USER MOD reduce.3.24.130724 H: found=0, std=0, add=767, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 771 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 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 14 TYR OH : rot -33:sc= 0.413 USER MOD Single : A 17 ASN : amide:sc= -1.81! X(o=-1.8!,f=-1.8) USER MOD Single : A 19 ASN :FLIP amide:sc= -2.39! C(o=-3!,f=-2.4!) USER MOD Single : A 23 THR OG1 : rot 180:sc= -0.243 USER MOD Single : A 29 THR OG1 : rot -46:sc= 0.706 USER MOD Single : A 32 SER OG : rot 120:sc= -0.7 USER MOD Single : A 34 TYR OH : rot 116:sc= 1.15 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 147:sc= -0.259 (180deg=-1.4!) USER MOD Single : A 59 TYR OH : rot 130:sc= -3.88! USER MOD Single : A 62 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 64 SER OG : rot -58:sc= 0.0417 USER MOD Single : A 65 THR OG1 : rot -88:sc= 1.16 USER MOD Single : A 71 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.1) USER MOD Single : A 73 ASN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 HIS : no HD1:sc= -0.108 X(o=-0.11,f=-0.12) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot -120:sc= -0.861 USER MOD Single : B 314 MET CE :methyl 159:sc= -0.111 (180deg=-0.504) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 162:sc= -0.0565 (180deg=-0.449) USER MOD Single : B 335 LYS NZ :NH3+ -166:sc= -0.0031 (180deg=-0.163) USER MOD Single : B 336 GLN : amide:sc= -0.201 X(o=-0.2,f=-0.29) USER MOD Single : B 337 ASN : amide:sc= -1.5! C(o=-1.5!,f=-3.7!) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -1.004 -16.744 -2.843 1.00 0.00 N ATOM 143 CA ALA A 11 -0.282 -17.474 -1.810 1.00 0.00 C ATOM 144 C ALA A 11 -0.916 -17.228 -0.435 1.00 0.00 C ATOM 145 O ALA A 11 -1.372 -16.122 -0.141 1.00 0.00 O ATOM 146 CB ALA A 11 1.199 -17.037 -1.797 1.00 0.00 C ATOM 0 HA ALA A 11 -0.338 -18.540 -2.031 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.734 -17.587 -1.022 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.649 -17.247 -2.767 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.261 -15.968 -1.592 1.00 0.00 H new ATOM 152 N TYR A 12 -0.933 -18.261 0.408 1.00 0.00 N ATOM 153 CA TYR A 12 -1.502 -18.144 1.758 1.00 0.00 C ATOM 154 C TYR A 12 -0.524 -18.660 2.810 1.00 0.00 C ATOM 155 O TYR A 12 0.237 -19.593 2.556 1.00 0.00 O ATOM 156 CB TYR A 12 -2.807 -18.947 1.849 1.00 0.00 C ATOM 157 CG TYR A 12 -3.867 -18.303 0.984 1.00 0.00 C ATOM 158 CD1 TYR A 12 -3.987 -18.660 -0.364 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.728 -17.344 1.532 1.00 0.00 C ATOM 160 CE1 TYR A 12 -4.968 -18.060 -1.163 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.711 -16.747 0.735 1.00 0.00 C ATOM 162 CZ TYR A 12 -5.829 -17.103 -0.614 1.00 0.00 C ATOM 163 OH TYR A 12 -6.793 -16.510 -1.402 1.00 0.00 O ATOM 0 H TYR A 12 -0.562 -19.185 0.185 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.701 -17.089 1.949 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.636 -19.974 1.526 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.146 -18.991 2.884 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -3.323 -19.398 -0.788 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -4.633 -17.065 2.571 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -5.060 -18.336 -2.203 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -6.378 -16.012 1.160 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.306 -15.870 -0.866 1.00 0.00 H new ATOM 173 N ILE A 13 -0.544 -18.044 3.997 1.00 0.00 N ATOM 174 CA ILE A 13 0.348 -18.460 5.089 1.00 0.00 C ATOM 175 C ILE A 13 -0.422 -19.380 6.036 1.00 0.00 C ATOM 176 O ILE A 13 -1.451 -18.990 6.592 1.00 0.00 O ATOM 177 CB ILE A 13 0.885 -17.227 5.867 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.880 -16.005 4.953 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.328 -17.490 6.341 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.570 -14.837 5.659 1.00 0.00 C ATOM 0 H ILE A 13 -1.160 -17.264 4.226 1.00 0.00 H new ATOM 0 HA ILE A 13 1.202 -18.990 4.667 1.00 0.00 H new ATOM 0 HB ILE A 13 0.245 -17.049 6.731 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.394 -16.234 4.019 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.144 -15.734 4.696 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.696 -16.620 6.885 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.343 -18.361 6.996 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.967 -17.675 5.477 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.567 -13.964 5.006 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.037 -14.603 6.581 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.599 -15.110 5.894 1.00 0.00 H new ATOM 192 N TYR A 14 0.083 -20.597 6.216 1.00 0.00 N ATOM 193 CA TYR A 14 -0.567 -21.561 7.097 1.00 0.00 C ATOM 194 C TYR A 14 -0.194 -21.303 8.549 1.00 0.00 C ATOM 195 O TYR A 14 0.982 -21.335 8.914 1.00 0.00 O ATOM 196 CB TYR A 14 -0.152 -22.983 6.715 1.00 0.00 C ATOM 197 CG TYR A 14 -0.789 -23.971 7.662 1.00 0.00 C ATOM 198 CD1 TYR A 14 -2.077 -24.455 7.411 1.00 0.00 C ATOM 199 CD2 TYR A 14 -0.090 -24.403 8.796 1.00 0.00 C ATOM 200 CE1 TYR A 14 -2.666 -25.371 8.289 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.679 -25.319 9.676 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.967 -25.803 9.422 1.00 0.00 C ATOM 203 OH TYR A 14 -2.549 -26.707 10.289 1.00 0.00 O ATOM 0 H TYR A 14 0.934 -20.937 5.767 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.645 -21.450 6.984 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -0.457 -23.198 5.691 1.00 0.00 H new ATOM 0 HB3 TYR A 14 0.933 -23.078 6.751 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -2.618 -24.121 6.538 1.00 0.00 H new ATOM 0 HD2 TYR A 14 0.904 -24.029 8.992 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.660 -25.745 8.093 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -0.139 -25.652 10.550 1.00 0.00 H new ATOM 0 HH TYR A 14 -3.517 -26.557 10.317 1.00 0.00 H new ATOM 213 N ILE A 15 -1.204 -21.050 9.381 1.00 0.00 N ATOM 214 CA ILE A 15 -0.966 -20.790 10.805 1.00 0.00 C ATOM 215 C ILE A 15 -1.511 -21.947 11.636 1.00 0.00 C ATOM 216 O ILE A 15 -2.708 -22.222 11.613 1.00 0.00 O ATOM 217 CB ILE A 15 -1.646 -19.480 11.215 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.083 -18.327 10.373 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.371 -19.210 12.695 1.00 0.00 C ATOM 220 CD1 ILE A 15 -1.951 -17.079 10.566 1.00 0.00 C ATOM 0 H ILE A 15 -2.184 -21.019 9.101 1.00 0.00 H new ATOM 0 HA ILE A 15 0.106 -20.700 10.981 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.721 -19.559 11.051 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.055 -18.116 10.667 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.062 -18.609 9.320 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.853 -18.278 12.991 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.767 -20.030 13.294 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.296 -19.129 12.856 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.550 -16.261 9.968 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -2.972 -17.293 10.250 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -1.949 -16.794 11.618 1.00 0.00 H new ATOM 232 N GLY A 16 -0.623 -22.622 12.374 1.00 0.00 N ATOM 233 CA GLY A 16 -1.024 -23.761 13.213 1.00 0.00 C ATOM 234 C GLY A 16 -0.792 -23.472 14.689 1.00 0.00 C ATOM 235 O GLY A 16 -0.305 -22.399 15.051 1.00 0.00 O ATOM 0 H GLY A 16 0.373 -22.403 12.409 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.078 -23.985 13.046 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.460 -24.647 12.921 1.00 0.00 H new ATOM 239 N ASN A 17 -1.141 -24.435 15.540 1.00 0.00 N ATOM 240 CA ASN A 17 -0.963 -24.278 16.977 1.00 0.00 C ATOM 241 C ASN A 17 -1.682 -23.028 17.463 1.00 0.00 C ATOM 242 O ASN A 17 -1.141 -22.259 18.258 1.00 0.00 O ATOM 243 CB ASN A 17 0.529 -24.175 17.315 1.00 0.00 C ATOM 244 CG ASN A 17 0.762 -24.538 18.780 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.636 -25.703 19.156 1.00 0.00 O ATOM 246 ND2 ASN A 17 1.090 -23.608 19.631 1.00 0.00 N ATOM 0 H ASN A 17 -1.547 -25.327 15.258 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.386 -25.150 17.476 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.102 -24.842 16.671 1.00 0.00 H new ATOM 0 HB3 ASN A 17 0.884 -23.163 17.122 1.00 0.00 H new ATOM 0 HD21 ASN A 17 1.243 -23.845 20.611 1.00 0.00 H new ATOM 0 HD22 ASN A 17 1.194 -22.643 19.317 1.00 0.00 H new ATOM 253 N LEU A 18 -2.902 -22.828 16.980 1.00 0.00 N ATOM 254 CA LEU A 18 -3.683 -21.664 17.372 1.00 0.00 C ATOM 255 C LEU A 18 -4.638 -22.022 18.508 1.00 0.00 C ATOM 256 O LEU A 18 -5.469 -22.920 18.374 1.00 0.00 O ATOM 257 CB LEU A 18 -4.486 -21.142 16.173 1.00 0.00 C ATOM 258 CG LEU A 18 -5.373 -19.946 16.616 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.297 -18.830 15.570 1.00 0.00 C ATOM 260 CD2 LEU A 18 -6.834 -20.401 16.760 1.00 0.00 C ATOM 0 H LEU A 18 -3.368 -23.452 16.321 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.999 -20.888 17.715 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.809 -20.830 15.378 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -5.109 -21.938 15.766 1.00 0.00 H new ATOM 0 HG LEU A 18 -5.011 -19.576 17.575 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.921 -17.993 15.885 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -4.265 -18.495 15.469 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.652 -19.206 14.610 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -7.449 -19.557 17.071 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -7.193 -20.779 15.803 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.897 -21.191 17.509 1.00 0.00 H new ATOM 272 N ASN A 19 -4.510 -21.314 19.623 1.00 0.00 N ATOM 273 CA ASN A 19 -5.366 -21.564 20.776 1.00 0.00 C ATOM 274 C ASN A 19 -6.747 -20.954 20.564 1.00 0.00 C ATOM 275 O ASN A 19 -6.875 -19.877 19.982 1.00 0.00 O ATOM 276 CB ASN A 19 -4.732 -20.971 22.036 1.00 0.00 C ATOM 277 CG ASN A 19 -5.418 -21.532 23.278 1.00 0.00 C ATOM 278 OD1 ASN A 19 -5.540 -20.783 24.339 1.00 0.00 O flip ATOM 279 ND2 ASN A 19 -5.851 -22.684 23.281 1.00 0.00 N flip ATOM 0 H ASN A 19 -3.827 -20.568 19.754 1.00 0.00 H new ATOM 0 HA ASN A 19 -5.474 -22.642 20.896 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.668 -21.204 22.062 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -4.820 -19.885 22.021 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -5.754 -23.267 22.450 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -6.307 -23.055 24.115 1.00 0.00 H new ATOM 286 N ARG A 20 -7.778 -21.647 21.040 1.00 0.00 N ATOM 287 CA ARG A 20 -9.146 -21.161 20.899 1.00 0.00 C ATOM 288 C ARG A 20 -9.298 -19.799 21.564 1.00 0.00 C ATOM 289 O ARG A 20 -10.248 -19.065 21.287 1.00 0.00 O ATOM 290 CB ARG A 20 -10.121 -22.154 21.534 1.00 0.00 C ATOM 291 CG ARG A 20 -9.848 -22.248 23.036 1.00 0.00 C ATOM 292 CD ARG A 20 -10.636 -23.419 23.627 1.00 0.00 C ATOM 293 NE ARG A 20 -12.071 -23.172 23.511 1.00 0.00 N ATOM 294 CZ ARG A 20 -12.730 -22.491 24.445 1.00 0.00 C ATOM 295 NH1 ARG A 20 -12.094 -22.028 25.487 1.00 0.00 N ATOM 296 NH2 ARG A 20 -14.013 -22.284 24.321 1.00 0.00 N ATOM 0 H ARG A 20 -7.693 -22.541 21.524 1.00 0.00 H new ATOM 0 HA ARG A 20 -9.371 -21.062 19.837 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -11.148 -21.833 21.360 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -10.010 -23.135 21.071 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.782 -22.387 23.214 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -10.135 -21.318 23.527 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.375 -24.341 23.108 