849 3.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 314 17.567 2.649 1.420 1.00 0.00 H new ATOM 352 N LEU A 315 12.538 1.412 5.145 1.00 0.00 N ATOM 353 CA LEU A 315 12.560 2.166 6.387 1.00 0.00 C ATOM 354 C LEU A 315 11.357 1.765 7.243 1.00 0.00 C ATOM 355 O LEU A 315 11.492 0.983 8.183 1.00 0.00 O ATOM 356 CB LEU A 315 12.640 3.667 6.103 1.00 0.00 C ATOM 357 CG LEU A 315 14.048 4.261 6.028 1.00 0.00 C ATOM 358 CD1 LEU A 315 14.070 5.509 5.143 1.00 0.00 C ATOM 359 CD2 LEU A 315 14.600 4.541 7.427 1.00 0.00 C ATOM 0 H LEU A 315 12.329 1.965 4.314 1.00 0.00 H new ATOM 0 HA LEU A 315 13.455 1.927 6.961 1.00 0.00 H new ATOM 0 HB2 LEU A 315 12.133 3.866 5.159 1.00 0.00 H new ATOM 0 HB3 LEU A 315 12.086 4.194 6.880 1.00 0.00 H new ATOM 0 HG LEU A 315 14.705 3.525 5.564 1.00 0.00 H new ATOM 0 HD11 LEU A 315 15.082 5.911 5.107 1.00 0.00 H new ATOM 0 HD12 LEU A 315 13.748 5.246 4.135 1.00 0.00 H new ATOM 0 HD13 LEU A 315 13.396 6.260 5.556 1.00 0.00 H new ATOM 0 HD21 LEU A 315 15.602 4.963 7.345 1.00 0.00 H new ATOM 0 HD22 LEU A 315 13.949 5.249 7.940 1.00 0.00 H new ATOM 0 HD23 LEU A 315 14.643 3.611 7.994 1.00 0.00 H new ATOM 371 N TYR A 316 10.207 2.320 6.887 1.00 0.00 N ATOM 372 CA TYR A 316 8.981 2.030 7.611 1.00 0.00 C ATOM 373 C TYR A 316 8.400 0.680 7.187 1.00 0.00 C ATOM 374 O TYR A 316 8.103 0.469 6.012 1.00 0.00 O ATOM 375 CB TYR A 316 7.996 3.138 7.232 1.00 0.00 C ATOM 376 CG TYR A 316 8.392 4.524 7.743 1.00 0.00 C ATOM 377 CD1 TYR A 316 9.304 5.285 7.039 1.00 0.00 C ATOM 378 CD2 TYR A 316 7.837 5.015 8.907 1.00 0.00 C ATOM 379 CE1 TYR A 316 9.676 6.590 7.520 1.00 0.00 C ATOM 380 CE2 TYR A 316 8.209 6.320 9.388 1.00 0.00 C ATOM 381 CZ TYR A 316 9.111 7.043 8.671 1.00 0.00 C ATOM 382 OH TYR A 316 9.462 8.276 9.125 1.00 0.00 O ATOM 0 H TYR A 316 10.099 2.969 6.107 1.00 0.00 H new ATOM 0 HA TYR A 316 9.169 1.987 8.684 1.00 0.00 H new ATOM 0 HB2 TYR A 316 7.906 3.174 6.146 1.00 0.00 H new ATOM 0 HB3 TYR A 316 7.011 2.885 7.625 1.00 0.00 H new ATOM 0 HD1 TYR A 316 9.738 4.901 6.128 1.00 0.00 H new ATOM 0 HD2 TYR A 316 7.123 4.420 9.457 1.00 0.00 H new ATOM 0 HE1 TYR A 316 10.388 7.196 6.979 1.00 0.00 H new ATOM 0 HE2 TYR A 316 7.782 6.716 10.297 1.00 0.00 H new ATOM 0 HH TYR A 316 8.979 8.468 9.956 1.00 0.00 H new ATOM 392 N ASN A 317 8.255 -0.200 8.167 1.00 0.00 N ATOM 393 CA ASN A 317 7.715 -1.524 7.910 1.00 0.00 C ATOM 394 C ASN A 317 6.278 -1.394 7.400 1.00 0.00 C ATOM 395 O ASN A 317 5.872 -2.112 6.488 1.00 0.00 O ATOM 396 CB ASN A 317 7.689 -2.366 9.187 1.00 0.00 C ATOM 397 CG ASN A 317 9.108 -2.680 9.666 1.00 0.00 C ATOM 398 OD1 ASN A 317 9.979 -1.827 9.710 1.00 0.00 O ATOM 399 ND2 ASN A 317 9.290 -3.949 10.021 1.00 0.00 N ATOM 0 H ASN A 317 8.502 -0.022 9.140 1.00 0.00 H new ATOM 0 HA ASN A 317 8.352 -2.010 7.171 1.00 0.00 H new ATOM 0 HB2 ASN A 317 7.148 -1.832 9.968 1.00 0.00 H new ATOM 0 HB3 ASN A 317 7.149 -3.295 9.003 1.00 0.00 H new ATOM 0 HD21 ASN A 317 10.203 -4.259 10.355 1.00 0.00 H new ATOM 0 HD22 ASN A 317 8.517 -4.612 9.959 1.00 0.00 H new ATOM 406 N ASN A 318 5.548 -0.472 8.012 1.00 0.00 N ATOM 407 CA ASN A 318 4.166 -0.239 7.632 1.00 0.00 C ATOM 408 C ASN A 318 3.746 1.161 8.085 1.00 0.00 C ATOM 409 O ASN A 318 4.042 1.569 9.207 1.00 0.00 O ATOM 410 CB ASN A 318 3.232 -1.251 8.299 1.00 0.00 C ATOM 411 CG ASN A 318 3.972 -2.553 8.616 1.00 0.00 C ATOM 412 OD1 ASN A 318 4.449 -2.774 9.716 1.00 0.00 O ATOM 413 ND2 ASN A 318 4.040 -3.399 7.592 1.00 0.00 N ATOM 0 H ASN A 318 5.888 0.122 8.768 1.00 0.00 H new ATOM 0 HA ASN A 318 4.093 -0.340 6.549 1.00 0.00 H new ATOM 0 HB2 ASN A 318 2.826 -0.826 9.217 1.00 0.00 H new ATOM 0 HB3 ASN A 318 2.387 -1.459 7.643 1.00 0.00 H new ATOM 0 HD21 ASN A 318 4.513 -4.296 7.702 1.00 0.00 H new ATOM 0 HD22 ASN A 318 3.619 -3.151 6.697 1.00 0.00 H new ATOM 420 N ILE A 319 3.063 1.858 7.189 1.00 0.00 N ATOM 421 CA ILE A 319 2.600 3.204 7.482 1.00 0.00 C ATOM 422 C ILE A 319 1.264 3.444 6.777 1.00 0.00 C ATOM 423 O ILE A 319 1.028 2.918 5.690 1.00 0.00 O ATOM 424 CB ILE A 319 3.677 4.231 7.126 1.00 0.00 C ATOM 425 CG1 ILE A 319 3.256 5.638 7.556 1.00 0.00 C ATOM 426 CG2 ILE A 319 4.025 4.166 5.638 1.00 0.00 C ATOM 427 CD1 ILE A 319 4.383 6.645 7.316 1.00 0.00 C ATOM 0 H ILE A 319 2.819 1.516 6.260 1.00 0.00 H new ATOM 0 HA ILE A 319 2.422 3.321 8.551 1.00 0.00 H new ATOM 0 HB ILE A 319 4.583 3.983 7.679 1.00 0.00 H new ATOM 0 HG12 ILE A 319 2.368 5.941 7.001 1.00 0.00 H new ATOM 0 HG13 ILE A 319 2.986 5.634 8.612 1.00 0.00 H new ATOM 0 HG21 ILE A 319 4.793 4.906 5.411 1.00 0.00 H new ATOM 0 HG22 ILE A 319 4.397 3.171 5.394 1.00 0.00 H new ATOM 0 HG23 ILE A 319 3.134 4.375 5.046 1.00 0.00 H new ATOM 0 HD11 ILE A 319 4.058 7.637 7.630 1.00 0.00 H new ATOM 0 HD12 ILE A 319 5.261 6.352 7.891 1.00 0.00 H new ATOM 0 HD13 ILE A 319 4.634 6.664 6.255 1.00 0.00 H new ATOM 439 N THR A 320 0.424 4.239 7.424 1.00 0.00 N ATOM 440 CA THR A 320 -0.882 4.555 6.872 1.00 0.00 C ATOM 441 C THR A 320 -0.790 5.769 5.946 1.00 0.00 C ATOM 442 O THR A 320 0.210 6.484 5.951 1.00 0.00 O ATOM 443 CB THR A 320 -1.853 4.752 8.038 1.00 0.00 C ATOM 444 OG1 THR A 320 -3.095 5.056 7.408 1.00 0.00 O ATOM 445 CG2 THR A 320 -1.536 6.004 