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -10.367 -23.556 24.674 1.00 0.00 H new ATOM 0 HE ARG A 20 -12.577 -23.528 22.700 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -11.091 -22.188 25.585 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -12.600 -21.506 26.203 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -14.511 -22.645 23.507 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -14.517 -21.762 25.038 1.00 0.00 H new ATOM 310 N GLU A 21 -8.359 -19.469 22.441 1.00 0.00 N ATOM 311 CA GLU A 21 -8.397 -18.190 23.139 1.00 0.00 C ATOM 312 C GLU A 21 -8.172 -17.042 22.163 1.00 0.00 C ATOM 313 O GLU A 21 -8.668 -15.934 22.368 1.00 0.00 O ATOM 314 CB GLU A 21 -7.324 -18.158 24.229 1.00 0.00 C ATOM 315 CG GLU A 21 -7.661 -19.185 25.314 1.00 0.00 C ATOM 316 CD GLU A 21 -8.922 -18.760 26.062 1.00 0.00 C ATOM 317 OE1 GLU A 21 -9.231 -17.580 26.036 1.00 0.00 O ATOM 318 OE2 GLU A 21 -9.558 -19.619 26.647 1.00 0.00 O ATOM 0 H GLU A 21 -7.567 -20.064 22.685 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.380 -18.074 23.596 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -6.347 -18.377 23.798 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.264 -17.161 24.665 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.809 -20.167 24.864 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -6.828 -19.276 26.011 1.00 0.00 H new ATOM 325 N LEU A 22 -7.417 -17.311 21.099 1.00 0.00 N ATOM 326 CA LEU A 22 -7.127 -16.287 20.102 1.00 0.00 C ATOM 327 C LEU A 22 -8.255 -16.203 19.079 1.00 0.00 C ATOM 328 O LEU A 22 -8.724 -17.223 18.574 1.00 0.00 O ATOM 329 CB LEU A 22 -5.811 -16.615 19.390 1.00 0.00 C ATOM 330 CG LEU A 22 -4.711 -16.867 20.431 1.00 0.00 C ATOM 331 CD1 LEU A 22 -3.404 -17.213 19.716 1.00 0.00 C ATOM 332 CD2 LEU A 22 -4.507 -15.606 21.289 1.00 0.00 C ATOM 0 H LEU A 22 -6.999 -18.222 20.908 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.038 -15.325 20.607 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.937 -17.495 18.759 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.525 -15.792 18.736 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.007 -17.696 21.074 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.622 -17.392 20.454 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.546 -18.110 19.112 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.111 -16.384 19.071 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.725 -15.790 22.026 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.213 -14.774 20.649 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -5.437 -15.360 21.801 1.00 0.00 H new ATOM 344 N THR A 23 -8.691 -14.981 18.777 1.00 0.00 N ATOM 345 CA THR A 23 -9.772 -14.768 17.809 1.00 0.00 C ATOM 346 C THR A 23 -9.229 -14.181 16.509 1.00 0.00 C ATOM 347 O THR A 23 -8.024 -13.960 16.373 1.00 0.00 O ATOM 348 CB THR A 23 -10.825 -13.827 18.401 1.00 0.00 C ATOM 349 OG1 THR A 23 -11.842 -13.593 17.438 1.00 0.00 O ATOM 350 CG2 THR A 23 -10.167 -12.501 18.784 1.00 0.00 C ATOM 0 H THR A 23 -8.316 -14.125 19.185 1.00 0.00 H new ATOM 0 HA THR A 23 -10.230 -15.732 17.589 1.00 0.00 H new ATOM 0 HB THR A 23 -11.263 -14.282 19.289 1.00 0.00 H new ATOM 0 HG1 THR A 23 -12.518 -12.992 17.816 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.917 -11.831 19.205 1.00 0.00 H new ATOM 0 HG22 THR A 23 -9.386 -12.682 19.523 1.00 0.00 H new ATOM 0 HG23 THR A 23 -9.729 -12.043 17.897 1.00 0.00 H new ATOM 358 N GLU A 24 -10.122 -13.929 15.559 1.00 0.00 N ATOM 359 CA GLU A 24 -9.718 -13.366 14.276 1.00 0.00 C ATOM 360 C GLU A 24 -9.113 -11.979 14.465 1.00 0.00 C ATOM 361 O GLU A 24 -8.122 -11.630 13.823 1.00 0.00 O ATOM 362 CB GLU A 24 -10.928 -13.272 13.344 1.00 0.00 C ATOM 363 CG GLU A 24 -11.373 -14.680 12.941 1.00 0.00 C ATOM 364 CD GLU A 24 -12.636 -14.602 12.091 1.00 0.00 C ATOM 365 OE1 GLU A 24 -13.221 -13.534 12.026 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.002 -15.616 11.517 1.00 0.00 O ATOM 0 H GLU A 24 -11.123 -14.104 15.651 1.00 0.00 H new ATOM 0 HA GLU A 24 -8.967 -14.021 13.834 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -11.745 -12.750 13.843 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.673 -12.692 12.457 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -10.579 -15.176 12.383 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.560 -15.280 13.831 1.00 0.00 H new ATOM 373 N GLY A 25 -9.716 -11.194 15.350 1.00 0.00 N ATOM 374 CA GLY A 25 -9.229 -9.845 15.616 1.00 0.00 C ATOM 375 C GLY A 25 -7.809 -9.877 16.171 1.00 0.00 C ATOM 376 O GLY A 25 -6.969 -9.057 15.798 1.00 0.00 O ATOM 0 H GLY A 25 -10.537 -11.465 15.892 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.251 -9.259 14.697 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.890 -9.349 16.327 1.00 0.00 H new ATOM 380 N ASP A 26 -7.549 -10.826 17.065 1.00 0.00 N ATOM 381 CA ASP A 26 -6.226 -10.956 17.666 1.00 0.00 C ATOM 382 C ASP A 26 -5.188 -11.294 16.602 1.00 0.00 C ATOM 383 O ASP A 26 -4.091 -10.737 16.593 1.00 0.00 O ATOM 384 CB ASP A 26 -6.239 -12.051 18.731 1.00 0.00 C ATOM 385 CG ASP A 26 -4.910 -12.067 19.477 1.00 0.00 C ATOM 386 OD1 ASP A 26 -4.704 -11.191 20.301 1.00 0.00 O ATOM 387 OD2 ASP A 26 -4.115 -12.954 19.212 1.00 0.00 O ATOM 0 H ASP A 26 -8.232 -11.512 17.388 1.00 0.00 H new ATOM 0 HA ASP A 26 -5.963 -10.004 18.128 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.057 -11.879 19.431 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -6.416 -13.021 18.266 1.00 0.00 H new ATOM 392 N ILE A 27 -5.545 -12.209 15.709 1.00 0.00 N ATOM 393 CA ILE A 27 -4.637 -12.614 14.643 1.00 0.00 C ATOM 394 C ILE A 27 -4.296 -11.420 13.760 1.00 0.00 C ATOM 395 O ILE A 27 -3.140 -11.224 13.391 1.00 0.00 O ATOM 396 CB ILE A 27 -5.277 -13.716 13.794 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.373 -15.015 14.611 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.425 -13.970 12.543 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.284 -16.026 13.886 1.00 0.00 C ATOM 0 H ILE A 27 -6.449 -12.681 15.701 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.722 -12.997 15.094 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.276 -13.397 13.497 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.380 -15.442 14.749 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.770 -14.802 15.604 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -4.885 -14.755 11.943 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.360 -13.054 11.955 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.424 -14.281 12.842 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.347 -16.944 14.471 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.281 -15.600 13.771 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -5.869 -16.250 12.903 1.00 0.00 H new ATOM 411 N LEU A 28 -5.309 -10.629 13.426 1.00 0.00 N ATOM 412 CA LEU A 28 -5.095 -9.466 12.579 1.00 0.00 C ATOM 413 C LEU A 28 -4.069 -8.536 13.208 1.00 0.00 C ATOM 414 O LEU A 28 -3.149 -8.082 12.534 1.00 0.00 O ATOM 415 CB LEU A 28 -6.431 -8.709 12.379 1.00 0.00 C ATOM 416 CG LEU A 28 -7.278 -9.390 11.275 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.763 -9.057 11.472 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.834 -8.882 9.892 1.00 0.00 C ATOM 0 H LEU A 28 -6.274 -10.770 13.725 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.721 -9.802 11.612 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -6.989 -8.690 13.315 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.232 -7.673 12.106 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.133 -10.469 11.338 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.351 -9.540 10.691 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.090 -9.417 12.448 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.904 -7.978 11.417 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.432 -9.363 9.118 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -6.973 -7.802 9.839 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.782 -9.120 9.738 1.00 0.00 H new ATOM 430 N THR A 29 -4.223 -8.267 14.501 1.00 0.00 N ATOM 431 CA THR A 29 -3.301 -7.383 15.205 1.00 0.00 C ATOM 432 C THR A 29 -1.874 -7.912 15.137 1.00 0.00 C ATOM 433 O THR A 29 -0.929 -7.149 14.936 1.00 0.00 O ATOM 434 CB THR A 29 -3.716 -7.255 16.671 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.015 -6.683 16.746 1.00 0.00 O ATOM 436 CG2 THR A 29 -2.717 -6.362 17.409 1.00 0.00 C ATOM 0 H THR A 29 -4.973 -8.646 15.079 1.00 0.00 H new ATOM 0 HA THR A 29 -3.338 -6.407 14.721 1.00 0.00 H new ATOM 0 HB THR A 29 -3.728 -8.242 17.134 1.00 0.00 H new ATOM 0 HG1 THR A 29 -5.065 -5.906 16.151 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.013 -6.271 18.454 1.00 0.00 H new ATOM 0 HG22 THR A 29 -1.722 -6.804 17.351 1.00 0.00 H new ATOM 0 HG23 THR A 29 -2.703 -5.374 16.949 1.00 0.00 H new ATOM 444 N VAL A 30 -1.726 -9.216 15.310 1.00 0.00 N ATOM 445 CA VAL A 30 -0.405 -9.826 15.276 1.00 0.00 C ATOM 446 C VAL A 30 0.271 -9.618 13.921 1.00 0.00 C ATOM 447 O VAL A 30 1.419 -9.187 13.849 1.00 0.00 O ATOM 448 CB VAL A 30 -0.531 -11.330 15.552 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.822 -12.007 15.325 1.00 0.00 C ATOM 450 CG2 VAL A 30 -0.974 -11.547 17.000 1.00 0.00 C ATOM 0 H VAL A 30 -2.494 -9.867 15.474 1.00 0.00 H new ATOM 0 HA VAL A 30 0.208 -9.350 16.041 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.270 -11.762 14.877 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.732 -13.075 15.521 1.00 0.00 H new ATOM 0 HG12 VAL A 30 1.137 -11.853 14.293 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.562 -11.576 15.999 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.064 -12.615 17.197 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.236 -11.114 17.675 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.939 -11.066 17.161 1.00 0.00 H new ATOM 460 N PHE A 31 -0.446 -9.923 12.852 1.00 0.00 N ATOM 461 CA PHE A 31 0.094 -9.776 11.501 1.00 0.00 C ATOM 462 C PHE A 31 -0.024 -8.332 11.003 1.00 0.00 C ATOM 463 O PHE A 31 0.595 -7.954 10.007 1.00 0.00 O ATOM 464 CB PHE A 31 -0.652 -10.715 10.542 1.00 0.00 C ATOM 465 CG PHE A 31 -0.179 -12.136 10.749 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.684 -12.900 11.806 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.770 -12.690 9.879 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.243 -14.214 11.996 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.211 -14.004 10.067 1.00 0.00 C ATOM 470 CZ PHE A 31 0.704 -14.766 11.127 1.00 0.00 C ATOM 0 H PHE A 31 -1.403 -10.274 12.888 1.00 0.00 H new ATOM 0 HA PHE A 31 1.152 -10.038 11.530 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.726 -10.650 10.716 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.478 -10.410 9.510 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.416 -12.475 12.477 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.161 -12.101 9.062 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.634 -14.802 12.813 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.942 -14.430 9.396 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.044 -15.780 11.274 1.00 0.00 H new ATOM 480 N SER A 32 -0.830 -7.532 11.692 1.00 0.00 N ATOM 481 CA SER A 32 -1.043 -6.143 11.285 1.00 0.00 C ATOM 482 C SER A 32 0.274 -5.391 11.039 1.00 0.00 C ATOM 483 O SER A 32 0.500 -4.849 9.949 1.00 0.00 O ATOM 484 CB SER A 32 -1.822 -5.398 12.366 1.00 0.00 C ATOM 485 OG SER A 32 -2.007 -4.046 11.969 1.00 0.00 O ATOM 0 H SER A 32 -1.343 -7.815 12.527 1.00 0.00 H new ATOM 0 HA SER A 32 -1.601 -6.175 10.349 1.00 0.00 H new ATOM 0 HB2 SER A 32 -2.788 -5.876 12.528 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.283 -5.440 13.312 