8.859 1.00 0.00 C ATOM 0 H THR A 320 0.623 4.673 8.325 1.00 0.00 H new ATOM 0 HA THR A 320 -1.257 3.741 6.252 1.00 0.00 H new ATOM 0 HB THR A 320 -1.824 3.876 8.686 1.00 0.00 H new ATOM 0 HG1 THR A 320 -3.783 5.197 8.092 1.00 0.00 H new ATOM 0 HG21 THR A 320 -2.255 6.097 9.673 1.00 0.00 H new ATOM 0 HG22 THR A 320 -0.530 5.924 9.270 1.00 0.00 H new ATOM 0 HG23 THR A 320 -1.598 6.884 8.219 1.00 0.00 H new ATOM 453 N PHE A 321 -1.848 5.965 5.172 1.00 0.00 N ATOM 454 CA PHE A 321 -1.900 7.080 4.243 1.00 0.00 C ATOM 455 C PHE A 321 -1.738 8.413 4.976 1.00 0.00 C ATOM 456 O PHE A 321 -1.088 9.328 4.473 1.00 0.00 O ATOM 457 CB PHE A 321 -3.276 7.043 3.575 1.00 0.00 C ATOM 458 CG PHE A 321 -3.648 5.677 2.994 1.00 0.00 C ATOM 459 CD1 PHE A 321 -2.926 5.156 1.966 1.00 0.00 C ATOM 460 CD2 PHE A 321 -4.702 4.986 3.505 1.00 0.00 C ATOM 461 CE1 PHE A 321 -3.272 3.888 1.427 1.00 0.00 C ATOM 462 CE2 PHE A 321 -5.047 3.718 2.966 1.00 0.00 C ATOM 463 CZ PHE A 321 -4.325 3.196 1.938 1.00 0.00 C ATOM 0 H PHE A 321 -2.676 5.369 5.170 1.00 0.00 H new ATOM 0 HA PHE A 321 -1.092 6.995 3.516 1.00 0.00 H new ATOM 0 HB2 PHE A 321 -4.031 7.334 4.305 1.00 0.00 H new ATOM 0 HB3 PHE A 321 -3.302 7.785 2.777 1.00 0.00 H new ATOM 0 HD1 PHE A 321 -2.090 5.706 1.560 1.00 0.00 H new ATOM 0 HD2 PHE A 321 -5.276 5.401 4.320 1.00 0.00 H new ATOM 0 HE1 PHE A 321 -2.698 3.474 0.611 1.00 0.00 H new ATOM 0 HE2 PHE A 321 -5.883 3.168 3.372 1.00 0.00 H new ATOM 0 HZ PHE A 321 -4.588 2.232 1.528 1.00 0.00 H new ATOM 473 N GLU A 322 -2.341 8.481 6.154 1.00 0.00 N ATOM 474 CA GLU A 322 -2.272 9.687 6.962 1.00 0.00 C ATOM 475 C GLU A 322 -0.823 9.982 7.352 1.00 0.00 C ATOM 476 O GLU A 322 -0.350 11.106 7.192 1.00 0.00 O ATOM 477 CB GLU A 322 -3.161 9.567 8.202 1.00 0.00 C ATOM 478 CG GLU A 322 -4.640 9.521 7.814 1.00 0.00 C ATOM 479 CD GLU A 322 -5.499 9.041 8.986 1.00 0.00 C ATOM 480 OE1 GLU A 322 -5.475 9.731 10.028 1.00 0.00 O ATOM 481 OE2 GLU A 322 -6.160 7.994 8.813 1.00 0.00 O ATOM 0 H GLU A 322 -2.880 7.720 6.568 1.00 0.00 H new ATOM 0 HA GLU A 322 -2.644 10.522 6.368 1.00 0.00 H new ATOM 0 HB2 GLU A 322 -2.899 8.666 8.756 1.00 0.00 H new ATOM 0 HB3 GLU A 322 -2.982 10.413 8.866 1.00 0.00 H new ATOM 0 HG2 GLU A 322 -4.968 10.512 7.500 1.00 0.00 H new ATOM 0 HG3 GLU A 322 -4.776 8.855 6.962 1.00 0.00 H new ATOM 488 N GLU A 323 -0.158 8.954 7.857 1.00 0.00 N ATOM 489 CA GLU A 323 1.228 9.089 8.271 1.00 0.00 C ATOM 490 C GLU A 323 2.136 9.231 7.048 1.00 0.00 C ATOM 491 O GLU A 323 3.012 10.095 7.018 1.00 0.00 O ATOM 492 CB GLU A 323 1.659 7.905 9.139 1.00 0.00 C ATOM 493 CG GLU A 323 0.875 7.874 10.453 1.00 0.00 C ATOM 494 CD GLU A 323 1.314 9.009 11.381 1.00 0.00 C ATOM 495 OE1 GLU A 323 0.747 10.113 11.234 1.00 0.00 O ATOM 496 OE2 GLU A 323 2.206 8.746 12.215 1.00 0.00 O ATOM 0 H GLU A 323 -0.554 8.023 7.989 1.00 0.00 H new ATOM 0 HA GLU A 323 1.320 9.992 8.874 1.00 0.00 H new ATOM 0 HB2 GLU A 323 1.501 6.974 8.595 1.00 0.00 H new ATOM 0 HB3 GLU A 323 2.726 7.973 9.350 1.00 0.00 H new ATOM 0 HG2 GLU A 323 -0.192 7.961 10.246 1.00 0.00 H new ATOM 0 HG3 GLU A 323 1.027 6.915 10.949 1.00 0.00 H new ATOM 503 N LEU A 324 1.896 8.371 6.070 1.00 0.00 N ATOM 504 CA LEU A 324 2.682 8.390 4.847 1.00 0.00 C ATOM 505 C LEU A 324 2.583 9.775 4.205 1.00 0.00 C ATOM 506 O LEU A 324 3.581 10.314 3.727 1.00 0.00 O ATOM 507 CB LEU A 324 2.257 7.250 3.920 1.00 0.00 C ATOM 508 CG LEU A 324 3.112 7.051 2.667 1.00 0.00 C ATOM 509 CD1 LEU A 324 4.562 6.731 3.038 1.00 0.00 C ATOM 510 CD2 LEU A 324 2.506 5.984 1.753 1.00 0.00 C ATOM 0 H LEU A 324 1.169 7.656 6.099 1.00 0.00 H new ATOM 0 HA LEU A 324 3.735 8.215 5.067 1.00 0.00 H new ATOM 0 HB2 LEU A 324 2.263 6.322 4.491 1.00 0.00 H new ATOM 0 HB3 LEU A 324 1.227 7.426 3.609 1.00 0.00 H new ATOM 0 HG LEU A 324 3.121 7.987 2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 324 5.148 6.594 2.129 1.00 0.00 H new ATOM 0 HD12 LEU A 324 4.979 7.554 3.619 1.00 0.00 H new ATOM 0 HD13 LEU A 324 4.593 5.817 3.631 1.00 0.00 H new ATOM 0 HD21 LEU A 324 3.133 5.862 0.870 1.00 0.00 H new ATOM 0 HD22 LEU A 324 2.446 5.037 2.289 1.00 0.00 H new ATOM 0 HD23 LEU A 324 1.506 6.292 1.448 1.00 0.00 H new ATOM 522 N GLY A 325 1.372 10.312 4.213 1.00 0.00 N ATOM 523 CA GLY A 325 1.130 11.623 3.637 1.00 0.00 C ATOM 524 C GLY A 325 1.819 12.717 4.456 1.00 0.00 C ATOM 525 O GLY A 325 2.252 13.729 3.906 1.00 0.00 O ATOM 0 H GLY A 325 0.547 9.862 4.610 1.00 0.00 H new ATOM 0 HA2 GLY A 325 1.496 11.647 2.611 1.00 0.00 H new ATOM 0 HA3 GLY A 325 0.058 11.814 3.597 1.00 0.00 H new ATOM 529 N ALA A 326 1.899 12.477 5.756 1.00 0.00 N ATOM 530 CA ALA A 326 2.528 13.429 6.656 1.00 0.00 C ATOM 531 C ALA A 326 4.042 13.410 6.435 1.00 0.00 C ATOM 532 O ALA A 326 4.723 14.402 6.690 1.00 0.00 O ATOM 533 CB ALA A 326 2.146 13.096 8.100 1.00 0.00 C ATOM 0 H ALA A 326 1.539 11.637 6.208 1.00 0.00 H new ATOM 0 HA ALA A 326 2.177 14.440 6.450 1.00 0.00 H new ATOM 0 HB1 ALA A 326 2.618 13.810 8.775 1.00 0.00 H new ATOM 0 HB2 ALA A 326 1.063 13.152 8.212 1.00 0.00 H new ATOM 0 HB3 ALA A 326 2.485 12.089 8.343 1.00 0.00 H new ATOM 539 N LEU A 327 4.525 12.270 5.962 1.00 0.00 N ATOM 540 CA LEU A 327 5.945 