1.00 0.00 H new ATOM 0 HG SER A 32 -2.966 -3.850 11.911 1.00 0.00 H new ATOM 491 N GLU A 33 1.143 -5.372 12.046 1.00 0.00 N ATOM 492 CA GLU A 33 2.429 -4.676 11.933 1.00 0.00 C ATOM 493 C GLU A 33 3.362 -5.371 10.954 1.00 0.00 C ATOM 494 O GLU A 33 4.341 -4.788 10.485 1.00 0.00 O ATOM 495 CB GLU A 33 3.104 -4.608 13.306 1.00 0.00 C ATOM 496 CG GLU A 33 3.515 -6.016 13.744 1.00 0.00 C ATOM 497 CD GLU A 33 3.939 -6.005 15.209 1.00 0.00 C ATOM 498 OE1 GLU A 33 3.065 -5.927 16.057 1.00 0.00 O ATOM 499 OE2 GLU A 33 5.131 -6.071 15.460 1.00 0.00 O ATOM 0 H GLU A 33 0.985 -5.826 12.945 1.00 0.00 H new ATOM 0 HA GLU A 33 2.228 -3.672 11.560 1.00 0.00 H new ATOM 0 HB2 GLU A 33 3.979 -3.960 13.261 1.00 0.00 H new ATOM 0 HB3 GLU A 33 2.422 -4.173 14.037 1.00 0.00 H new ATOM 0 HG2 GLU A 33 2.684 -6.707 13.603 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.336 -6.374 13.122 1.00 0.00 H new ATOM 506 N TYR A 34 3.059 -6.622 10.651 1.00 0.00 N ATOM 507 CA TYR A 34 3.880 -7.417 9.741 1.00 0.00 C ATOM 508 C TYR A 34 3.190 -7.605 8.396 1.00 0.00 C ATOM 509 O TYR A 34 3.340 -8.649 7.760 1.00 0.00 O ATOM 510 CB TYR A 34 4.196 -8.773 10.373 1.00 0.00 C ATOM 511 CG TYR A 34 5.024 -8.568 11.630 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.295 -7.983 11.549 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.519 -8.972 12.871 1.00 0.00 C ATOM 514 CE1 TYR A 34 7.058 -7.798 12.709 1.00 0.00 C ATOM 515 CE2 TYR A 34 5.283 -8.784 14.031 1.00 0.00 C ATOM 516 CZ TYR A 34 6.551 -8.199 13.950 1.00 0.00 C ATOM 517 OH TYR A 34 7.303 -8.017 15.092 1.00 0.00 O ATOM 0 H TYR A 34 2.247 -7.115 11.022 1.00 0.00 H new ATOM 0 HA TYR A 34 4.812 -6.880 9.564 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.271 -9.297 10.616 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.740 -9.398 9.665 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.687 -7.674 10.591 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.542 -9.428 12.935 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.037 -7.346 12.646 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.892 -9.092 14.990 1.00 0.00 H new ATOM 0 HH TYR A 34 6.842 -7.393 15.691 1.00 0.00 H new ATOM 527 N GLY A 35 2.419 -6.598 7.970 1.00 0.00 N ATOM 528 CA GLY A 35 1.707 -6.715 6.697 1.00 0.00 C ATOM 529 C GLY A 35 0.261 -7.125 6.911 1.00 0.00 C ATOM 530 O GLY A 35 -0.119 -8.260 6.627 1.00 0.00 O ATOM 0 H GLY A 35 2.276 -5.721 8.470 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.743 -5.762 6.169 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.206 -7.449 6.065 1.00 0.00 H new ATOM 534 N VAL A 36 -0.540 -6.198 7.429 1.00 0.00 N ATOM 535 CA VAL A 36 -1.929 -6.507 7.724 1.00 0.00 C ATOM 536 C VAL A 36 -2.631 -7.102 6.489 1.00 0.00 C ATOM 537 O VAL A 36 -2.618 -6.514 5.408 1.00 0.00 O ATOM 538 CB VAL A 36 -2.661 -5.211 8.132 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.902 -4.326 6.898 1.00 0.00 C ATOM 540 CG2 VAL A 36 -4.005 -5.574 8.774 1.00 0.00 C ATOM 0 H VAL A 36 -0.255 -5.244 7.649 1.00 0.00 H new ATOM 0 HA VAL A 36 -1.957 -7.236 8.534 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.047 -4.660 8.844 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.419 -3.415 7.199 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.946 -4.067 6.443 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.512 -4.868 6.175 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.527 -4.663 9.065 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.612 -6.128 8.058 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.832 -6.190 9.656 1.00 0.00 H new ATOM 550 N PRO A 37 -3.234 -8.280 6.642 1.00 0.00 N ATOM 551 CA PRO A 37 -3.934 -8.990 5.534 1.00 0.00 C ATOM 552 C PRO A 37 -5.260 -8.335 5.187 1.00 0.00 C ATOM 553 O PRO A 37 -5.836 -7.602 5.989 1.00 0.00 O ATOM 554 CB PRO A 37 -4.151 -10.408 6.077 1.00 0.00 C ATOM 555 CG PRO A 37 -4.203 -10.257 7.560 1.00 0.00 C ATOM 556 CD PRO A 37 -3.311 -9.063 7.902 1.00 0.00 C ATOM 0 HA PRO A 37 -3.355 -8.972 4.611 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.075 -10.839 5.693 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.341 -11.072 5.777 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -5.225 -10.088 7.898 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -3.849 -11.161 8.055 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.736 -8.470 8.712 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -2.323 -9.387 8.228 1.00 0.00 H new ATOM 564 N VAL A 38 -5.741 -8.606 3.983 1.00 0.00 N ATOM 565 CA VAL A 38 -7.009 -8.040 3.534 1.00 0.00 C ATOM 566 C VAL A 38 -8.149 -9.020 3.787 1.00 0.00 C ATOM 567 O VAL A 38 -9.320 -8.641 3.762 1.00 0.00 O ATOM 568 CB VAL A 38 -6.934 -7.713 2.045 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.915 -6.596 1.817 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.503 -8.960 1.272 1.00 0.00 C ATOM 0 H VAL A 38 -5.279 -9.209 3.302 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.200 -7.126 4.096 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.914 -7.387 1.695 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.862 -6.363 0.753 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.220 -5.707 2.368 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.935 -6.921 2.166 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.449 -8.728 0.208 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.524 -9.285 1.623 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.229 -9.757 1.433 1.00 0.00 H new ATOM 580 N ASP A 39 -7.799 -10.281 4.030 1.00 0.00 N ATOM 581 CA ASP A 39 -8.802 -11.308 4.289 1.00 0.00 C ATOM 582 C ASP A 39 -8.174 -12.512 4.991 1.00 0.00 C ATOM 583 O ASP A 39 -7.118 -12.996 4.588 1.00 0.00 O ATOM 584 CB ASP A 39 -9.439 -11.758 2.973 1.00 0.00 C ATOM 585 CG ASP A 39 -10.610 -12.694 3.255 1.00 0.00 C ATOM 586 OD1 ASP A 39 -11.540 -12.264 3.917 1.00 0.00 O ATOM 587 OD2 ASP A 39 -10.559 -13.826 2.804 1.00 0.00 O ATOM 0 H ASP A 39 -6.835 -10.614 4.053 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.568 -10.884 4.939 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.783 -10.890 2.410 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.698 -12.265 2.355 1.00 0.00 H new ATOM 592 N VAL A 40 -8.829 -12.995 6.047 1.00 0.00 N ATOM 593 CA VAL A 40 -8.325 -14.153 6.797 1.00 0.00 C ATOM 594 C VAL A 40 -9.398 -15.232 6.892 1.00 0.00 C ATOM 595 O VAL A 40 -10.505 -14.979 7.371 1.00 0.00 O ATOM 596 CB VAL A 40 -7.898 -13.719 8.205 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.379 -14.932 8.982 1.00 0.00 C ATOM 598 CG2 VAL A 40 -6.791 -12.669 8.100 1.00 0.00 C ATOM 0 H VAL A 40 -9.703 -12.608 6.403 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.463 -14.561 6.270 1.00 0.00 H new ATOM 0 HB VAL A 40 -8.755 -13.295 8.728 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.076 -14.621 9.982 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.168 -15.680 9.058 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.523 -15.359 8.460 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -6.487 -12.360 9.100 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -5.935 -13.094 7.575 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.161 -11.804 7.550 1.00 0.00 H new ATOM 608 N ILE A 41 -9.067 -16.441 6.436 1.00 0.00 N ATOM 609 CA ILE A 41 -10.020 -17.554 6.471 1.00 0.00 C ATOM 610 C ILE A 41 -9.752 -18.440 7.678 1.00 0.00 C ATOM 611 O ILE A 41 -8.662 -18.991 7.823 1.00 0.00 O ATOM 612 CB ILE A 41 -9.901 -18.390 5.193 1.00 0.00 C ATOM 613 CG1 ILE A 41 -10.155 -17.497 3.976 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.937 -19.517 5.222 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.793 -18.259 2.696 1.00 0.00 C ATOM 0 H ILE A 41 -8.156 -16.675 6.042 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.027 -17.143 6.543 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.900 -18.817 5.130 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.201 -17.193 3.947 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.561 -16.586 4.050 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.853 -20.112 4.313 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.759 -20.153 6.089 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.938 -19.090 5.284 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.974 -17.622 1.830 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.740 -18.541 2.726 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.407 -19.157 2.621 1.00 0.00 H new ATOM 627 N LEU A 42 -10.755 -18.577 8.546 1.00 0.00 N ATOM 628 CA LEU A 42 -10.614 -19.405 9.746 1.00 0.00 C ATOM 629 C LEU A 42 -11.454 -20.675 9.611 1.00 0.00 C ATOM 630 O LEU A 42 -12.682 -20.624 9.650 1.00 0.00 O ATOM 631 CB LEU A 42 -11.061 -18.617 11.000 1.00 0.00 C ATOM 632 CG LEU A 42 -10.269 -19.102 12.249 1.00 0.00 C ATOM 633 CD1 LEU A 42 -9.033 -18.209 12.465 1.00 0.00 C ATOM 634 CD2 LEU A 42 -11.164 -19.036 13.492 1.00 0.00 C ATOM 0 H LEU A 42 -11.666 -18.130 8.443 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.565 -19.679 9.855 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -10.895 -17.551 10.847 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.130 -18.753 11.162 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.950 -20.131 12.085 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.483 -18.554 13.341 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.388 -18.262 11.588 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.351 -17.178 12.620 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -10.603 -19.377 14.362 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -11.491 -18.008 13.651 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -12.035 -19.676 13.348 1.00 0.00 H new ATOM 646 N SER A 43 -10.783 -21.811 9.455 1.00 0.00 N ATOM 647 CA SER A 43 -11.482 -23.084 9.318 1.00 0.00 C ATOM 648 C SER A 43 -12.105 -23.498 10.650 1.00 0.00 C ATOM 649 O SER A 43 -11.452 -23.445 11.698 1.00 0.00 O ATOM 650 CB SER A 43 -10.505 -24.162 8.849 1.00 0.00 C ATOM 651 OG SER A 43 -11.199 -25.395 8.711 1.00 0.00 O ATOM 0 H SER A 43 -9.766 -21.877 9.420 1.00 0.00 H new ATOM 0 HA SER A 43 -12.277 -22.968 8.581 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.057 -23.875 7.898 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.690 -24.268 9.566 1.00 0.00 H new ATOM 0 HG SER A 43 -10.576 -26.089 8.409 1.00 0.00 H new ATOM 657 N ARG A 44 -13.375 -23.909 10.606 1.00 0.00 N ATOM 658 CA ARG A 44 -14.078 -24.329 11.819 1.00 0.00 C ATOM 659 C ARG A 44 -14.905 -25.585 11.555 1.00 0.00 C ATOM 660 O ARG A 44 -15.443 -25.770 10.464 1.00 0.00 O ATOM 661 CB ARG A 44 -15.004 -23.209 12.295 1.00 0.00 C ATOM 662 CG ARG A 44 -14.195 -21.924 12.488 1.00 0.00 C ATOM 663 CD ARG A 44 -15.059 -20.875 13.191 1.00 0.00 C ATOM 664 NE ARG A 44 -16.292 -20.656 12.441 1.00 0.00 N ATOM 665 CZ ARG A 44 -16.333 -19.822 11.406 1.00 0.00 C ATOM 666 NH1 ARG A 44 -15.257 -19.180 11.042 1.00 0.00 N ATOM 667 NH2 ARG A 44 -17.450 -19.644 10.756 1.00 0.00 N ATOM 0 H ARG A 44 -13.932 -23.959 9.753 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.336 -24.548 12.587 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.798 -23.045 11.567 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -15.484 -23.493 13.231 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -13.302 -22.130 13.078 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -13.859 -21.545 11.523 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -15.294 -21.205 14.203 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -14.508 -19.939 13.280 1.00 0.00 H new ATOM 0 HE ARG A 44 -17.139 -21.153 12.716 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -14.384 -19.318 