12.108 5.704 1.00 0.00 C ATOM 541 C LEU A 327 6.311 12.845 4.414 1.00 0.00 C ATOM 542 O LEU A 327 7.378 13.450 4.322 1.00 0.00 O ATOM 543 CB LEU A 327 6.323 10.626 5.693 1.00 0.00 C ATOM 544 CG LEU A 327 7.396 10.214 4.683 1.00 0.00 C ATOM 545 CD1 LEU A 327 8.762 10.781 5.073 1.00 0.00 C ATOM 546 CD2 LEU A 327 7.433 8.694 4.512 1.00 0.00 C ATOM 0 H LEU A 327 3.957 11.449 5.751 1.00 0.00 H new ATOM 0 HA LEU A 327 6.531 12.556 6.506 1.00 0.00 H new ATOM 0 HB2 LEU A 327 6.667 10.352 6.690 1.00 0.00 H new ATOM 0 HB3 LEU A 327 5.423 10.044 5.495 1.00 0.00 H new ATOM 0 HG LEU A 327 7.136 10.640 3.714 1.00 0.00 H new ATOM 0 HD11 LEU A 327 9.507 10.473 4.339 1.00 0.00 H new ATOM 0 HD12 LEU A 327 8.709 11.869 5.102 1.00 0.00 H new ATOM 0 HD13 LEU A 327 9.045 10.405 6.056 1.00 0.00 H new ATOM 0 HD21 LEU A 327 8.204 8.428 3.789 1.00 0.00 H new ATOM 0 HD22 LEU A 327 7.657 8.225 5.470 1.00 0.00 H new ATOM 0 HD23 LEU A 327 6.464 8.344 4.155 1.00 0.00 H new ATOM 558 N LEU A 328 5.406 12.770 3.450 1.00 0.00 N ATOM 559 CA LEU A 328 5.620 13.423 2.169 1.00 0.00 C ATOM 560 C LEU A 328 4.941 14.794 2.180 1.00 0.00 C ATOM 561 O LEU A 328 4.939 15.497 1.171 1.00 0.00 O ATOM 562 CB LEU A 328 5.162 12.518 1.024 1.00 0.00 C ATOM 563 CG LEU A 328 5.201 11.014 1.300 1.00 0.00 C ATOM 564 CD1 LEU A 328 3.949 10.323 0.756 1.00 0.00 C ATOM 565 CD2 LEU A 328 6.485 10.389 0.749 1.00 0.00 C ATOM 0 H LEU A 328 4.522 12.267 3.530 1.00 0.00 H new ATOM 0 HA LEU A 328 6.683 13.596 2.002 1.00 0.00 H new ATOM 0 HB2 LEU A 328 4.141 12.792 0.757 1.00 0.00 H new ATOM 0 HB3 LEU A 328 5.785 12.724 0.154 1.00 0.00 H new ATOM 0 HG LEU A 328 5.207 10.865 2.380 1.00 0.00 H new ATOM 0 HD11 LEU A 328 4.003 9.255 0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 328 3.065 10.743 1.235 1.00 0.00 H new ATOM 0 HD13 LEU A 328 3.887 10.479 -0.321 1.00 0.00 H new ATOM 0 HD21 LEU A 328 6.488 9.319 0.958 1.00 0.00 H new ATOM 0 HD22 LEU A 328 6.534 10.548 -0.328 1.00 0.00 H new ATOM 0 HD23 LEU A 328 7.349 10.854 1.224 1.00 0.00 H new ATOM 577 N GLU A 329 4.380 15.132 3.332 1.00 0.00 N ATOM 578 CA GLU A 329 3.699 16.406 3.488 1.00 0.00 C ATOM 579 C GLU A 329 2.461 16.458 2.591 1.00 0.00 C ATOM 580 O GLU A 329 1.844 17.512 2.440 1.00 0.00 O ATOM 581 CB GLU A 329 4.643 17.572 3.188 1.00 0.00 C ATOM 582 CG GLU A 329 5.490 17.921 4.414 1.00 0.00 C ATOM 583 CD GLU A 329 4.781 18.951 5.295 1.00 0.00 C ATOM 584 OE1 GLU A 329 3.548 18.813 5.451 1.00 0.00 O ATOM 585 OE2 GLU A 329 5.488 19.854 5.793 1.00 0.00 O ATOM 0 H GLU A 329 4.383 14.545 4.166 1.00 0.00 H new ATOM 0 HA GLU A 329 3.377 16.500 4.525 1.00 0.00 H new ATOM 0 HB2 GLU A 329 5.294 17.312 2.354 1.00 0.00 H new ATOM 0 HB3 GLU A 329 4.064 18.443 2.881 1.00 0.00 H new ATOM 0 HG2 GLU A 329 5.689 17.018 4.992 1.00 0.00 H new ATOM 0 HG3 GLU A 329 6.455 18.314 4.094 1.00 0.00 H new ATOM 592 N ILE A 330 2.134 15.308 2.020 1.00 0.00 N ATOM 593 CA ILE A 330 0.980 15.210 1.142 1.00 0.00 C ATOM 594 C ILE A 330 -0.162 14.513 1.884 1.00 0.00 C ATOM 595 O ILE A 330 0.058 13.884 2.918 1.00 0.00 O ATOM 596 CB ILE A 330 1.364 14.531 -0.174 1.00 0.00 C ATOM 597 CG1 ILE A 330 1.315 13.008 -0.040 1.00 0.00 C ATOM 598 CG2 ILE A 330 2.728 15.019 -0.666 1.00 0.00 C ATOM 599 CD1 ILE A 330 1.610 12.329 -1.379 1.00 0.00 C ATOM 0 H ILE A 330 2.648 14.436 2.148 1.00 0.00 H new ATOM 0 HA ILE A 330 0.624 16.203 0.869 1.00 0.00 H new ATOM 0 HB ILE A 330 0.630 14.812 -0.929 1.00 0.00 H new ATOM 0 HG12 ILE A 330 2.041 12.682 0.705 1.00 0.00 H new ATOM 0 HG13 ILE A 330 0.332 12.702 0.318 1.00 0.00 H new ATOM 0 HG21 ILE A 330 2.977 14.520 -1.603 1.00 0.00 H new ATOM 0 HG22 ILE A 330 2.693 16.097 -0.827 1.00 0.00 H new ATOM 0 HG23 ILE A 330 3.488 14.788 0.081 1.00 0.00 H new ATOM 0 HD11 ILE A 330 1.569 11.247 -1.255 1.00 0.00 H new ATOM 0 HD12 ILE A 330 0.868 12.639 -2.115 1.00 0.00 H new ATOM 0 HD13 ILE A 330 2.604 12.617 -1.722 1.00 0.00 H new ATOM 611 N PRO A 331 -1.388 14.651 1.312 1.00 0.00 N ATOM 612 CA PRO A 331 -2.565 14.041 1.908 1.00 0.00 C ATOM 613 C PRO A 331 -2.583 12.531 1.663 1.00 0.00 C ATOM 614 O PRO A 331 -1.905 12.036 0.764 1.00 0.00 O ATOM 615 CB PRO A 331 -3.744 14.760 1.273 1.00 0.00 C ATOM 616 CG PRO A 331 -3.204 15.416 0.013 1.00 0.00 C ATOM 617 CD PRO A 331 -1.686 15.389 0.088 1.00 0.00 C ATOM 0 HA PRO A 331 -2.590 14.145 2.993 1.00 0.00 H new ATOM 0 HB2 PRO A 331 -4.546 14.061 1.036 1.00 0.00 H new ATOM 0 HB3 PRO A 331 -4.160 15.504 1.953 1.00 0.00 H new ATOM 0 HG2 PRO A 331 -3.552 14.885 -0.873 1.00 0.00 H new ATOM 0 HG3 PRO A 331 -3.564 16.442 -0.068 1.00 0.00 H new ATOM 0 HD2 PRO A 331 -1.255 14.899 -0.785 1.00 0.00 H new ATOM 0 HD3 PRO A 331 -1.273 16.397 0.123 1.00 0.00 H new ATOM 625 N ALA A 332 -3.366 11.841 2.480 1.00 0.00 N ATOM 626 CA ALA A 332 -3.481 10.397 2.364 1.00 0.00 C ATOM 627 C ALA A 332 -3.971 10.041 0.959 1.00 0.00 C ATOM 628 O ALA A 332 -3.489 9.084 0.354 1.00 0.00 O ATOM 629 CB ALA A 332 -4.412 9.870 3.457 1.00 0.00 C ATOM 0 H ALA A 332 -3.927 12.255 3.225 1.00 0.00 H new ATOM 0 HA ALA A 332 -2.510 9.921 2.505 1.00 0.00 H new ATOM 0 HB1 ALA A 332 -4.498 8.787 3.370 1.00 0.00 H new ATOM 0 HB2 ALA A 332 -4.005 10.124 4.436 1.00 0.00 H new ATOM 0 HB3 ALA A 332 -5.397 10.323 3.345 1.00 0.00 H new ATOM 635 N ALA A 333 -4.922 10.829 0.480 1.00 0.00 N ATOM 636 CA ALA A 333 -5.482 10.608 -0.842 1.00 0.00 C ATOM 637 C ALA A 333 -4.363 10.676 -1.883 1.00 0.00 C ATOM 638 O ALA A 333 -4.389 9.949 -2.875 1.00 0.00 O ATOM 639 CB ALA A 333 -6.587 11.633 -1.106 1.00 0.00 C ATOM 0 H ALA A 333 -5.319 11.622 0.984 1.00 0.00 H new ATOM 0 HA ALA A 333 -5.933 9.618 -0.907 1.00 0.00 H new ATOM 0 HB1 ALA A 333 -7.007 11.467 -2.098 1.00 0.00 H new ATOM 0 HB2 ALA A 333 -7.371 11.524 -0.357 1.00 0.00 H new ATOM 0 HB3 ALA A 333 -6.171 12.639 -1.052 1.00 0.00 H new ATOM 645 N LYS A 334 -3.407 11.555 -1.621 1.00 0.00 N ATOM 646 CA LYS A 334 -2.281 11.726 -2.523 1.00 0.00 C ATOM 647 C LYS A 334 -1.317 10.550 -2.358 1.00 0.00 C ATOM 648 O LYS A 334 -0.891 9.948 -3.343 1.00 0.00 O ATOM 649 CB LYS A 334 -1.626 13.093 -2.309 1.00 0.00 C ATOM 650 CG LYS A 334 -0.816 13.511 -3.537 1.00 0.00 C ATOM 651 CD LYS A 334 -1.737 13.957 -4.675 1.00 0.00 C ATOM 652 CE LYS A 334 -1.029 13.851 -6.027 1.00 0.00 C ATOM 653 NZ LYS A 334 -1.138 15.126 -6.771 1.00 0.00 N ATOM 0 H LYS A 334 -3.389 12.156 -0.797 1.00 0.00 H new ATOM 0 HA LYS A 334 -2.619 11.718 -3.559 1.00 0.00 H new ATOM 0 HB2 LYS A 334 -2.393 13.840 -2.104 1.00 0.00 H new ATOM 0 HB3 LYS A 334 -0.975 13.056 -1.435 1.00 0.00 H new ATOM 0 HG2 LYS A 334 -0.140 14.324 -3.272 1.00 0.00 H new ATOM 0 HG3 LYS A 334 -0.197 12.678 -3.870 1.00 0.00 H new ATOM 0 HD2 LYS A 334 -2.636 13.341 -4.682 1.00 0.00 H new ATOM 0 HD3 LYS A 334 -2.056 14.986 -4.507 1.00 0.00 H new ATOM 0 HE2 LYS A 334 0.021 13.600 -5.876 1.00 0.00 H new ATOM 0 HE3 LYS A 334 -1.469 13.043 -6.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 334 -0.652 15.037 -7.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 334 -2.141 15.349 -6.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 334 -0.698 15.889 -6.218 1.00 0.00 H new ATOM 667 N ALA A 335 -1.000 10.257 -1.105 1.00 0.00 N ATOM 668 CA ALA A 335 -0.094 9.163 -0.798 1.00 0.00 C ATOM 669 C ALA A 335 -0.722 7.844 -1.253 1.00 0.00 C ATOM 670 O ALA A 335 -0.012 6.909 -1.621 1.00 0.00 O ATOM 671 CB ALA A 335 0.228 9.171 0.698 1.00 0.00 C ATOM 0 H ALA A 335 -1.355 10.758 -0.291 1.00 0.00 H new ATOM 0 HA ALA A 335 0.848 9.282 -1.334 1.00 0.00 H new ATOM 0 HB1 ALA A 335 0.908 8.350 0.928 1.00 0.00 H new ATOM 0 HB2 ALA A 335 0.699 10.117 0.964 1.00 0.00 H new ATOM 0 HB3 ALA A 335 -0.693 9.051 1.269 1.00 0.00 H new ATOM 677 N GLU A 336 -2.045 7.811 -1.212 1.00 0.00 N ATOM 678 CA GLU A 336 -2.777 6.621 -1.615 1.00 0.00 C ATOM 679 C GLU A 336 -2.693 6.435 -3.131 1.00 0.00 C ATOM 680 O GLU A 336 -2.414 5.337 -3.611 1.00 0.00 O ATOM 681 CB GLU A 336 -4.233 6.689 -1.151 1.00 0.00 C ATOM 682 CG GLU A 336 -4.990 5.416 -1.532 1.00 0.00 C ATOM 683 CD GLU A 336 -6.478 5.704 -1.740 1.00 0.00 C ATOM 684 OE1 GLU A 336 -6.814 6.193 -2.840 1.00 0.00 O ATOM 685 OE2 GLU A 336 -7.247 5.430 -0.793 1.00 0.00 O ATOM 0 H GLU A 336 -2.630 8.589 -0.906 1.00 0.00 H new ATOM 0 HA GLU A 336 -2.318 5.756 -1.136 1.00 0.00 H new ATOM 0 HB2 GLU A 336 -4.268 6.827 -0.070 1.00 0.00 H new ATOM 0 HB3 GLU A 336 -4.721 7.554 -1.599 1.00 0.00 H new ATOM 0 HG2 GLU A 336 -4.566 4.996 -2.444 1.00 0.00 H new ATOM 0 HG3 GLU A 336 -4.867 4.667 -0.749 1.00 0.00 H new ATOM 692 N LYS A 337 -2.939 7.525 -3.844 1.00 0.00 N ATOM 693 CA LYS A 337 -2.895 7.495 -5.296 1.00 0.00 C ATOM 694 C LYS A 337 -1.455 7.256 -5.753 1.00 0.00 C ATOM 695 O LYS A 337 -1.208 6.433 -6.633 1.00 0.00 O ATOM 696 CB LYS A 337 -3.522 8.764 -5.877 1.00 0.00 C ATOM 697 CG LYS A 337 -5.038 8.771 -5.670 1.00 0.00 C ATOM 698 CD LYS A 337 -5.756 9.329 -6.901 1.00 0.00 C ATOM 699 CE LYS A 337 -6.356 10.705 -6.608 1.00 0.00 C ATOM 700 NZ LYS A 337 -7.197 11.156 -7.739 1.00 0.00 N ATOM 0 H LYS A 337 -3.169 8.434 -3.443 1.00 0.00 H new ATOM 0 HA LYS A 337 -3.493 6.668 -5.679 1.00 0.00 H new ATOM 0 HB2 LYS A 337 -3.083 9.641 -5.402 1.00 0.00 H new ATOM 0 HB3 LYS A 337 -3.296 8.831 -6.941 1.00 0.00 H new ATOM 0 HG2 LYS A 337 -5.386 7.758 -5.469 1.00 0.00 H new ATOM 0 HG3 LYS A 337 -5.287 9.372 -4.796 1.00 0.00 H new ATOM 0 HD2 LYS A 337 -5.055 9.403 -7.733 1.00 0.00 H new ATOM 0 HD3 LYS A 337 -6.545 8.642 -7.209 1.00 0.00 H new ATOM 0 HE2 LYS A 337 -6.954 10.661 -5.698 1.00 0.00 H new ATOM 0 HE3 LYS A 337 -5.558 11.426 -6.431 1.00 0.00 H new ATOM 0 HZ1 LYS A 337 -7.596 12.092 -7.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 337 -6.617 11.217 -8.