11.551 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -15.289 -18.540 10.248 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -18.292 -20.144 11.042 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -17.482 -19.004 9.962 1.00 0.00 H new ATOM 786 N GLY A 53 -8.001 -25.061 14.979 1.00 0.00 N ATOM 787 CA GLY A 53 -6.660 -24.934 15.554 1.00 0.00 C ATOM 788 C GLY A 53 -5.692 -24.293 14.567 1.00 0.00 C ATOM 789 O GLY A 53 -4.532 -24.040 14.897 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.707 -24.333 16.462 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.291 -25.918 15.841 1.00 0.00 H new ATOM 793 N PHE A 54 -6.171 -24.029 13.354 1.00 0.00 N ATOM 794 CA PHE A 54 -5.338 -23.410 12.324 1.00 0.00 C ATOM 795 C PHE A 54 -6.195 -22.576 11.376 1.00 0.00 C ATOM 796 O PHE A 54 -7.409 -22.761 11.298 1.00 0.00 O ATOM 797 CB PHE A 54 -4.585 -24.483 11.527 1.00 0.00 C ATOM 798 CG PHE A 54 -5.577 -25.383 10.827 1.00 0.00 C ATOM 799 CD1 PHE A 54 -6.180 -24.966 9.633 1.00 0.00 C ATOM 800 CD2 PHE A 54 -5.895 -26.634 11.371 1.00 0.00 C ATOM 801 CE1 PHE A 54 -7.099 -25.797 8.984 1.00 0.00 C ATOM 802 CE2 PHE A 54 -6.812 -27.467 10.719 1.00 0.00 C ATOM 803 CZ PHE A 54 -7.415 -27.048 9.526 1.00 0.00 C ATOM 0 H PHE A 54 -7.126 -24.232 13.060 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.615 -22.760 12.816 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -3.927 -24.013 10.797 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -3.954 -25.070 12.194 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -5.935 -24.002 9.213 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -5.433 -26.956 12.293 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -7.565 -25.473 8.065 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -7.055 -28.433 11.136 1.00 0.00 H new ATOM 0 HZ PHE A 54 -8.124 -27.690 9.025 1.00 0.00 H new ATOM 813 N ALA A 55 -5.555 -21.658 10.658 1.00 0.00 N ATOM 814 CA ALA A 55 -6.269 -20.796 9.720 1.00 0.00 C ATOM 815 C ALA A 55 -5.328 -20.283 8.628 1.00 0.00 C ATOM 816 O ALA A 55 -4.105 -20.367 8.764 1.00 0.00 O ATOM 817 CB ALA A 55 -6.878 -19.614 10.467 1.00 0.00 C ATOM 0 H ALA A 55 -4.550 -21.492 10.706 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.060 -21.380 9.250 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.410 -18.974 9.763 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.574 -19.980 11.222 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -6.086 -19.042 10.951 1.00 0.00 H new ATOM 823 N TYR A 56 -5.902 -19.748 7.543 1.00 0.00 N ATOM 824 CA TYR A 56 -5.099 -19.224 6.429 1.00 0.00 C ATOM 825 C TYR A 56 -5.094 -17.697 6.447 1.00 0.00 C ATOM 826 O TYR A 56 -6.129 -17.066 6.668 1.00 0.00 O ATOM 827 CB TYR A 56 -5.666 -19.711 5.098 1.00 0.00 C ATOM 828 CG TYR A 56 -5.636 -21.221 5.059 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.449 -21.890 4.742 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.798 -21.950 5.336 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.423 -23.289 4.707 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.771 -23.350 5.302 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.583 -24.019 4.986 1.00 0.00 C ATOM 834 OH TYR A 56 -5.556 -25.398 4.952 1.00 0.00 O ATOM 0 H TYR A 56 -6.910 -19.666 7.412 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.077 -19.586 6.543 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.688 -19.354 4.974 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -5.083 -19.304 4.272 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.553 -21.327 4.524 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.715 -21.433 5.576 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.506 -23.805 4.464 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.667 -23.913 5.520 1.00 0.00 H new ATOM 0 HH TYR A 56 -6.445 -25.748 5.171 1.00 0.00 H new ATOM 844 N LEU A 57 -3.923 -17.102 6.213 1.00 0.00 N ATOM 845 CA LEU A 57 -3.793 -15.637 6.210 1.00 0.00 C ATOM 846 C LEU A 57 -3.507 -15.112 4.795 1.00 0.00 C ATOM 847 O LEU A 57 -2.564 -15.562 4.142 1.00 0.00 O ATOM 848 CB LEU A 57 -2.659 -15.209 7.162 1.00 0.00 C ATOM 849 CG LEU A 57 -2.672 -13.656 7.365 1.00 0.00 C ATOM 850 CD1 LEU A 57 -2.350 -13.310 8.829 1.00 0.00 C ATOM 851 CD2 LEU A 57 -1.623 -12.994 6.448 1.00 0.00 C ATOM 0 H LEU A 57 -3.055 -17.604 6.024 1.00 0.00 H new ATOM 0 HA LEU A 57 -4.736 -15.211 6.551 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.775 -15.709 8.124 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.697 -15.521 6.755 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.665 -13.283 7.113 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -2.362 -12.228 8.958 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.097 -13.762 9.482 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.363 -13.695 9.085 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.640 -11.914 6.596 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.633 -13.378 6.691 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.855 -13.221 5.407 1.00 0.00 H new ATOM 863 N LYS A 58 -4.330 -14.158 4.323 1.00 0.00 N ATOM 864 CA LYS A 58 -4.153 -13.580 2.981 1.00 0.00 C ATOM 865 C LYS A 58 -3.408 -12.249 3.072 1.00 0.00 C ATOM 866 O LYS A 58 -3.955 -11.245 3.541 1.00 0.00 O ATOM 867 CB LYS A 58 -5.522 -13.359 2.309 1.00 0.00 C ATOM 868 CG LYS A 58 -5.359 -13.365 0.775 1.00 0.00 C ATOM 869 CD LYS A 58 -4.497 -12.169 0.339 1.00 0.00 C ATOM 870 CE LYS A 58 -4.774 -11.839 -1.132 1.00 0.00 C ATOM 871 NZ LYS A 58 -6.209 -11.472 -1.295 1.00 0.00 N ATOM 0 H LYS A 58 -5.117 -13.775 4.847 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.569 -14.277 2.381 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -6.217 -14.142 2.613 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -5.948 -12.410 2.635 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.894 -14.297 0.453 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -6.337 -13.314 0.296 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -4.718 -11.303 0.963 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -3.441 -12.401 0.477 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.138 -11.016 -1.458 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.533 -12.697 -1.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.302 -10.758 -2.046 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.757 -12.318 -1.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.572 -11.083 -0.401 1.00 0.00 H new ATOM 885 N TYR A 59 -2.159 -12.241 2.617 1.00 0.00 N ATOM 886 CA TYR A 59 -1.343 -11.029 2.660 1.00 0.00 C ATOM 887 C TYR A 59 -1.349 -10.316 1.310 1.00 0.00 C ATOM 888 O TYR A 59 -1.669 -10.913 0.283 1.00 0.00 O ATOM 889 CB TYR A 59 0.093 -11.386 3.029 1.00 0.00 C ATOM 890 CG TYR A 59 0.697 -12.235 1.935 1.00 0.00 C ATOM 891 CD1 TYR A 59 1.183 -11.630 0.770 1.00 0.00 C ATOM 892 CD2 TYR A 59 0.779 -13.623 2.090 1.00 0.00 C ATOM 893 CE1 TYR A 59 1.744 -12.414 -0.244 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.342 -14.406 1.076 1.00 0.00 C ATOM 895 CZ TYR A 59 1.825 -13.800 -0.090 1.00 0.00 C ATOM 896 OH TYR A 59 2.382 -14.572 -1.087 1.00 0.00 O ATOM 0 H TYR A 59 -1.691 -13.054 2.216 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.767 -10.362 3.411 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.681 -10.479 3.166 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.113 -11.925 3.976 1.00 0.00 H new ATOM 0 HD1 TYR A 59 1.125 -10.558 0.654 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.408 -14.089 2.991 1.00 0.00 H new ATOM 0 HE1 TYR A 59 2.114 -11.948 -1.145 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.404 -15.478 1.193 1.00 0.00 H new ATOM 0 HH TYR A 59 3.053 -15.172 -0.700 1.00 0.00 H new ATOM 906 N GLU A 60 -0.994 -9.035 1.319 1.00 0.00 N ATOM 907 CA GLU A 60 -0.954 -8.251 0.085 1.00 0.00 C ATOM 908 C GLU A 60 0.426 -8.349 -0.563 1.00 0.00 C ATOM 909 O GLU A 60 0.542 -8.529 -1.776 1.00 0.00 O ATOM 910 CB GLU A 60 -1.282 -6.787 0.385 1.00 0.00 C ATOM 911 CG GLU A 60 -1.362 -6.003 -0.927 1.00 0.00 C ATOM 912 CD GLU A 60 -1.832 -4.578 -0.655 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.097 -4.272 0.497 1.00 0.00 O ATOM 914 OE2 GLU A 60 -1.922 -3.814 -1.601 1.00 0.00 O ATOM 0 H GLU A 60 -0.731 -8.519 2.159 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.696 -8.651 -0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.229 -6.718 0.921 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.517 -6.357 1.032 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.385 -5.987 -1.411 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.049 -6.497 -1.614 1.00 0.00 H new ATOM 921 N ASP A 61 1.475 -8.226 0.252 1.00 0.00 N ATOM 922 CA ASP A 61 2.852 -8.298 -0.251 1.00 0.00 C ATOM 923 C ASP A 61 3.524 -9.595 0.196 1.00 0.00 C ATOM 924 O ASP A 61 3.332 -10.048 1.323 1.00 0.00 O ATOM 925 CB ASP A 61 3.655 -7.100 0.260 1.00 0.00 C ATOM 926 CG ASP A 61 3.011 -5.802 -0.212 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.636 -5.736 -1.370 1.00 0.00 O ATOM 928 OD2 ASP A 61 2.903 -4.891 0.593 1.00 0.00 O ATOM 0 H ASP A 61 1.401 -8.077 1.258 1.00 0.00 H new ATOM 0 HA ASP A 61 2.822 -8.279 -1.340 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.699 -7.119 1.349 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.682 -7.159 -0.102 1.00 0.00 H new ATOM 933 N GLN A 62 4.314 -10.189 -0.693 1.00 0.00 N ATOM 934 CA GLN A 62 5.013 -11.435 -0.382 1.00 0.00 C ATOM 935 C GLN A 62 6.026 -11.218 0.736 1.00 0.00 C ATOM 936 O GLN A 62 6.289 -12.116 1.535 1.00 0.00 O ATOM 937 CB GLN A 62 5.725 -11.963 -1.628 1.00 0.00 C ATOM 938 CG GLN A 62 6.224 -13.386 -1.365 1.00 0.00 C ATOM 939 CD GLN A 62 6.836 -13.966 -2.636 1.00 0.00 C ATOM 940 OE1 GLN A 62 7.364 -13.226 -3.466 1.00 0.00 O ATOM 941 NE2 GLN A 62 6.797 -15.255 -2.838 1.00 0.00 N ATOM 0 H GLN A 62 4.487 -9.830 -1.632 1.00 0.00 H new ATOM 0 HA GLN A 62 4.277 -12.168 -0.050 1.00 0.00 H new ATOM 0 HB2 GLN A 62 5.044 -11.956 -2.479 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.562 -11.314 -1.884 1.00 0.00 H new ATOM 0 HG2 GLN A 62 6.965 -13.379 -0.565 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.399 -14.014 -1.029 1.00 0.00 H new ATOM 0 HE21 GLN A 62 6.359 -15.866 -2.149 1.00 0.00 H new ATOM 0 HE22 GLN A 62 7.205 -15.651 -3.685 1.00 0.00 H new ATOM 950 N ARG A 63 6.596 -10.022 0.782 1.00 0.00 N ATOM 951 CA ARG A 63 7.593 -9.700 1.796 1.00 0.00 C ATOM 952 C ARG A 63 7.001 -9.841 3.199 1.00 0.00 C ATOM 953 O ARG A 63 7.725 -10.055 4.171 1.00 0.00 O ATOM 954 CB ARG A 63 8.097 -8.268 1.588 1.00 0.00 C ATOM 955 CG ARG A 63 8.700 -8.125 0.178 1.00 0.00 C ATOM 956 CD ARG A 63 9.984 -8.964 0.063 1.00 0.00 C ATOM 957 NE ARG A 63 10.805 -8.491 -1.045 1.00 0.00 N ATOM 958 CZ ARG A 63 11.871 -9.173 -1.451 1.00 0.00 C ATOM 959 NH1 ARG A 63 12.197 -10.287 -0.857 1.00 0.00 N ATOM 960 NH2 ARG A 63 12.593 -8.728 -2.442 1.00 0.00 N ATOM 0 H ARG A 63 6.388 -9.262 0.134 1.00 0.00 H new ATOM 0 HA ARG A 63 8.425 -10.397 1.699 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.276 -7.562 1.715 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.847 -8.024 2.340 1.00 0.00 H new ATOM 0 HG2 ARG A 63 7.976 -8.450 -0.570 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.922 -7.078 -0.026 1.00 0.00 H new ATOM 0 HD2 ARG A 63 10.549 -8.905 0.993 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.728 -10.013 -0.088 1.00 0.00 H new ATOM 0 HE ARG A 63 10.557 -7.621 -1.517 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.634 -10.635 -0.081 1.00 0.00 H new ATOM 0 HH12 ARG A 63 13.015 -10.811 -1.168 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.340 -7.856 -2.906 1.00 0.00 H new ATOM 0 HH22 ARG A 63 13.411 -9.252 -2.753 1.00 0.00 H new ATOM 974 N SER A 64 5.680 -9.718 3.297 1.00 0.00 N ATOM 975 CA SER A 64 5.003 -9.835 4.586 1.00 0.00 C ATOM 976 C SER A 64 5.179 -11.235 5.169 1.00 0.00 C ATOM 977 O SER A 64 5.299 -11.399 6.384 1.00 0.00 O ATOM 978 CB SER A 64 3.515 -9.543 4.422 1.00 0.00 C ATOM 979 OG SER A 64 2.936 -10.537 3.589 1.00 0.00 O ATOM 0 H SER A 64 5.061 -9.539 2.506 1.00 0.00 H new ATOM 0 HA SER A 64 5.448 -9.111 5.268 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.024 -9.535 5.395 1.00 0.00 H new ATOM 0 HB3 SER A 64 3.372 -8.555 3.984 1.00 0.00 H new ATOM 0 HG SER A 64 3.392 -10.543 2.722 1.00 0.00 H new ATOM 985 N THR A 65 5.193 -12.241 4.295 1.00 0.00 N ATOM 986 CA THR A 65 5.344 -13.622 4.737 1.00 0.00 C ATOM 987 C THR A 65 6.699 -13.831 5.387 1.00 0.00 C ATOM 988 O THR A 65 6.817 -14.533 6.392 1.00 0.00 O ATOM 989 CB THR A 65 5.202 -14.572 3.543 1.00 0.00 C ATOM 990 OG1 THR A 65 6.300 -14.392 2.660 1.00 0.00 O ATOM 991 CG2 THR A 65 3.898 -14.269 2.799 1.00 0.00 C ATOM 0 H THR A 65 5.102 -12.125 3.286 1.00 0.00 H new ATOM 0 HA THR A 65 4.564 -13.834 5.469 1.00 0.00 H new ATOM 0 HB THR A 65 5.186 -15.601 3.901 1.00 0.00 H new ATOM 0 HG1 THR A 65 6.090 -13.683 2.017 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.798 -14.945 1.950 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.053 -14.407 3.474 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.913 -13.239 2.443 1.00 0.00 H new ATOM 999 N ILE A 66 7.717 -13.216 4.810 1.00 0.00 N ATOM 1000 CA ILE A 66 9.066 -13.335 5.341 1.00 0.00 C ATOM 1001 C ILE A 66 9.141 -12.722 6.738 1.00 0.00 C ATOM 1002 O ILE A 66 9.739 -13.292 7.648 1.00 0.00 O ATOM 1003 CB ILE A 66 10.061 -12.627 4.416 1.00 0.00 C ATOM 1004 CG1 ILE A 66 10.124 -13.369 3.079 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.452 -12.627 5.062 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.900 -12.527 2.065 1.00 0.00 C ATOM 0 H ILE A 66 7.637 -12.632 3.978 1.00 0.00 H new ATOM 0 HA ILE A 66 9.322 -14.393 5.402 1.00 0.00 H new ATOM 0 HB ILE A 66 9.737 -11.599 4.252 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.608 -14.337 3.210 1.00 0.00 H new ATOM 0 HG13 ILE A 66 9.117 -13.564 2.711 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.159 -12.123 4.403 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.410 -12.104 6.017 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.777 -13.654 5.225 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.945 -13.055 1.112 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.397 -11.570 1.926 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.912 -12.355 2.433 1.00 0.00 H new ATOM 1018 N LEU A 67 8.532 -11.557 6.901 1.00 0.00 N ATOM 1019 CA LEU A 67 8.553 -10.876 8.191 1.00 0.00 C ATOM 1020 C LEU A 67 7.978 -11.751 9.305 1.00 0.00 C ATOM 1021 O LEU A 67 8.612 -11.945 10.344 1.00 0.00 O ATOM 1022 CB LEU A 67 7.735 -9.575 8.098 1.00 0.00 C ATOM 1023 CG LEU A 67 8.622 -8.431 7.558 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.735 -7.291 7.062 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.550 -7.909 8.685 1.00 0.00 C ATOM 0 H LEU A 67 8.022 -11.066 6.167 1.00 0.00 H new ATOM 0 HA LEU A 67 9.593 -10.657 8.435 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.877 -9.721 7.442 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.344 -9.310 9.080 1.00 0.00 H new ATOM 0 HG LEU A 67 9.231 -8.806 6.735 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.360 -6.483 6.681 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.086 -7.655 6.265 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.125 -6.920 7.886 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.173 -7.102 8.299 1.00 0.00 H new ATOM 0 HD22 LEU A 67 8.945 -7.536 9.511 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.185 -8.721 9.038 1.00 0.00 H new ATOM 1037 N ALA A 68 6.785 -12.279 9.082 1.00 0.00 N ATOM 1038 CA ALA A 68 6.140 -13.118 10.084 1.00 0.00 C ATOM 1039 C ALA A 68 6.851 -14.459 10.243 1.00 0.00 C ATOM 1040 O ALA A 68 7.365 -14.781 11.313 1.00 0.00 O ATOM 1041 CB ALA A 68 4.685 -13.364 9.682 1.00 0.00 C ATOM 0 H ALA A 68 6.247 -12.145 8.226 1.00 0.00 H new ATOM 0 HA ALA A 68 6.188 -12.595 11.039 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.202 -13.991 10.431 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.160 -12.411 9.614 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.655 -13.865 8.714 1.00 0.00 H new ATOM 1047 N VAL A 69 6.886 -15.227 9.170 1.00 0.00 N ATOM 1048 CA VAL A 69 7.529 -16.534 9.195 1.00 0.00 C ATOM 1049 C VAL A 69 8.939 -16.445 9.807 1.00 0.00 C ATOM 1050 O VAL A 69 9.513 -17.448 10.215 1.00 0.00 O ATOM 1051 CB VAL A 69 7.608 -17.113 7.769 1.00 0.00 C ATOM 1052 CG1 VAL A 69 8.790 -16.488 7.022 1.00 0.00 C ATOM 1053 CG2 VAL A 69 7.795 -18.632 7.841 1.00 0.00 C ATOM 0 H VAL A 69 6.479 -14.972 8.270 1.00 0.00 H new ATOM 0 HA VAL A 69 6.928 -17.196 9.818 1.00 0.00 H new ATOM 0 HB VAL A 69 6.684 -16.885 7.238 1.00 0.00 H new ATOM 0 HG11 VAL A 69 8.842 -16.900 6.014 1.00 0.00 H new ATOM 0 HG12 VAL A 69 8.655 -15.408 6.966 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.715 -16.711 7.554 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.851 -19.040 6.832 1.00 0.00 H new ATOM 0 HG22 VAL A 69 8.717 -18.860 8.376 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.951 -19.078 8.367 1.00 0.00 H new ATOM 1063 N ASP A 70 9.507 -15.239 9.831 1.00 0.00 N ATOM 1064 CA ASP A 70 10.854 -15.038 10.377 1.00 0.00 C ATOM 1065 C ASP A 70 10.850 -14.820 11.901 1.00 0.00 C ATOM 1066 O ASP A 70 11.613 -15.452 12.631 1.00 0.00 O ATOM 1067 CB ASP A 70 11.503 -13.820 9.711 1.00 0.00 C ATOM 1068 CG ASP A 70 12.838 -13.497 10.377 1.00 0.00 C ATOM 1069 OD1 ASP A 70 13.361 -14.364 11.058 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.315 -12.387 10.200 1.00 0.00 O ATOM 0 H ASP A 70 9.061 -14.391 9.482 1.00 0.00 H new ATOM 0 HA ASP A 70 11.419 -15.947 10.169 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.657 -14.017 8.650 1.00 0.00 H new ATOM 0 HB3 ASP A 70 10.836 -12.960 9.782 1.00 0.00 H new ATOM 1075 N ASN A 71 9.989 -13.910 12.375 1.00 0.00 N ATOM 1076 CA ASN A 71 9.919 -13.589 13.816 1.00 0.00 C ATOM 1077 C ASN A 71 8.780 -14.316 14.542 1.00 0.00 C ATOM 1078 O ASN A 71 8.936 -14.755 15.680 1.00 0.00 O ATOM 1079 CB ASN A 71 9.710 -12.084 13.975 1.00 0.00 C ATOM 1080 CG ASN A 71 10.869 -11.325 13.336 1.00 0.00 C ATOM 1081 OD1 ASN A 71 12.026 -11.720 13.480 1.00 0.00 O ATOM 1082 ND2 ASN A 71 10.626 -10.253 12.633 1.00 0.00 N ATOM 0 H ASN A 71 9.336 -13.385 11.793 1.00 0.00 H new ATOM 0 HA ASN A 71 10.856 -13.920 14.264 1.00 0.00 H new ATOM 0 HB2 ASN A 71 8.770 -11.788 13.509 1.00 0.00 H new ATOM 0 HB3 ASN A 71 9.636 -11.829 15.032 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.395 -9.741 12.202 1.00 0.00 H new ATOM 0 HD22 ASN A 71 9.667 -9.927 12.515 1.00 0.00 H new ATOM 1089 N LEU A 72 7.640 -14.447 13.877 1.00 0.00 N ATOM 1090 CA LEU A 72 6.475 -15.102 14.481 1.00 0.00 C ATOM 1091 C LEU A 72 6.647 -16.620 14.509 1.00 0.00 C ATOM 1092 O LEU A 72 5.927 -17.326 15.210 1.00 0.00 O ATOM 1093 CB LEU A 72 5.196 -14.711 13.693 1.00 0.00 C ATOM 1094 CG LEU A 72 4.649 -13.321 14.160 1.00 0.00 C ATOM 1095 CD1 LEU A 72 3.932 -13.472 15.514 1.00 0.00 C ATOM 1096 CD2 LEU A 72 5.810 -12.319 14.309 1.00 0.00 C ATOM 0 H LEU A 72 7.492 -14.113 12.925 1.00 0.00 H new ATOM 0 HA LEU A 72 6.380 -14.764 15.513 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.418 -14.678 12.626 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.430 -15.473 13.836 1.00 0.00 H new ATOM 0 HG LEU A 72 3.947 -12.951 13.413 1.00 0.00 H new ATOM 0 HD11 LEU A 72 3.553 -12.502 15.835 1.00 0.00 H new ATOM 0 HD12 LEU A 72 3.101 -14.170 15.410 1.00 0.00 H new ATOM 0 HD13 LEU A 72 4.634 -13.851 16.257 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.419 -11.355 14.634 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.519 -12.691 15.048 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.314 -12.201 13.350 1.00 0.00 H new ATOM 1108 N ASN A 73 7.608 -17.115 13.749 1.00 0.00 N ATOM 1109 CA ASN A 73 7.863 -18.550 13.700 1.00 0.00 C ATOM 1110 C ASN A 73 8.667 -18.995 14.908 1.00 0.00 C ATOM 1111 O ASN A 73 9.828 -18.613 15.068 1.00 0.00 O ATOM 1112 CB ASN A 73 8.624 -18.898 12.429 1.00 0.00 C ATOM 1113 CG ASN A 73 8.892 -20.399 12.369 1.00 0.00 C ATOM 1114 OD1 ASN A 73 7.963 -21.201 12.447 1.00 0.00 O ATOM 1115 ND2 ASN A 73 10.118 -20.825 12.232 1.00 0.00 N ATOM 0 H ASN A 73 8.222 -16.552 13.160 1.00 0.00 H new ATOM 0 HA ASN A 73 6.904 -19.068 13.706 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.049 -18.589 11.556 1.00 0.00 H new ATOM 0 HB3 ASN A 73 9.567 -18.352 12.400 1.00 0.00 H new ATOM 0 HD21 ASN A 73 10.308 -21.826 12.189 1.00 0.00 H new ATOM 0 HD22 ASN A 73 10.886 -20.157 12.168 1.00 0.00 H new ATOM 1122 N GLY A 74 8.046 -19.804 15.759 1.00 0.00 N ATOM 1123 CA GLY A 74 8.718 -20.295 16.950 1.00 0.00 C ATOM 1124 C GLY A 74 8.581 -19.306 18.104 1.00 0.00 C ATOM 1125 O GLY A 74 9.202 -19.481 19.152 1.00 0.00 O ATOM 0 H GLY A 74 7.086 -20.130 15.646 1.00 0.00 H new ATOM 0 HA2 GLY A 74 8.296 -21.257 17.239 1.00 0.00 H new ATOM 0 HA3 GLY A 74 9.773 -20.462 16.733 1.00 0.00 H new ATOM 1129 N PHE A 75 7.764 -18.265 17.905 1.00 0.00 N ATOM 1130 CA PHE A 75 7.558 -17.254 18.943 1.00 0.00 C ATOM 1131 C PHE A 75 6.448 -17.677 19.892 1.00 0.00 C ATOM 1132 O PHE A 75 5.353 -18.036 19.463 1.00 0.00 O ATOM 1133 CB PHE A 75 7.190 -15.907 18.308 1.00 0.00 C ATOM 1134 CG PHE A 75 7.050 -14.850 19.388 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.164 -14.483 20.154 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.808 -14.243 19.624 1.00 0.00 C ATOM 1137 CE1 PHE A 75 8.033 -13.508 21.152 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.680 -13.271 20.621 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.792 -12.902 21.385 1.00 0.00 C ATOM 0 H PHE A 75 7.241 -18.103 17.044 1.00 0.00 H new ATOM 0 HA PHE A 75 8.488 -17.152 19.503 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.957 -15.610 17.593 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.256 -15.999 17.753 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.121 -14.950 19.976 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.949 -14.527 19.035 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.891 -13.223 21.743 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.722 -12.805 20.801 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.694 -12.150 22.154 1.00 0.00 H new ATOM 1149 N LYS A 76 6.741 -17.630 21.184 1.00 0.00 N ATOM 1150 CA LYS A 76 5.754 -18.002 22.184 1.00 0.00 C ATOM 1151 C LYS A 76 4.727 -16.893 22.329 1.00 0.00 C ATOM 1152 O LYS A 76 5.063 -15.766 22.691 1.00 0.00 O ATOM 1153 CB LYS A 76 6.442 -18.256 23.524 1.00 0.00 C ATOM 1154 CG LYS A 76 7.263 -19.543 23.440 1.00 0.00 C ATOM 1155 CD LYS A 76 7.995 -19.769 24.761 1.00 0.00 C ATOM 1156 CE LYS A 76 8.814 -21.057 24.677 1.00 0.00 C ATOM 1157 NZ LYS A 76 9.561 -21.253 25.953 1.00 0.00 N ATOM 0 H LYS A 76 7.644 -17.341 21.560 1.00 0.00 H new ATOM 0 HA LYS A 76 5.250 -18.915 21.867 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.088 -17.416 23.778 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.699 -18.337 24.317 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.611 -20.389 23.224 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.980 -19.477 22.622 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.648 -18.924 24.976 1.00 0.00 H new ATOM 0 HD3 LYS A 76 7.278 -19.834 25.580 1.00 0.00 H new ATOM 0 HE2 LYS A 76 8.157 -21.907 24.493 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.510 -21.005 23.