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 337 -7.970 10.476 -7.890 1.00 0.00 H new ATOM 714 N ILE A 338 -0.541 7.990 -5.135 1.00 0.00 N ATOM 715 CA ILE A 338 0.868 7.868 -5.467 1.00 0.00 C ATOM 716 C ILE A 338 1.352 6.461 -5.110 1.00 0.00 C ATOM 717 O ILE A 338 2.023 5.810 -5.909 1.00 0.00 O ATOM 718 CB ILE A 338 1.675 8.984 -4.800 1.00 0.00 C ATOM 719 CG1 ILE A 338 1.241 10.357 -5.316 1.00 0.00 C ATOM 720 CG2 ILE A 338 3.177 8.754 -4.974 1.00 0.00 C ATOM 721 CD1 ILE A 338 2.022 11.475 -4.622 1.00 0.00 C ATOM 0 H ILE A 338 -0.749 8.672 -4.406 1.00 0.00 H new ATOM 0 HA ILE A 338 1.019 7.995 -6.539 1.00 0.00 H new ATOM 0 HB ILE A 338 1.469 8.962 -3.730 1.00 0.00 H new ATOM 0 HG12 ILE A 338 1.400 10.412 -6.393 1.00 0.00 H new ATOM 0 HG13 ILE A 338 0.173 10.493 -5.144 1.00 0.00 H new ATOM 0 HG21 ILE A 338 3.727 9.561 -4.491 1.00 0.00 H new ATOM 0 HG22 ILE A 338 3.455 7.803 -4.519 1.00 0.00 H new ATOM 0 HG23 ILE A 338 3.421 8.733 -6.036 1.00 0.00 H new ATOM 0 HD11 ILE A 338 1.694 12.441 -5.007 1.00 0.00 H new ATOM 0 HD12 ILE A 338 1.842 11.432 -3.548 1.00 0.00 H new ATOM 0 HD13 ILE A 338 3.087 11.349 -4.816 1.00 0.00 H new ATOM 733 N ALA A 339 0.992 6.034 -3.908 1.00 0.00 N ATOM 734 CA ALA A 339 1.382 4.716 -3.435 1.00 0.00 C ATOM 735 C ALA A 339 0.884 3.658 -4.421 1.00 0.00 C ATOM 736 O ALA A 339 1.624 2.744 -4.782 1.00 0.00 O ATOM 737 CB ALA A 339 0.836 4.499 -2.022 1.00 0.00 C ATOM 0 H ALA A 339 0.435 6.577 -3.248 1.00 0.00 H new ATOM 0 HA ALA A 339 2.467 4.632 -3.382 1.00 0.00 H new ATOM 0 HB1 ALA A 339 1.128 3.511 -1.667 1.00 0.00 H new ATOM 0 HB2 ALA A 339 1.242 5.259 -1.354 1.00 0.00 H new ATOM 0 HB3 ALA A 339 -0.251 4.572 -2.037 1.00 0.00 H new ATOM 743 N SER A 340 -0.367 3.816 -4.829 1.00 0.00 N ATOM 744 CA SER A 340 -0.972 2.885 -5.766 1.00 0.00 C ATOM 745 C SER A 340 -0.332 3.042 -7.147 1.00 0.00 C ATOM 746 O SER A 340 -0.022 2.052 -7.807 1.00 0.00 O ATOM 747 CB SER A 340 -2.485 3.099 -5.855 1.00 0.00 C ATOM 748 OG SER A 340 -2.863 3.739 -7.071 1.00 0.00 O ATOM 0 H SER A 340 -0.978 4.575 -4.528 1.00 0.00 H new ATOM 0 HA SER A 340 -0.796 1.872 -5.404 1.00 0.00 H new ATOM 0 HB2 SER A 340 -2.992 2.137 -5.779 1.00 0.00 H new ATOM 0 HB3 SER A 340 -2.816 3.702 -5.010 1.00 0.00 H new ATOM 0 HG SER A 340 -3.836 3.856 -7.090 1.00 0.00 H new ATOM 754 N GLN A 341 -0.153 4.294 -7.542 1.00 0.00 N ATOM 755 CA GLN A 341 0.445 4.594 -8.832 1.00 0.00 C ATOM 756 C GLN A 341 1.855 4.006 -8.913 1.00 0.00 C ATOM 757 O GLN A 341 2.278 3.541 -9.970 1.00 0.00 O ATOM 758 CB GLN A 341 0.463 6.101 -9.092 1.00 0.00 C ATOM 759 CG GLN A 341 -0.674 6.510 -10.030 1.00 0.00 C ATOM 760 CD GLN A 341 -0.481 7.941 -10.536 1.00 0.00 C ATOM 761 OE1 GLN A 341 -0.431 8.894 -9.776 1.00 0.00 O ATOM 762 NE2 GLN A 341 -0.374 8.037 -11.858 1.00 0.00 N ATOM 0 H GLN A 341 -0.412 5.113 -6.991 1.00 0.00 H new ATOM 0 HA GLN A 341 -0.165 4.133 -9.609 1.00 0.00 H new ATOM 0 HB2 GLN A 341 0.371 6.638 -8.148 1.00 0.00 H new ATOM 0 HB3 GLN A 341 1.420 6.387 -9.529 1.00 0.00 H new ATOM 0 HG2 GLN A 341 -0.716 5.824 -10.876 1.00 0.00 H new ATOM 0 HG3 GLN A 341 -1.627 6.431 -9.507 1.00 0.00 H new ATOM 0 HE21 GLN A 341 -0.425 7.198 -12.436 1.00 0.00 H new ATOM 0 HE22 GLN A 341 -0.241 8.950 -12.294 1.00 0.00 H new ATOM 771 N MET A 342 2.544 4.047 -7.782 1.00 0.00 N ATOM 772 CA MET A 342 3.898 3.525 -7.711 1.00 0.00 C ATOM 773 C MET A 342 3.921 2.021 -7.989 1.00 0.00 C ATOM 774 O MET A 342 4.717 1.548 -8.799 1.00 0.00 O ATOM 775 CB MET A 342 4.478 3.796 -6.321 1.00 0.00 C ATOM 776 CG MET A 342 4.990 5.234 -6.212 1.00 0.00 C ATOM 777 SD MET A 342 6.439 5.289 -5.171 1.00 0.00 S ATOM 778 CE MET A 342 7.685 4.789 -6.348 1.00 0.00 C ATOM 0 H MET A 342 2.190 4.434 -6.907 1.00 0.00 H new ATOM 0 HA MET A 342 4.500 4.025 -8.470 1.00 0.00 H new ATOM 0 HB2 MET A 342 3.714 3.620 -5.564 1.00 0.00 H new ATOM 0 HB3 MET A 342 5.292 3.100 -6.121 1.00 0.00 H new ATOM 0 HG2 MET A 342 5.229 5.620 -7.203 1.00 0.00 H new ATOM 0 HG3 MET A 342 4.211 5.876 -5.800 1.00 0.00 H new ATOM 0 HE1 MET A 342 8.675 4.989 -5.937 1.00 0.00 H new ATOM 0 HE2 MET A 342 7.585 3.723 -6.552 1.00 0.00 H new ATOM 0 HE3 MET A 342 7.557 5.349 -7.274 1.00 0.00 H new ATOM 788 N ILE A 343 3.038 1.311 -7.302 1.00 0.00 N ATOM 789 CA ILE A 343 2.947 -0.130 -7.465 1.00 0.00 C ATOM 790 C ILE A 343 2.415 -0.448 -8.864 1.00 0.00 C ATOM 791 O ILE A 343 2.836 -1.423 -9.485 1.00 0.00 O ATOM 792 CB ILE A 343 2.117 -0.746 -6.337 1.00 0.00 C ATOM 793 CG1 ILE A 343 2.865 -0.676 -5.004 1.00 0.00 C ATOM 794 CG2 ILE A 343 1.695 -2.175 -6.683 1.00 0.00 C ATOM 795 CD1 ILE A 343 1.920 -0.939 -3.830 1.00 0.00 C ATOM 0 H ILE A 343 2.379 1.707 -6.631 1.00 0.00 H new ATOM 0 HA ILE A 343 3.934 -0.585 -7.388 1.00 0.00 H new ATOM 0 HB ILE A 343 1.205 -0.160 -6.226 1.00 0.00 H new ATOM 0 HG12 ILE A 343 3.672 -1.409 -4.997 1.00 0.00 H new ATOM 0 HG13 ILE A 343 3.325 0.306 -4.892 1.00 0.00 H new ATOM 0 HG21 ILE A 343 1.106 -2.589 -5.864 1.00 0.00 H new ATOM 0 HG22 ILE A 343 1.095 -2.167 -7.593 1.00 0.00 H new ATOM 0 HG23 ILE A 343 2.582 -2.789 -6.839 1.00 0.00 H new ATOM 0 HD11 ILE A 343 2.477 -0.883 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 343 1.128 -0.190 -3.826 1.00 0.00 H new ATOM 0 HD13 ILE A 343 1.480 -1.931 -3.932 1.00 0.00 H new ATOM 807 N THR A 344 1.498 0.393 -9.319 1.00 0.00 N ATOM 808 CA THR A 344 0.904 0.214 -10.633 1.00 0.00 C ATOM 809 C THR A 344 1.956 0.415 -11.725 1.00 0.00 C ATOM 810 O THR A 344 1.912 -0.244 -12.763 1.00 0.00 O ATOM 811 CB THR A 344 -0.283 1.171 -10.750 1.00 0.00 C ATOM 812 OG1 THR A 344 -1.281 0.590 -9.915 1.00 0.00 O ATOM 813 CG2 THR A 344 -0.911 1.158 -12.145 1.00 0.00 C ATOM 0 H THR A 344 1.152 1.201 -8.801 1.00 0.00 H new ATOM 0 HA THR A 344 0.534 -0.803 -10.764 1.00 0.00 H new ATOM 0 HB THR A 344 0.042 2.183 -10.508 1.00 0.00 H new ATOM 0 HG1 THR A 344 -1.165 0.910 -8.996 1.00 0.00 H new ATOM 0 HG21 THR A 344 -1.749 1.855 -12.173 1.00 0.00 H new ATOM 0 HG22 THR A 344 -0.166 1.457 -12.882 1.00 0.00 H new ATOM 0 HG23 THR A 344 -1.266 0.153 -12.375 1.00 0.00 H new ATOM 821 N GLU A 345 2.878 1.327 -11.454 1.00 0.00 N ATOM 822 CA GLU A 345 3.939 1.623 -12.401 1.00 0.00 C ATOM 823 C GLU A 345 5.048 0.574 -12.301 1.00 0.00 C ATOM 824 O GLU A 345 6.007 0.604 -13.070 1.00 0.00 O ATOM 825 CB GLU A 345 4.495 3.031 -12.179 1.00 0.00 C ATOM 826 CG GLU A 345 3.531 4.092 -12.713 1.00 0.00 C ATOM 827 CD GLU A 345 4.267 5.116 -13.580 1.00 0.00 C ATOM 828 OE1 GLU A 345 4.563 4.766 -14.743 1.00 0.00 O ATOM 829 OE2 GLU A 345 4.518 6.224 -13.060 1.00 0.00 O ATOM 0 H GLU A 345 2.912 1.871 -10.592 1.00 0.00 H new ATOM 0 HA GLU A 345 3.521 1.587 -13.407 1.00 0.00 H new ATOM 0 HB2 GLU A 345 4.668 3.194 -11.115 1.00 0.00 H new ATOM 0 HB3 GLU A 345 5.460 3.128 -12.677 1.00 0.00 H new ATOM 0 HG2 GLU A 345 2.745 3.613 -13.297 1.00 0.00 H new ATOM 0 HG3 GLU A 345 3.044 4.599 -11.880 1.00 0.00 H new ATOM 836 N GLY A 346 4.879 -0.330 -11.347 1.00 0.00 N ATOM 837 CA GLY A 346 5.853 -1.387 -11.136 1.00 0.00 C ATOM 838 C GLY A 346 7.106 -0.847 -10.443 1.00 0.00 C ATOM 839 O GLY A 346 8.062 -1.588 -10.215 1.00 0.00 O ATOM 0 H GLY A 346 4.082 -0.352 -10.711 1.00 0.00 H new ATOM 0 HA2 GLY A 346 5.411 -2.178 -10.531 1.00 0.00 H new ATOM 0 HA3 GLY A 346 6.125 -1.832 -12.093 1.00 0.00 H new ATOM 843 N ARG A 347 7.062 0.439 -10.128 1.00 0.00 N ATOM 844 CA ARG A 347 8.181 1.086 -9.465 1.00 0.00 C ATOM 845 C ARG A 347 8.308 0.586 -8.025 1.00 0.00 C ATOM 846 O ARG A 347 9.399 0.584 -7.458 1.00 0.00 O ATOM 847 CB ARG A 347 8.012 2.606 -9.457 1.00 0.00 C ATOM 848 CG ARG A 347 8.109 3.177 -10.873 1.00 0.00 C ATOM 849 CD ARG A 347 8.217 4.703 -10.843 1.00 0.00 C ATOM 850 NE ARG A 347 7.676 5.273 -12.097 1.00 0.00 N ATOM 851 CZ ARG A 347 7.795 6.560 -12.450 1.00 0.00 C ATOM 852 NH1 ARG A 347 8.438 7.418 -11.646 1.00 0.00 N ATOM 853 NH2 ARG A 347 7.272 6.989 -13.606 1.00 0.00 N ATOM 0 H ARG A 347 6.268 1.051 -10.320 1.00 0.00 H new ATOM 0 HA ARG A 347 9.085 0.835 -10.020 1.00 0.00 H new ATOM 0 HB2 ARG A 347 7.047 2.866 -9.022 1.00 0.00 H new ATOM 0 HB3 ARG A 347 8.778 3.057 -8.826 1.00 0.00 H new ATOM 0 HG2 ARG A 347 8.978 2.757 -11.379 1.00 0.00 H new ATOM 0 HG3 ARG A 347 7.232 2.882 -11.449 1.00 0.00 H new ATOM 0 HD2 ARG A 347 7.668 5.098 -9.988 1.00 0.00 H new ATOM 0 HD3 ARG A 347 9.258 5.000 -10.718 1.00 0.00 H new ATOM 0 HE ARG A 347 7.182 4.647 -12.732 1.00 0.00 H new ATOM 0 HH11 ARG A 347 8.837 7.091 -10.766 1.00 0.00 H new ATOM 0 HH12 ARG A 347 8.529 8.398 -11.914 1.00 0.00 H new ATOM 0 HH21 ARG A 347 6.783 6.336 -14.218 1.00 0.00 H new ATOM 0 HH22 ARG A 347 7.363 7.969 -13.874 1.00 0.00 H new ATOM 867 N MET A 348 7.175 0.173 -7.474 1.00 0.00 N ATOM 868 CA MET A 348 7.145 -0.329 -6.111 1.00 0.00 C ATOM 869 C MET A 348 6.590 -1.753 -6.063 1.00 0.00 C ATOM 870 O MET A 348 5.983 -2.220 -7.026 1.00 0.00 O ATOM 871 CB MET A 348 6.275 0.588 -5.248 1.00 0.00 C ATOM 872 CG MET A 348 6.533 0.347 -3.760 1.00 0.00 C ATOM 873 SD MET A 348 5.888 1.707 -2.800 1.00 0.00 S ATOM 874 CE MET A 348 4.143 1.337 -2.872 1.00 0.00 C ATOM 0 H MET A 348 6.271 0.176 -7.947 1.00 0.00 H new ATOM 0 HA MET A 348 8.165 -0.344 -5.727 1.00 0.00 H new ATOM 0 HB2 MET A 348 6.484 1.629 -5.493 1.00 0.00 H new ATOM 0 HB3 MET A 348 5.223 0.413 -5.471 1.00 0.00 H new ATOM 0 HG2 MET A 348 6.062 -0.585 -3.447 1.00 0.00 H new ATOM 0 HG3 MET A 348 7.603 0.240 -3.581 1.00 0.00 H new ATOM 0 HE1 MET A 348 3.628 1.851 -2.060 1.00 0.00 H new ATOM 0 HE2 MET A 348 3.739 1.672 -3.827 1.00 0.00 H new ATOM 0 HE3 MET A 348 3.995 0.262 -2.772 1.00 0.00 H new ATOM 884 N ASN A 349 6.816 -2.405 -4.932 1.00 0.00 N ATOM 885 CA ASN A 349 6.346 -3.767 -4.746 1.00 0.00 C ATOM 886 C ASN A 349 5.522 -3.846 -3.459 1.00 0.00 C ATOM 887 O ASN A 349 5.945 -3.351 -2.415 1.00 0.00 O ATOM 888 CB ASN A 349 7.518 -4.742 -4.617 1.00 0.00 C ATOM 889 CG ASN A 349 7.312 -5.968 -5.508 1.00 0.00 C ATOM 890 OD1 ASN A 349 7.079 -7.072 -5.045 1.00 0.00 O ATOM 891 ND2 ASN A 349 7.410 -5.713 -6.810 1.00 0.00 N ATOM 0 H ASN A 349 7.319 -2.015 -4.135 1.00 0.00 H new ATOM 0 HA ASN A 349 5.746 -4.038 -5.615 1.00 0.00 H new ATOM 0 HB2 ASN A 349 8.445 -4.240 -4.892 1.00 0.00 H new ATOM 0 HB3 ASN A 349 7.622 -5.056 -3.578 1.00 0.00 H new ATOM 0 HD21 ASN A 349 7.288 -6.465 -7.488 1.00 0.00 H new ATOM 0 HD22 ASN A 349 7.607 -4.765 -7.131 1.00 0.00 H new ATOM 898 N GLY A 350 4.360 -4.472 -3.575 1.00 0.00 N ATOM 899 CA GLY A 350 3.473 -4.622 -2.434 1.00 0.00 C ATOM 900 C GLY A 350 2.022 -4.338 -2.827 1.00 0.00 C ATOM 901 O GLY A 350 1.707 -4.217 -4.010 1.00 0.00 O ATOM 0 H GLY A 350 4.012 -4.881 -4.442 1.00 0.00 H new ATOM 0 HA2 GLY A 350 3.554 -5.633 -2.036 1.00 0.00 H new ATOM 0 HA3 GLY A 350 3.778 -3.941 -1.639 1.00 0.00 H new ATOM 905 N PHE A 351 1.177 -4.238 -1.812 1.00 0.00 N ATOM 906 CA PHE A 351 -0.234 -3.970 -2.036 1.00 0.00 C ATOM 907 C PHE A 351 -0.802 -3.070 -0.937 1.00 0.00 C ATOM 908 O PHE A 351 -0.273 -3.030 0.174 1.00 0.00 O ATOM 909 CB PHE A 351 -0.957 -5.318 -1.999 1.00 0.00 C ATOM 910 CG PHE A 351 -1.075 -5.922 -0.598 1.00 0.00 C ATOM 911 CD1 PHE A 351 -2.132 -5.599 0.195 1.00 0.00 C ATOM 912 