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 10.119 -22.129 25.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 10.198 -20.446 26.110 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.888 -21.321 26.743 1.00 0.00 H new ATOM 1171 N ILE A 77 3.468 -17.219 22.048 1.00 0.00 N ATOM 1172 CA ILE A 77 2.395 -16.233 22.149 1.00 0.00 C ATOM 1173 C ILE A 77 1.159 -16.854 22.804 1.00 0.00 C ATOM 1174 O ILE A 77 0.666 -17.891 22.363 1.00 0.00 O ATOM 1175 CB ILE A 77 2.042 -15.704 20.733 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.266 -14.384 20.853 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.174 -16.736 19.991 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.269 -13.662 19.502 1.00 0.00 C ATOM 0 H ILE A 77 3.167 -18.148 21.752 1.00 0.00 H new ATOM 0 HA ILE A 77 2.732 -15.403 22.770 1.00 0.00 H new ATOM 0 HB ILE A 77 2.964 -15.538 20.176 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.242 -14.580 21.170 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.720 -13.752 21.616 1.00 0.00 H new ATOM 0 HG21 ILE A 77 0.930 -16.359 18.998 1.00 0.00 H new ATOM 0 HG22 ILE A 77 1.722 -17.673 19.898 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.254 -16.907 20.550 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.718 -12.726 19.589 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.296 -13.452 19.204 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.795 -14.294 18.751 1.00 0.00 H new ATOM 1190 N GLY A 78 0.663 -16.213 23.853 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.520 -16.710 24.547 1.00 0.00 C ATOM 1192 C GLY A 78 -0.208 -17.995 25.304 1.00 0.00 C ATOM 1193 O GLY A 78 -1.113 -18.737 25.688 1.00 0.00 O ATOM 0 H GLY A 78 1.056 -15.355 24.241 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -0.883 -15.953 25.242 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.319 -16.892 23.828 1.00 0.00 H new ATOM 1197 N GLY A 79 1.079 -18.256 25.516 1.00 0.00 N ATOM 1198 CA GLY A 79 1.499 -19.462 26.228 1.00 0.00 C ATOM 1199 C GLY A 79 1.689 -20.632 25.263 1.00 0.00 C ATOM 1200 O GLY A 79 2.030 -21.740 25.679 1.00 0.00 O ATOM 0 H GLY A 79 1.844 -17.655 25.209 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.431 -19.269 26.758 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.753 -19.723 26.979 1.00 0.00 H new ATOM 1204 N ARG A 80 1.466 -20.384 23.967 1.00 0.00 N ATOM 1205 CA ARG A 80 1.617 -21.431 22.941 1.00 0.00 C ATOM 1206 C ARG A 80 2.637 -21.005 21.883 1.00 0.00 C ATOM 1207 O ARG A 80 2.748 -19.824 21.553 1.00 0.00 O ATOM 1208 CB ARG A 80 0.250 -21.716 22.266 1.00 0.00 C ATOM 1209 CG ARG A 80 -0.472 -22.878 22.990 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.900 -22.437 24.410 1.00 0.00 C ATOM 1211 NE ARG A 80 -2.210 -22.988 24.739 1.00 0.00 N ATOM 1212 CZ ARG A 80 -2.722 -22.860 25.959 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -2.047 -22.237 26.888 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -3.898 -23.358 26.227 1.00 0.00 N ATOM 0 H ARG A 80 1.182 -19.475 23.602 1.00 0.00 H new ATOM 0 HA ARG A 80 1.975 -22.339 23.426 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.370 -20.820 22.292 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.400 -21.969 21.217 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -1.347 -23.186 22.417 1.00 0.00 H new ATOM 0 HG3 ARG A 80 0.188 -23.743 23.053 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -0.163 -22.773 25.140 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.931 -21.349 24.466 1.00 0.00 H new ATOM 0 HE ARG A 80 -2.742 -23.480 24.021 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -1.128 -21.849 26.677 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -2.439 -22.139 27.824 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -4.423 -23.845 25.501 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -4.292 -23.260 27.163 1.00 0.00 H new ATOM 1228 N ALA A 81 3.376 -21.978 21.353 1.00 0.00 N ATOM 1229 CA ALA A 81 4.376 -21.698 20.327 1.00 0.00 C ATOM 1230 C ALA A 81 3.703 -21.485 18.970 1.00 0.00 C ATOM 1231 O ALA A 81 2.772 -22.204 18.611 1.00 0.00 O ATOM 1232 CB ALA A 81 5.370 -22.853 20.232 1.00 0.00 C ATOM 0 H ALA A 81 3.301 -22.961 21.616 1.00 0.00 H new ATOM 0 HA ALA A 81 4.909 -20.788 20.604 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.111 -22.633 19.464 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.870 -22.983 21.192 1.00 0.00 H new ATOM 0 HB3 ALA A 81 4.839 -23.769 19.973 1.00 0.00 H new ATOM 1238 N LEU A 82 4.182 -20.494 18.223 1.00 0.00 N ATOM 1239 CA LEU A 82 3.621 -20.197 16.905 1.00 0.00 C ATOM 1240 C LEU A 82 4.198 -21.132 15.848 1.00 0.00 C ATOM 1241 O LEU A 82 5.374 -21.497 15.899 1.00 0.00 O ATOM 1242 CB LEU A 82 3.925 -18.737 16.517 1.00 0.00 C ATOM 1243 CG LEU A 82 2.772 -17.811 16.972 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.299 -16.389 17.186 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.674 -17.788 15.896 1.00 0.00 C ATOM 0 H LEU A 82 4.952 -19.886 18.504 1.00 0.00 H new ATOM 0 HA LEU A 82 2.542 -20.345 16.955 1.00 0.00 H new ATOM 0 HB2 LEU A 82 4.860 -18.418 16.977 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.058 -18.660 15.438 1.00 0.00 H new ATOM 0 HG LEU A 82 2.361 -18.189 17.908 1.00 0.00 H new ATOM 0 HD11 LEU A 82 2.482 -15.743 17.506 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.075 -16.400 17.952 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.716 -16.011 16.252 1.00 0.00 H new ATOM 0 HD21 LEU A 82 0.863 -17.135 16.218 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.090 -17.415 14.960 1.00 0.00 H new ATOM 0 HD23 LEU A 82 1.290 -18.797 15.746 1.00 0.00 H new ATOM 1257 N LYS A 83 3.365 -21.512 14.882 1.00 0.00 N ATOM 1258 CA LYS A 83 3.809 -22.394 13.804 1.00 0.00 C ATOM 1259 C LYS A 83 3.423 -21.794 12.457 1.00 0.00 C ATOM 1260 O LYS A 83 2.268 -21.880 12.036 1.00 0.00 O ATOM 1261 CB LYS A 83 3.170 -23.777 13.960 1.00 0.00 C ATOM 1262 CG LYS A 83 3.754 -24.731 12.917 1.00 0.00 C ATOM 1263 CD LYS A 83 3.121 -26.114 13.077 1.00 0.00 C ATOM 1264 CE LYS A 83 3.721 -27.074 12.047 1.00 0.00 C ATOM 1265 NZ LYS A 83 3.112 -28.424 12.213 1.00 0.00 N ATOM 0 H LYS A 83 2.388 -21.227 14.823 1.00 0.00 H new ATOM 0 HA LYS A 83 4.893 -22.498 13.853 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.353 -24.162 14.963 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.089 -23.706 13.838 1.00 0.00 H new ATOM 0 HG2 LYS A 83 3.567 -24.348 11.914 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.835 -24.799 13.036 1.00 0.00 H new ATOM 0 HD2 LYS A 83 3.295 -26.491 14.085 1.00 0.00 H new ATOM 0 HD3 LYS A 83 2.041 -26.049 12.943 1.00 0.00 H new ATOM 0 HE2 LYS A 83 3.539 -26.703 11.039 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.802 -27.133 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 3.519 -29.077 11.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 3.307 -28.778 13.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 2.084 -28.361 12.070 1.00 0.00 H new ATOM 1279 N ILE A 84 4.397 -21.182 11.777 1.00 0.00 N ATOM 1280 CA ILE A 84 4.148 -20.552 10.477 1.00 0.00 C ATOM 1281 C ILE A 84 4.720 -21.410 9.351 1.00 0.00 C ATOM 1282 O ILE A 84 5.839 -21.915 9.451 1.00 0.00 O ATOM 1283 CB ILE A 84 4.786 -19.135 10.438 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.534 -18.391 11.789 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.158 -18.319 9.294 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.047 -17.982 11.926 1.00 0.00 C ATOM 0 H ILE A 84 5.361 -21.109 12.103 1.00 0.00 H new ATOM 0 HA ILE A 84 3.071 -20.462 10.337 1.00 0.00 H new ATOM 0 HB ILE A 84 5.859 -19.239 10.278 1.00 0.00 H new ATOM 0 HG12 ILE A 84 4.816 -19.035 12.622 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.166 -17.504 11.844 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.606 -17.326 9.267 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.339 -18.824 8.345 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.084 -18.229 9.458 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.897 -17.466 12.874 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.775 -17.319 11.105 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.420 -18.873 11.895 1.00 0.00 H new ATOM 1298 N ASP A 85 3.945 -21.575 8.282 1.00 0.00 N ATOM 1299 CA ASP A 85 4.385 -22.376 7.142 1.00 0.00 C ATOM 1300 C ASP A 85 3.687 -21.919 5.861 1.00 0.00 C ATOM 1301 O ASP A 85 2.504 -21.578 5.873 1.00 0.00 O ATOM 1302 CB ASP A 85 4.079 -23.854 7.399 1.00 0.00 C ATOM 1303 CG ASP A 85 4.762 -24.719 6.347 1.00 0.00 C ATOM 1304 OD1 ASP A 85 5.331 -24.159 5.425 1.00 0.00 O ATOM 1305 OD2 ASP A 85 4.708 -25.932 6.480 1.00 0.00 O ATOM 0 H ASP A 85 3.015 -21.168 8.181 1.00 0.00 H new ATOM 0 HA ASP A 85 5.460 -22.243 7.018 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.423 -24.137 8.394 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.002 -24.020 7.375 1.00 0.00 H new ATOM 1310 N HIS A 86 4.426 -21.910 4.756 1.00 0.00 N ATOM 1311 CA HIS A 86 3.863 -21.490 3.474 1.00 0.00 C ATOM 1312 C HIS A 86 2.966 -22.580 2.896 1.00 0.00 C ATOM 1313 O HIS A 86 3.270 -23.767 3.001 1.00 0.00 O ATOM 1314 CB HIS A 86 4.993 -21.178 2.488 1.00 0.00 C ATOM 1315 CG HIS A 86 5.703 -19.922 2.915 1.00 0.00 C ATOM 1316 ND1 HIS A 86 6.737 -19.369 2.176 1.00 0.00 N ATOM 1317 CD2 HIS A 86 5.538 -19.100 4.004 1.00 0.00 C ATOM 1318 CE1 HIS A 86 7.153 -18.263 2.823 1.00 0.00 C ATOM 1319 NE2 HIS A 86 6.455 -18.053 3.942 1.00 0.00 N ATOM 0 H HIS A 86 5.407 -22.186 4.720 1.00 0.00 H new ATOM 0 HA HIS A 86 3.263 -20.595 3.637 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.696 -22.010 2.450 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.589 -21.056 1.483 1.00 0.00 H new ATOM 0 HD2 HIS A 86 4.809 -19.244 4.788 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.953 -17.624 2.479 1.00 0.00 H new ATOM 0 HE2 HIS A 86 6.569 -17.289 4.609 1.00 0.00 H new ATOM 1328 N THR A 87 1.854 -22.169 2.280 1.00 0.00 N ATOM 1329 CA THR A 87 0.915 -23.120 1.682 1.00 0.00 C ATOM 1330 C THR A 87 0.272 -22.526 0.428 1.00 0.00 C ATOM 1331 O THR A 87 0.100 -21.309 0.323 1.00 0.00 O ATOM 1332 CB THR A 87 -0.172 -23.489 2.700 1.00 0.00 C ATOM 1333 OG1 THR A 87 -1.105 -24.371 2.093 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.890 -22.222 3.168 1.00 0.00 C ATOM 0 H THR A 87 1.584 -21.190 2.183 1.00 0.00 H new ATOM 0 HA THR A 87 1.464 -24.018 1.398 1.00 0.00 H new ATOM 0 HB THR A 87 0.285 -23.979 3.559 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.800 -24.610 2.742 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.662 -22.487 3.891 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.172 -21.548 3.635 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.349 -21.727 2.312 1.00 0.00 H new ATOM 1342 N PHE A 88 -0.083 -23.390 -0.527 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.706 -22.941 -1.783 1.00 0.00 C ATOM 1344 C PHE A 88 -2.104 -23.538 -1.943 1.00 0.00 C ATOM 1345 O PHE A 88 -2.609 -23.669 -3.058 1.00 0.00 O ATOM 1346 CB PHE A 88 0.168 -23.352 -2.970 1.00 0.00 C ATOM 1347 CG PHE A 88 0.372 -24.849 -2.952 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.437 -25.402 -2.231 1.00 0.00 C ATOM 1349 CD2 PHE A 88 -0.503 -25.683 -3.659 1.00 0.00 C ATOM 1350 CE1 PHE A 88 1.626 -26.789 -2.216 1.00 0.00 C ATOM 1351 CE2 PHE A 88 -0.314 -27.070 -3.643 1.00 0.00 C ATOM 1352 CZ PHE A 88 0.750 -27.623 -2.921 1.00 0.00 C ATOM 0 H PHE A 88 0.048 -24.399 -0.459 1.00 0.00 H new ATOM 0 HA PHE A 88 -0.796 -21.855 -1.752 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -0.304 -23.050 -3.905 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.130 -22.843 -2.920 