CD2 PHE A 351 -0.124 -6.783 -0.147 1.00 0.00 C ATOM 913 CE1 PHE A 351 -2.242 -6.160 1.494 1.00 0.00 C ATOM 914 CE2 PHE A 351 -0.235 -7.344 1.153 1.00 0.00 C ATOM 915 CZ PHE A 351 -1.291 -7.021 1.946 1.00 0.00 C ATOM 0 H PHE A 351 1.442 -4.338 -0.832 1.00 0.00 H new ATOM 0 HA PHE A 351 -0.369 -3.462 -2.991 1.00 0.00 H new ATOM 0 HB2 PHE A 351 -1.957 -5.194 -2.416 1.00 0.00 H new ATOM 0 HB3 PHE A 351 -0.428 -6.020 -2.643 1.00 0.00 H new ATOM 0 HD1 PHE A 351 -2.887 -4.916 -0.164 1.00 0.00 H new ATOM 0 HD2 PHE A 351 0.715 -7.040 -0.777 1.00 0.00 H new ATOM 0 HE1 PHE A 351 -3.081 -5.903 2.124 1.00 0.00 H new ATOM 0 HE2 PHE A 351 0.520 -8.028 1.512 1.00 0.00 H new ATOM 0 HZ PHE A 351 -1.375 -7.448 2.935 1.00 0.00 H new ATOM 925 N ILE A 352 -1.871 -2.368 -1.284 1.00 0.00 N ATOM 926 CA ILE A 352 -2.516 -1.471 -0.341 1.00 0.00 C ATOM 927 C ILE A 352 -3.731 -2.171 0.272 1.00 0.00 C ATOM 928 O ILE A 352 -4.646 -2.574 -0.444 1.00 0.00 O ATOM 929 CB ILE A 352 -2.849 -0.137 -1.013 1.00 0.00 C ATOM 930 CG1 ILE A 352 -1.574 0.603 -1.423 1.00 0.00 C ATOM 931 CG2 ILE A 352 -3.746 0.719 -0.116 1.00 0.00 C ATOM 932 CD1 ILE A 352 -1.891 2.028 -1.881 1.00 0.00 C ATOM 0 H ILE A 352 -2.307 -2.403 -2.206 1.00 0.00 H new ATOM 0 HA ILE A 352 -1.840 -1.229 0.479 1.00 0.00 H new ATOM 0 HB ILE A 352 -3.409 -0.343 -1.925 1.00 0.00 H new ATOM 0 HG12 ILE A 352 -0.880 0.633 -0.583 1.00 0.00 H new ATOM 0 HG13 ILE A 352 -1.077 0.061 -2.227 1.00 0.00 H new ATOM 0 HG21 ILE A 352 -3.968 1.661 -0.617 1.00 0.00 H new ATOM 0 HG22 ILE A 352 -4.676 0.186 0.083 1.00 0.00 H new ATOM 0 HG23 ILE A 352 -3.234 0.920 0.825 1.00 0.00 H new ATOM 0 HD11 ILE A 352 -0.968 2.532 -2.167 1.00 0.00 H new ATOM 0 HD12 ILE A 352 -2.566 1.994 -2.737 1.00 0.00 H new ATOM 0 HD13 ILE A 352 -2.366 2.575 -1.066 1.00 0.00 H new ATOM 944 N ASP A 353 -3.700 -2.293 1.591 1.00 0.00 N ATOM 945 CA ASP A 353 -4.787 -2.937 2.309 1.00 0.00 C ATOM 946 C ASP A 353 -5.908 -1.922 2.545 1.00 0.00 C ATOM 947 O ASP A 353 -5.753 -0.995 3.339 1.00 0.00 O ATOM 948 CB ASP A 353 -4.319 -3.451 3.672 1.00 0.00 C ATOM 949 CG ASP A 353 -5.393 -4.161 4.498 1.00 0.00 C ATOM 950 OD1 ASP A 353 -6.527 -4.270 3.983 1.00 0.00 O ATOM 951 OD2 ASP A 353 -5.056 -4.578 5.627 1.00 0.00 O ATOM 0 H ASP A 353 -2.939 -1.957 2.181 1.00 0.00 H new ATOM 0 HA ASP A 353 -5.137 -3.777 1.709 1.00 0.00 H new ATOM 0 HB2 ASP A 353 -3.487 -4.138 3.518 1.00 0.00 H new ATOM 0 HB3 ASP A 353 -3.935 -2.609 4.249 1.00 0.00 H new ATOM 956 N GLN A 354 -7.011 -2.132 1.842 1.00 0.00 N ATOM 957 CA GLN A 354 -8.157 -1.247 1.966 1.00 0.00 C ATOM 958 C GLN A 354 -9.026 -1.667 3.153 1.00 0.00 C ATOM 959 O GLN A 354 -9.839 -0.883 3.640 1.00 0.00 O ATOM 960 CB GLN A 354 -8.972 -1.222 0.672 1.00 0.00 C ATOM 961 CG GLN A 354 -8.277 -0.376 -0.397 1.00 0.00 C ATOM 962 CD GLN A 354 -9.260 0.598 -1.050 1.00 0.00 C ATOM 963 OE1 GLN A 354 -9.605 1.633 -0.502 1.00 0.00 O ATOM 964 NE2 GLN A 354 -9.691 0.212 -2.247 1.00 0.00 N ATOM 0 H GLN A 354 -7.136 -2.902 1.185 1.00 0.00 H new ATOM 0 HA GLN A 354 -7.793 -0.236 2.147 1.00 0.00 H new ATOM 0 HB2 GLN A 354 -9.108 -2.239 0.304 1.00 0.00 H new ATOM 0 HB3 GLN A 354 -9.965 -0.819 0.871 1.00 0.00 H new ATOM 0 HG2 GLN A 354 -7.454 0.179 0.052 1.00 0.00 H new ATOM 0 HG3 GLN A 354 -7.845 -1.027 -1.157 1.00 0.00 H new ATOM 0 HE21 GLN A 354 -9.362 -0.666 -2.649 1.00 0.00 H new ATOM 0 HE22 GLN A 354 -10.350 0.794 -2.764 1.00 0.00 H new ATOM 973 N ILE A 355 -8.825 -2.904 3.585 1.00 0.00 N ATOM 974 CA ILE A 355 -9.580 -3.437 4.705 1.00 0.00 C ATOM 975 C ILE A 355 -9.177 -2.700 5.984 1.00 0.00 C ATOM 976 O ILE A 355 -10.024 -2.390 6.820 1.00 0.00 O ATOM 977 CB ILE A 355 -9.410 -4.956 4.792 1.00 0.00 C ATOM 978 CG1 ILE A 355 -9.860 -5.632 3.495 1.00 0.00 C ATOM 979 CG2 ILE A 355 -10.136 -5.520 6.015 1.00 0.00 C ATOM 980 CD1 ILE A 355 -9.088 -6.932 3.258 1.00 0.00 C ATOM 0 H ILE A 355 -8.150 -3.552 3.179 1.00 0.00 H new ATOM 0 HA ILE A 355 -10.647 -3.266 4.560 1.00 0.00 H new ATOM 0 HB ILE A 355 -8.350 -5.175 4.919 1.00 0.00 H new ATOM 0 HG12 ILE A 355 -10.928 -5.843 3.542 1.00 0.00 H new ATOM 0 HG13 ILE A 355 -9.705 -4.955 2.655 1.00 0.00 H new ATOM 0 HG21 ILE A 355 -9.999 -6.601 6.053 1.00 0.00 H new ATOM 0 HG22 ILE A 355 -9.727 -5.070 6.920 1.00 0.00 H new ATOM 0 HG23 ILE A 355 -11.199 -5.291 5.944 1.00 0.00 H new ATOM 0 HD11 ILE A 355 -9.427 -7.392 2.330 1.00 0.00 H new ATOM 0 HD12 ILE A 355 -8.022 -6.715 3.187 1.00 0.00 H new ATOM 0 HD13 ILE A 355 -9.264 -7.616 4.088 1.00 0.00 H new ATOM 992 N ASP A 356 -7.882 -2.440 6.096 1.00 0.00 N ATOM 993 CA ASP A 356 -7.356 -1.745 7.258 1.00 0.00 C ATOM 994 C ASP A 356 -6.917 -0.337 6.850 1.00 0.00 C ATOM 995 O ASP A 356 -6.700 0.521 7.703 1.00 0.00 O ATOM 996 CB ASP A 356 -6.138 -2.472 7.831 1.00 0.00 C ATOM 997 CG ASP A 356 -6.433 -3.841 8.446 1.00 0.00 C ATOM 998 OD1 ASP A 356 -7.402 -3.914 9.232 1.00 0.00 O ATOM 999 OD2 ASP A 356 -5.683 -4.785 8.116 1.00 0.00 O ATOM 0 H ASP A 356 -7.182 -2.698 5.401 1.00 0.00 H new ATOM 0 HA ASP A 356 -8.142 -1.708 8.012 1.00 0.00 H new ATOM 0 HB2 ASP A 356 -5.402 -2.598 7.037 1.00 0.00 H new ATOM 0 HB3 ASP A 356 -5.681 -1.839 8.592 1.00 0.00 H new ATOM 1004 N GLY A 357 -6.801 -0.144 5.544 1.00 0.00 N ATOM 1005 CA GLY A 357 -6.392 1.145 5.012 1.00 0.00 C ATOM 1006 C GLY A 357 -4.913 1.414 5.301 1.00 0.00 C ATOM 1007 O GLY A 357 -4.495 2.566 5.395 1.00 0.00 O ATOM 0 H GLY A 357 -6.983 -0.858 4.839 1.00 0.00 H new ATOM 0 HA2 GLY A 357 -6.566 1.170 3.936 1.00 0.00 H new ATOM 0 HA3 GLY A 357 -7.002 1.934 5.452 1.00 0.00 H new ATOM 1011 N ILE A 358 -4.163 0.330 5.435 1.00 0.00 N ATOM 1012 CA ILE A 358 -2.741 0.434 5.712 1.00 0.00 C ATOM 1013 C ILE A 358 -1.952 0.047 4.459 1.00 0.00 C ATOM 1014 O ILE A 358 -2.362 -0.841 3.712 1.00 0.00 O ATOM 1015 CB ILE A 358 -2.373 -0.390 6.948 1.00 0.00 C ATOM 1016 CG1 ILE A 358 -3.122 0.112 8.184 1.00 0.00 C ATOM 1017 CG2 ILE A 358 -0.859 -0.409 7.164 1.00 0.00 C ATOM 1018 CD1 ILE A 358 -3.050 -0.908 9.321 1.00 0.00 C ATOM 0 H ILE A 358 -4.514 -0.625 5.357 1.00 0.00 H new ATOM 0 HA ILE A 358 -2.475 1.463 5.953 1.00 0.00 H new ATOM 0 HB ILE A 358 -2.686 -1.420 6.777 1.00 0.00 H new ATOM 0 HG12 ILE A 358 -2.694 1.059 8.513 1.00 0.00 H new ATOM 0 HG13 ILE A 358 -4.164 0.304 7.929 1.00 0.00 H new ATOM 0 HG21 ILE A 358 -0.625 -1.001 8.049 1.00 0.00 H new ATOM 0 HG22 ILE A 358 -0.373 -0.849 6.293 1.00 0.00 H new ATOM 0 HG23 ILE A 358 -0.499 0.610 7.304 1.00 0.00 H new ATOM 0 HD11 ILE A 358 -3.590 -0.526 10.187 1.00 0.00 H new ATOM 0 HD12 ILE A 358 -3.500 -1.846 8.997 1.00 0.00 H new ATOM 0 HD13 ILE A 358 -2.008 -1.080 9.590 1.00 0.00 H new ATOM 1030 N VAL A 359 -0.835 0.733 4.267 1.00 0.00 N ATOM 1031 CA VAL A 359 0.015 0.472 3.117 1.00 0.00 C ATOM 1032 C VAL A 359 1.039 -0.605 3.479 1.00 0.00 C ATOM 1033 O VAL A 359 1.860 -0.411 4.374 1.00 0.00 O ATOM 1034 CB VAL A 359 0.660 1.774 2.637 1.00 0.00 C ATOM 1035 CG1 VAL A 359 1.771 1.494 1.623 1.00 0.00 C ATOM 1036 CG2 VAL A 359 -0.388 2.724 2.055 1.00 0.00 C ATOM 0 H VAL A 359 -0.499 1.469 4.888 1.00 0.00 H new ATOM 0 HA VAL A 359 -0.576 0.091 2.284 1.00 0.00 H new ATOM 0 HB VAL A 359 1.111 2.263 3.501 1.00 0.00 H new ATOM 0 HG11 VAL A 359 2.213 2.436 1.298 1.00 0.00 H new ATOM 0 HG12 VAL A 359 2.539 0.874 2.086 1.00 0.00 H new ATOM 0 HG13 VAL A 359 1.354 0.972 0.761 1.00 0.00 H new ATOM 0 HG21 VAL A 359 0.098 3.641 1.722 1.00 0.00 H new ATOM 0 HG22 VAL A 359 -0.882 2.247 1.209 1.00 0.00 H new ATOM 0 HG23 VAL A 359 -1.128 2.962 2.819 1.00 0.00 H new ATOM 1046 N HIS A 360 0.958 -1.718 2.764 1.00 0.00 N ATOM 1047 CA HIS A 360 1.867 -2.827 2.999 1.00 0.00 C ATOM 1048 C HIS A 360 3.137 -2.633 2.167 1.00 0.00 C ATOM 1049 O HIS A 360 3.102 -2.729 0.942 1.00 0.00 O ATOM 1050 CB HIS A 360 1.177 -4.164 2.724 1.00 0.00 C ATOM 1051 CG HIS A 360 0.693 -4.872 3.967 1.00 0.00 C ATOM 1052 ND1 HIS A 360 1.377 -5.929 4.541 1.00 0.00 N ATOM 1053 CD2 HIS A 360 -0.412 -4.663 4.738 1.00 0.00 C ATOM 1054 CE1 HIS A 360 0.704 -6.331 5.609 1.00 0.00 C ATOM 1055 NE2 HIS A 360 -0.405 -5.546 5.730 1.00 0.00 N ATOM 0 H HIS A 360 0.277 -1.875 2.022 1.00 0.00 H new ATOM 0 HA HIS A 360 2.160 -2.846 4.049 1.00 0.00 H new ATOM 0 HB2 HIS A 360 0.328 -3.994 2.061 1.00 0.00 H new ATOM 0 HB3 HIS A 360 1.870 -4.817 2.193 1.00 0.00 H new ATOM 0 HD2 HIS A 360 -1.165 -3.907 4.570 1.00 0.00 H new ATOM 0 HE1 HIS A 360 0.984 -7.139 6.269 1.00 0.00 H new ATOM 0 HE2 HIS A 360 -1.112 -5.624 6.461 1.00 0.00 H new ATOM 1063 N PHE A 361 4.229 -2.364 2.868 1.00 0.00 N ATOM 1064 CA PHE A 361 5.508 -2.157 2.210 1.00 0.00 C ATOM 1065 C PHE A 361 6.353 -3.432 2.238 1.00 0.00 C ATOM 1066 O PHE A 361 6.254 -4.226 3.172 1.00 0.00 O ATOM 1067 CB PHE A 361 6.237 -1.059 2.986 1.00 0.00 C ATOM 1068 CG PHE A 361 5.956 0.356 2.476 1.00 0.00 C ATOM 1069 CD1 PHE A 361 6.280 0.695 1.200 1.00 0.00 C ATOM 1070 CD2 PHE A 361 5.383 1.274 3.299 1.00 0.00 C ATOM 1071 CE1 PHE A 361 6.019 2.008 0.726 1.00 0.00 C ATOM 1072 CE2 PHE A 361 5.122 2.587 2.826 1.00 0.00 C ATOM 1073 CZ PHE A 361 5.445 2.927 1.549 1.00 0.00 C ATOM 0 H PHE A 361 4.254 -2.285 3.885 1.00 0.00 H new ATOM 0 HA PHE A 361 5.349 -1.882 1.167 1.00 0.00 H new ATOM 0 HB2 PHE A 361 5.950 -1.119 4.036 1.00 0.00 H new ATOM 0 HB3 PHE A 361 7.310 -1.245 2.937 1.00 0.00 H new ATOM 0 HD1 PHE A 361 6.736 -0.034 0.547 1.00 0.00 H new ATOM 0 HD2 PHE A 361 5.126 1.004 4.313 1.00 0.00 H new ATOM 0 HE1 PHE A 361 6.276 2.277 -0.288 1.00 0.00 H new ATOM 0 HE2 PHE A 361 4.667 3.316 3.480 1.00 0.00 H new ATOM 0 HZ PHE A 361 5.246 3.926 1.189 1.00 0.00 H new ATOM 1083 N GLU A 362 7.165 -3.589 1.203 1.00 0.00 N ATOM 1084 CA GLU A 362 8.026 -4.754 1.097 1.00 0.00 C ATOM 1085 C GLU A 362 9.292 -4.557 1.934 1.00 0.00 C ATOM 1086 O GLU A 362 9.774 -3.434 2.081 1.00 0.00 O ATOM 1087 CB GLU A 362 8.375 -5.048 -0.363 1.00 0.00 C ATOM 1088 CG GLU A 362 9.192 -3.907 -0.972 1.00 0.00 C ATOM 1089 CD GLU A 362 10.269 -4.446 -1.915 1.00 0.00 C ATOM 1090 OE1 GLU A 362 10.131 -5.620 -2.322 1.00 0.00 O ATOM 1091 OE2 GLU A 362 11.206 -3.673 -2.208 1.00 0.00 O ATOM 0 H GLU A 362 7.245 -2.928 0.430 1.00 0.00 H new ATOM 0 HA GLU A 362 7.486 -5.616 1.488 1.00 0.00 H new ATOM 0 HB2 GLU A 362 8.940 -5.978 -0.425 1.00 0.00 H new ATOM 0 HB3 GLU A 362 7.460 -5.192 -0.938 1.00 0.00 H new ATOM 0 HG2 GLU A 362 8.531 -3.232 -1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 362 9.658 -3.324 -0.177 1.00 0.00 H new