1.00 0.00 H new ATOM 0 HD1 PHE A 88 2.113 -24.759 -1.687 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.324 -25.256 -4.217 1.00 0.00 H new ATOM 0 HE1 PHE A 88 2.448 -27.216 -1.660 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -0.989 -27.713 -4.188 1.00 0.00 H new ATOM 0 HZ PHE A 88 0.895 -28.693 -2.908 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.723 -23.896 -0.825 1.00 0.00 N ATOM 1363 CA TYR A 89 -4.061 -24.480 -0.856 1.00 0.00 C ATOM 1364 C TYR A 89 -5.044 -23.520 -1.532 1.00 0.00 C ATOM 1365 O TYR A 89 -5.062 -22.327 -1.229 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.531 -24.793 0.587 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.322 -23.623 1.151 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -4.664 -22.438 1.498 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.711 -23.721 1.308 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -5.393 -21.355 1.999 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.439 -22.638 1.811 1.00 0.00 C ATOM 1372 CZ TYR A 89 -6.780 -21.454 2.157 1.00 0.00 C ATOM 1373 OH TYR A 89 -7.498 -20.387 2.655 1.00 0.00 O ATOM 0 H TYR A 89 -2.325 -23.794 0.109 1.00 0.00 H new ATOM 0 HA TYR A 89 -4.028 -25.406 -1.430 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -5.148 -25.692 0.589 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.668 -24.997 1.221 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -3.593 -22.360 1.379 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.220 -24.635 1.040 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -4.884 -20.440 2.265 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.509 -22.716 1.932 1.00 0.00 H new ATOM 0 HH TYR A 89 -7.954 -20.656 3.480 1.00 0.00 H new ATOM 2031 N PHE B 311 12.836 -4.427 7.194 1.00 0.00 N ATOM 2032 CA PHE B 311 11.862 -4.046 6.175 1.00 0.00 C ATOM 2033 C PHE B 311 11.262 -2.683 6.495 1.00 0.00 C ATOM 2034 O PHE B 311 11.641 -2.040 7.473 1.00 0.00 O ATOM 2035 CB PHE B 311 10.749 -5.085 6.091 1.00 0.00 C ATOM 2036 CG PHE B 311 11.331 -6.406 5.657 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.880 -7.270 6.608 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.322 -6.770 4.305 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.419 -8.499 6.211 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.860 -7.997 3.907 1.00 0.00 C ATOM 2041 CZ PHE B 311 12.409 -8.861 4.861 1.00 0.00 C ATOM 0 HA PHE B 311 12.376 -3.993 5.215 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.261 -5.191 7.060 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.986 -4.761 5.383 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.888 -6.989 7.651 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.899 -6.102 3.569 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.842 -9.167 6.947 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.852 -8.278 2.864 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.826 -9.809 4.554 1.00 0.00 H new ATOM 2051 N ALA B 312 10.323 -2.243 5.663 1.00 0.00 N ATOM 2052 CA ALA B 312 9.669 -0.948 5.867 1.00 0.00 C ATOM 2053 C ALA B 312 8.158 -1.072 5.704 1.00 0.00 C ATOM 2054 O ALA B 312 7.584 -0.548 4.748 1.00 0.00 O ATOM 2055 CB ALA B 312 10.213 0.071 4.863 1.00 0.00 C ATOM 0 H ALA B 312 9.997 -2.758 4.845 1.00 0.00 H new ATOM 0 HA ALA B 312 9.882 -0.611 6.882 1.00 0.00 H new ATOM 0 HB1 ALA B 312 9.723 1.032 5.019 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.288 0.184 5.005 1.00 0.00 H new ATOM 0 HB3 ALA B 312 10.016 -0.276 3.849 1.00 0.00 H new ATOM 2061 N ILE B 313 7.511 -1.769 6.644 1.00 0.00 N ATOM 2062 CA ILE B 313 6.058 -1.952 6.588 1.00 0.00 C ATOM 2063 C ILE B 313 5.361 -0.961 7.516 1.00 0.00 C ATOM 2064 O ILE B 313 5.663 -0.893 8.707 1.00 0.00 O ATOM 2065 CB ILE B 313 5.694 -3.382 7.000 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.575 -4.379 6.224 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.220 -3.648 6.677 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.504 -4.092 4.718 1.00 0.00 C ATOM 0 H ILE B 313 7.965 -2.211 7.444 1.00 0.00 H new ATOM 0 HA ILE B 313 5.726 -1.774 5.565 1.00 0.00 H new ATOM 0 HB ILE B 313 5.860 -3.504 8.070 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.607 -4.306 6.567 1.00 0.00 H new ATOM 0 HG13 ILE B 313 6.244 -5.398 6.423 1.00 0.00 H new ATOM 0 HG21 ILE B 313 3.961 -4.665 6.970 1.00 0.00 H new ATOM 0 HG22 ILE B 313 3.595 -2.943 7.224 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.054 -3.526 5.607 1.00 0.00 H new ATOM 0 HD11 ILE B 313 7.131 -4.804 4.182 1.00 0.00 H new ATOM 0 HD12 ILE B 313 5.473 -4.188 4.377 1.00 0.00 H new ATOM 0 HD13 ILE B 313 6.857 -3.079 4.524 1.00 0.00 H new ATOM 2080 N MET B 314 4.430 -0.193 6.960 1.00 0.00 N ATOM 2081 CA MET B 314 3.698 0.792 7.750 1.00 0.00 C ATOM 2082 C MET B 314 2.696 0.109 8.695 1.00 0.00 C ATOM 2083 O MET B 314 2.171 -0.960 8.383 1.00 0.00 O ATOM 2084 CB MET B 314 2.948 1.748 6.811 1.00 0.00 C ATOM 2085 CG MET B 314 1.928 0.957 5.972 1.00 0.00 C ATOM 2086 SD MET B 314 1.754 1.740 4.350 1.00 0.00 S ATOM 2087 CE MET B 314 3.332 1.173 3.653 1.00 0.00 C ATOM 0 H MET B 314 4.166 -0.232 5.976 1.00 0.00 H new ATOM 0 HA MET B 314 4.414 1.349 8.354 1.00 0.00 H new ATOM 0 HB2 MET B 314 2.438 2.517 7.391 1.00 0.00 H new ATOM 0 HB3 MET B 314 3.654 2.258 6.156 1.00 0.00 H new ATOM 0 HG2 MET B 314 2.257 -0.076 5.857 1.00 0.00 H new ATOM 0 HG3 MET B 314 0.964 0.930 6.481 1.00 0.00 H new ATOM 0 HE1 MET B 314 3.284 1.213 2.565 1.00 0.00 H new ATOM 0 HE2 MET B 314 4.138 1.817 4.005 1.00 0.00 H new ATOM 0 HE3 MET B 314 3.523 0.148 3.971 1.00 0.00 H new ATOM 2097 N PRO B 315 2.416 0.712 9.837 1.00 0.00 N ATOM 2098 CA PRO B 315 1.448 0.155 10.836 1.00 0.00 C ATOM 2099 C PRO B 315 0.000 0.239 10.341 1.00 0.00 C ATOM 2100 O PRO B 315 -0.348 1.127 9.563 1.00 0.00 O ATOM 2101 CB PRO B 315 1.661 1.035 12.079 1.00 0.00 C ATOM 2102 CG PRO B 315 2.191 2.332 11.559 1.00 0.00 C ATOM 2103 CD PRO B 315 2.996 1.985 10.304 1.00 0.00 C ATOM 0 HA PRO B 315 1.618 -0.904 11.028 1.00 0.00 H new ATOM 0 HB2 PRO B 315 0.727 1.181 12.622 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.364 0.573 12.772 1.00 0.00 H new ATOM 0 HG2 PRO B 315 1.379 3.020 11.324 1.00 0.00 H new ATOM 0 HG3 PRO B 315 2.819 2.823 12.302 1.00 0.00 H new ATOM 0 HD2 PRO B 315 2.907 2.764 9.547 1.00 0.00 H new ATOM 0 HD3 PRO B 315 4.057 1.879 10.529 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.841 -0.692 10.798 1.00 0.00 N ATOM 2112 CA GLY B 316 -2.254 -0.714 10.399 1.00 0.00 C ATOM 2113 C GLY B 316 -3.160 -0.337 11.566 1.00 0.00 C ATOM 2114 O GLY B 316 -2.778 -0.468 12.727 1.00 0.00 O ATOM 0 H GLY B 316 -0.572 -1.437 11.441 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -2.413 -0.021 9.573 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -2.517 -1.708 10.036 1.00 0.00 H new ATOM 2118 N SER B 317 -4.361 0.133 11.251 1.00 0.00 N ATOM 2119 CA SER B 317 -5.318 0.523 12.281 1.00 0.00 C ATOM 2120 C SER B 317 -5.693 -0.679 13.144 1.00 0.00 C ATOM 2121 O SER B 317 -5.848 -0.561 14.359 1.00 0.00 O ATOM 2122 CB SER B 317 -6.576 1.108 11.637 1.00 0.00 C ATOM 2123 OG SER B 317 -7.488 1.494 12.656 1.00 0.00 O ATOM 0 H SER B 317 -4.695 0.253 10.295 1.00 0.00 H new ATOM 0 HA SER B 317 -4.854 1.280 12.913 1.00 0.00 H new ATOM 0 HB2 SER B 317 -6.316 1.968 11.020 1.00 0.00 H new ATOM 0 HB3 SER B 317 -7.038 0.372 10.979 1.00 0.00 H new ATOM 0 HG SER B 317 -8.295 1.871 12.247 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.845 -1.836 12.505 1.00 0.00 N ATOM 2130 CA ARG B 318 -6.208 -3.054 13.222 1.00 0.00 C ATOM 2131 C ARG B 318 -5.090 -3.467 14.173 1.00 0.00 C ATOM 2132 O ARG B 318 -5.267 -4.360 15.002 1.00 0.00 O ATOM 2133 CB ARG B 318 -6.480 -4.186 12.232 1.00 0.00 C ATOM 2134 CG ARG B 318 -7.720 -3.851 11.406 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.073 -5.034 10.517 1.00 0.00 C ATOM 2136 NE ARG B 318 -9.177 -4.685 9.626 1.00 0.00 N ATOM 2137 CZ ARG B 318 -8.956 -4.094 8.454 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -7.734 -3.816 8.084 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -9.957 -3.792 7.674 1.00 0.00 N ATOM 0 H ARG B 318 -5.723 -1.955 11.499 1.00 0.00 H new ATOM 0 HA ARG B 318 -7.110 -2.855 13.800 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -5.620 -4.325 11.577 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -6.629 -5.124 12.767 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -8.556 -3.615 12.065 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.536 -2.967 10.796 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -7.203 -5.330 9.931 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.349 -5.890 11.132 1.00 0.00 H new ATOM 0 HE ARG B 318 -10.134 -4.898 9.907 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -6.951 -4.052 8.693 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -7.564 -3.363 7.186 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -10.911 -4.009 7.962 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -9.785 -3.339 6.776 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.937 -2.815 14.044 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.792 -3.122 14.895 1.00 0.00 C ATOM 2155 C TRP B 319 -3.114 -2.862 16.362 1.00 0.00 C ATOM 2156 O TRP B 319 -2.410 -3.316 17.261 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.578 -2.281 14.489 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.369 -2.726 15.262 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.133 -3.986 15.697 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.769 -1.931 15.700 1.00 0.00 C ATOM 2161 NE1 TRP B 319 1.067 -4.019 16.370 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.662 -2.777 16.400 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.108 -0.576 15.560 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.846 -2.299 16.938 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.305 -0.086 16.101 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.174 -0.946 16.791 1.00 0.00 C ATOM 0 H TRP B 319 -3.772 -2.075 13.362 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.561 -4.179 14.765 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -1.395 -2.383 13.419 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.775 -1.226 14.680 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.785 -4.833 15.540 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.465 -4.857 16.793 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.443 0.092 15.033 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.511 -2.965 17.467 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.560 0.957 15.986 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.094 -0.564 17.208 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.173 -2.114 16.597 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.585 -1.792 17.960 1.00 0.00 C ATOM 2179 C ASP B 320 -3.434 -1.146 18.737 1.00 0.00 C ATOM 2180 O ASP B 320 -3.577 -0.816 19.914 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.038 -3.066 18.677 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.371 -3.540 18.106 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -7.012 -2.759 17.423 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.731 -4.677 18.360 1.00 0.00 O ATOM 0 H ASP B 320 -4.766 -1.716 15.869 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.412 -1.084 17.913 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -4.285 -3.846 18.561 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -5.138 -2.876 19.746 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.294 -0.967 18.070 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.129 -0.363 18.706 1.00 0.00 C ATOM 2191 C GLY B 321 -0.451 -1.348 19.658 1.00 0.00 C ATOM 2192 O GLY B 321 0.345 -0.952 20.508 1.00 0.00 O ATOM 0 H GLY B 321 -2.155 -1.231 17.095 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.419 -0.042 17.943 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.432 0.529 19.255 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.774 -2.630 19.508 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.192 -3.665 20.357 1.00 0.00 C ATOM 2198 C VAL B 322 1.245 -3.963 19.930 1.00 0.00 C ATOM 2199 O VAL B 322 1.553 -4.007 18.739 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.028 -4.944 20.280 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -0.336 -6.061 21.068 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -2.411 -4.684 20.881 1.00 0.00 C ATOM 0 H VAL B 322 -1.432 -2.976 18.810 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.186 -3.302 21.385 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.131 -5.245 19.238 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -0.934 -6.971 21.011 1.00 0.00 H new ATOM 0 HG12 VAL B 322 0.650 -6.248 20.644 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -0.232 -5.760 22.110 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.008 -5.594 20.827 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -2.304 -4.381 21.923 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -2.907 -3.891 20.322 1.00 0.00 H new ATOM 2212 N HIS B 323 2.122 -4.165 20.909 1.00 0.00 N ATOM 2213 CA HIS B 323 3.527 -4.453 20.619 1.00 0.00 C ATOM 2214 C HIS B 323 3.743 -5.950 20.395 1.00 0.00 C ATOM 2215 O HIS B 323 3.383 -6.773 21.236 1.00 0.00 O ATOM 2216 CB HIS B 323 4.400 -3.984 21.783 1.00 0.00 C ATOM 2217 CG HIS B 323 4.221 -2.504 21.981 1.00 0.00 C ATOM 2218 ND1 HIS B 323 3.367 -1.986 22.942 1.00 0.00 N ATOM 2219 CD2 HIS B 323 4.776 -1.420 21.349 1.00 0.00 C ATOM 2220 CE1 HIS B 323 3.433 -0.644 22.861 1.00 0.00 C ATOM 2221 NE2 HIS B 323 4.277 -0.247 21.906 1.00 0.00 N ATOM 0 H HIS B 323 1.890 -4.136 21.902 1.00 0.00 H new ATOM 0 HA HIS B 323 3.804 -3.921 19.709 1.00 0.00 H new ATOM 0 HB2 HIS B 323 4.129 -4.519 22.693 1.00 0.00 H new ATOM 0 HB3 HIS B 323 5.447 -4.210 21.580 1.00 0.00 H new ATOM 0 HD2 HIS B 323 5.492 -1.470 20.542 1.00 0.00 H new ATOM 0 HE1 HIS B 323 2.872 0.029 23.492 1.00 0.00 H new ATOM 0 HE2 HIS B 323 4.507 0.711 21.641 1.00 0.00 H new ATOM 2230 N ARG B 324 4.340 -6.301 19.251 1.00 0.00 N ATOM 2231 CA ARG B 324 4.610 -7.708 18.931 1.00 0.00 C ATOM 2232 C ARG B 324 6.009 -7.850 18.329 1.00 0.00 C ATOM 2233 O ARG B 324 6.246 -7.450 17.189 1.00 0.00 O ATOM 2234 CB ARG B 324 3.557 -8.237 17.939 1.00 0.00 C ATOM 2235 CG ARG B 324 3.384 -9.758 18.131 1.00 0.00 C ATOM 2236 CD ARG B 324 2.606 -10.050 19.443 1.00 0.00 C ATOM 2237 NE ARG B 324 3.512 -10.552 20.470 1.00 0.00 N ATOM 2238 CZ ARG B 324 3.054 -10.966 21.647 1.00 0.00 C ATOM 2239 NH1 ARG B 324 1.773 -10.927 21.900 1.00 0.00 N ATOM 2240 NH2 ARG B 324 3.882 -11.412 22.551 1.00 0.00 N ATOM 0 H ARG B 324 4.643 -5.638 18.537 1.00 0.00 H new ATOM 0 HA ARG B 324 4.557 -8.293 19.849 1.00 0.00 H new ATOM 0 HB2 ARG B 324 2.606 -7.730 18.098 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.866 -8.022 16.916 1.00 0.00 H new ATOM 0 HG2 ARG B 324 2.848 -10.180 17.281 1.00 0.00 H new ATOM 0 HG3 ARG B 324 4.361 -10.241 18.164 1.00 0.00 H new ATOM 0 HD2 ARG B 324 2.117 -9.141 19.793 1.00 0.00 H new ATOM 0 HD3 ARG B 324 1.821 -10.782 19.253 1.00 0.00 H new ATOM 0 HE ARG B 324 4.514 -10.586 20.282 1.00 0.00 H new ATOM 0 HH11 ARG B 324 1.124 -10.579 21.194 1.00 0.00 H new ATOM 0 HH12 ARG B 324 1.422 -11.245 22.803 1.00 0.00 H new ATOM 0 HH21 ARG B 324 4.883 -11.443 22.355 1.00 0.00 H new ATOM 0 HH22 ARG B 324 3.529 -11.729 23.454 1.00 0.00 H new ATOM 2254 N SER B 325 6.926 -8.424 19.099 1.00 0.00 N ATOM 2255 CA SER B 325 8.296 -8.611 18.631 1.00 0.00 C ATOM 2256 C SER B 325 8.991 -9.706 19.432 1.00 0.00 C ATOM 2257 O SER B 325 8.505 -10.120 20.483 1.00 0.00 O ATOM 2258 CB SER B 325 9.079 -7.305 18.767 1.00 0.00 C ATOM 2259 OG SER B 325 9.291 -7.026 20.145 1.00 0.00 O ATOM 0 H SER B 325 6.749 -8.766 20.043 1.00 0.00 H new ATOM 0 HA SER B 325 8.263 -8.907 17.583 1.00 0.00 H new ATOM 0 HB2 SER B 325 10.035 -7.385 18.249 1.00 0.00 H new ATOM 0 HB3 SER B 325 8.530 -6.488 18.299 1.00 0.00 H new ATOM 0 HG SER B 325 9.794 -6.190 20.236 1.00 0.00 H new ATOM 2286 N PHE B 328 14.631 -12.753 20.265 1.00 0.00 N ATOM 2287 CA PHE B 328 15.354 -13.931 19.802 1.00 0.00 C ATOM 2288 C PHE B 328 15.946 -13.684 18.411 1.00 0.00 C ATOM 2289 O PHE B 328 16.960 -14.275 18.043 1.00 0.00 O ATOM 2290 CB PHE B 328 14.409 -15.141 19.755 1.00 0.00 C ATOM 2291 CG PHE B 328 15.217 -16.421 19.804 1.00 0.00 C ATOM 2292 CD1 PHE B 328 15.755 -16.858 21.020 1.00 0.00 C ATOM 2293 CD2 PHE B 328 15.431 -17.166 18.637 1.00 0.00 C ATOM 2294 CE1 PHE B 328 16.505 -18.038 21.071 1.00 0.00 C ATOM 2295 CE2 PHE B 328 16.181 -18.347 18.689 1.00 0.00 C ATOM 2296 CZ PHE B 328 16.718 -18.783 19.906 1.00 0.00 C ATOM 0 HA PHE B 328 16.167 -14.135 20.499 1.00 0.00 H new ATOM 0 HB2 PHE B 328 13.715 -15.105 20.595 1.00 0.00 H new ATOM 0 HB3 PHE B 328 13.810 -15.112 18.845 1.00 0.00 H new ATOM 0 HD1 PHE B 328 15.591 -16.284 21.920 1.00 0.00 H new ATOM 0 HD2 PHE B 328 15.018 -16.829 17.698 1.00 0.00 H new ATOM 0 HE1 PHE B 328 16.920 -18.374 22.010 1.00 0.00 H new ATOM 0 HE2 PHE B 328 16.345 -18.922 17.790 1.00 0.00 H new ATOM 0 HZ PHE B 328 17.297 -19.694 19.946 1.00 0.00 H new ATOM 2306 N GLU B 329 15.301 -12.810 17.643 1.00 0.00 N ATOM 2307 CA GLU B 329 15.769 -12.494 16.295 1.00 0.00 C ATOM 2308 C GLU B 329 17.164 -11.867 16.342 1.00 0.00 C ATOM 2309 O GLU B 329 17.893 -11.879 15.351 1.00 0.00 O ATOM 2310 CB GLU B 329 14.794 -11.525 15.617 1.00 0.00 C ATOM 2311 CG GLU B 329 14.901 -10.142 16.269 1.00 0.00 C ATOM 2312 CD GLU B 329 13.699 -9.286 15.883 1.00 0.00 C ATOM 2313 OE1 GLU B 329 12.898 -9.748 15.088 1.00 0.00 O ATOM 2314 OE2 GLU B 329 13.596 -8.181 16.391 1.00 0.00 O ATOM 0 H GLU B 329 14.458 -12.311 17.928 1.00 0.00 H new ATOM 0 HA GLU B 329 15.819 -13.420 15.722 1.00 0.00 H new ATOM 0 HB2 GLU B 329 15.018 -11.454 14.553 1.00 0.00 H new ATOM 0 HB3 GLU B 329 13.774 -11.900 15.704 1.00 0.00 H new ATOM 0 HG2 GLU B 329 14.951 -10.245 17.353 1.00 0.00 H new ATOM 0 HG3 GLU B 329 15.822 -9.653 15.953 1.00 0.00 H new ATOM 2321 N GLU B 330 17.524 -11.321 17.498 1.00 0.00 N ATOM 2322 CA GLU B 330 18.828 -10.683 17.664 1.00 0.00 C ATOM 2323 C GLU B 330 19.939 -11.597 17.150 1.00 0.00 C ATOM 2324 O GLU B 330 20.985 -11.128 16.705 1.00 0.00 O ATOM 2325 CB GLU B 330 19.072 -10.363 19.140 1.00 0.00 C ATOM 2326 CG GLU B 330 20.397 -9.609 19.291 1.00 0.00 C ATOM 2327 CD GLU B 330 20.615 -9.223 20.749 1.00 0.00 C ATOM 2328 OE1 GLU B 330 19.772 -9.559 21.564 1.00 0.00 O ATOM 2329 OE2 GLU B 330 21.624 -8.596 21.031 1.00 0.00 O ATOM 0 H GLU B 330 16.936 -11.306 18.331 1.00 0.00 H new ATOM 0 HA GLU B 330 18.834 -9.758 17.087 1.00 0.00 H new ATOM 0 HB2 GLU B 330 18.253 -9.761 19.532 1.00 0.00 H new ATOM 0 HB3 GLU B 330 19.098 -11.284 19.723 1.00 0.00 H new ATOM 0 HG2 GLU B 330 21.221 -10.233 18.944 1.00 0.00 H new ATOM 0 HG3 GLU B 330 20.389 -8.715 18.667 1.00 0.00 H new ATOM 2336 N LYS B 331 19.706 -12.902 17.219 1.00 0.00 N ATOM 2337 CA LYS B 331 20.698 -13.867 16.759 1.00 0.00 C ATOM 2338 C LYS B 331 21.064 -13.611 15.298 1.00 0.00 C ATOM 2339 O LYS B 331 22.207 -13.812 14.889 1.00 0.00 O ATOM 2340 CB LYS B 331 20.141 -15.287 16.905 1.00 0.00 C ATOM 2341 CG LYS B 331 18.960 -15.480 15.947 1.00 0.00 C ATOM 2342 CD LYS B 331 18.310 -16.842 16.200 1.00 0.00 C ATOM 2343 CE LYS B 331 17.080 -16.995 15.303 1.00 0.00 C ATOM 2344 NZ LYS B 331 17.502 -16.961 13.874 1.00 0.00 N ATOM 0 H LYS B 331 18.848 -13.314 17.585 1.00 0.00 H new ATOM 0 HA LYS B 331 21.595 -13.758 17.368 1.00 0.00 H new ATOM 0 HB2 LYS B 331 20.920 -16.018 16.689 1.00 0.00 H new ATOM 0 HB3 LYS B 331 19.820 -15.458 17.932 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.229 -14.685 16.091 1.00 0.00 H new ATOM 0 HG3 LYS B 331 19.302 -15.416 14.914 1.00 0.00 H new ATOM 0 HD2 LYS B 331 19.023 -17.641 15.996 1.00 0.00 H new ATOM 0 HD3 LYS B 331 18.023 -16.931 17.248 1.00 0.00 H new ATOM 0 HE2 LYS B 331 16.572 -17.934 15.521 1.00 0.00 H new ATOM 0 HE3 LYS B 331 16.369 -16.194 15.503 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 16.748 -17.360 13.280 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 17.683 -15.977 13.589 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 18.370 -17.522 13.755 1.00 0.00 H new ATOM 2358 N TRP B 332 20.084 -13.167 14.515 1.00 0.00 N ATOM 2359 CA TRP B 332 20.314 -12.894 13.098 1.00 0.00 C ATOM 2360 C TRP B 332 21.344 -11.779 12.921 1.00 0.00 C ATOM 2361 O TRP B 332 22.294 -11.914 12.151 1.00 0.00 O ATOM 2362 CB TRP B 332 18.999 -12.494 12.425 1.00 0.00 C ATOM 2363 CG TRP B 332 19.233 -12.286 10.962 1.00 0.00 C ATOM 2364 CD1 TRP B 332 19.391 -13.277 10.054 1.00 0.00 C ATOM 2365 CD2 TRP B 332 19.323 -11.034 10.222 1.00 0.00 C ATOM 2366 NE1 TRP B 332 19.580 -12.712 8.805 1.00 0.00 N ATOM 2367 CE2 TRP B 332 19.547 -11.333 8.857 1.00 0.00 C ATOM 2368 CE3 TRP B 332 19.236 -9.682 10.599 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 19.681 -10.325 7.901 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 19.371 -8.666 9.639 1.00 0.00 C ATOM 2371 CH2 TRP B 332 19.592 -8.988 8.292 1.00 0.00 C ATOM 0 H TRP B 332 19.131 -12.990 14.833 1.00 0.00 H new ATOM 0 HA TRP B 332 20.700 -13.800 12.631 1.00 0.00 H new ATOM 0 HB2 TRP B 332 18.249 -13.270 12.578 1.00 0.00 H new ATOM 0 HB3 TRP B 332 18.610 -11.581 12.876 1.00 0.00 H new ATOM 0 HD1 TRP B 332 19.373 -14.335 10.269 1.00 0.00 H new ATOM 0 HE1 TRP B 332 19.726 -13.249 7.950 1.00 0.00 H new ATOM 0 HE3 TRP B 332 19.064 -9.423 11.633 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 19.852 -10.578 6.865 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 19.304 -7.631 9.940 1.00 0.00 H new ATOM 0 HH2 TRP B 332 19.693 -8.202 7.558 1.00 0.00 H new ATOM 2382 N PHE B 333 21.149 -10.681 13.643 1.00 0.00 N ATOM 2383 CA PHE B 333 22.070 -9.551 13.564 1.00 0.00 C ATOM 2384 C PHE B 333 23.456 -9.957 14.064 1.00 0.00 C ATOM 2385 O PHE B 333 24.471 -9.546 13.504 1.00 0.00 O ATOM 2386 CB PHE B 333 21.535 -8.371 14.399 1.00 0.00 C ATOM 2387 CG PHE B 333 20.529 -7.580 13.589 1.00 0.00 C ATOM 2388 CD1 PHE B 333 20.972 -6.722 12.574 1.00 0.00 C ATOM 2389 CD2 PHE B 333 19.158 -7.707 13.849 1.00 0.00 C ATOM 2390 CE1 PHE B 333 20.045 -5.990 11.821 1.00 0.00 C ATOM 2391 CE2 PHE B 333 18.233 -6.975 13.096 1.00 0.00 C ATOM 2392 CZ PHE B 333 18.675 -6.116 12.082 1.00 0.00 C ATOM 0 H PHE B 333 20.368 -10.549 14.285 1.00 0.00 H new ATOM 0 HA PHE B 333 22.150 -9.242 12.522 1.00 0.00 H new ATOM 0 HB2 PHE B 333 21.069 -8.742 15.312 1.00 0.00 H new ATOM 0 HB3 PHE B 333 22.359 -7.725 14.702 1.00 0.00 H new ATOM 0 HD1 PHE B 333 22.028 -6.625 12.372 1.00 0.00 H new ATOM 0 HD2 PHE B 333 18.815 -8.369 14.630 1.00 0.00 H new ATOM 0 HE1 PHE B 333 20.387 -5.328 11.039 1.00 0.00 H new ATOM 0 HE2 PHE B 333 17.176 -7.073 13.297 1.00 0.00 H new ATOM 0 HZ PHE B 333 17.960 -5.551 11.502 1.00 0.00 H new ATOM 2402 N ALA B 334 23.486 -10.765 15.120 1.00 0.00 N ATOM 2403 CA ALA B 334 24.753 -11.210 15.689 1.00 0.00 C ATOM 2404 C ALA B 334 25.559 -11.976 14.645 1.00 0.00 C ATOM 2405 O ALA B 334 26.763 -11.764 14.502 1.00 0.00 O ATOM 2406 CB ALA B 334 24.493 -12.109 16.899 1.00 0.00 C ATOM 0 H ALA B 334 22.657 -11.122 15.595 1.00 0.00 H new ATOM 0 HA ALA B 334 25.322 -10.335 16.005 1.00 0.00 H new ATOM 0 HB1 ALA B 334 25.444 -12.438 17.319 1.00 0.00 H new ATOM 0 HB2 ALA B 334 23.936 -11.552 17.653 1.00 0.00 H new ATOM 0 HB3 ALA B 334 23.914 -12.978 16.588 1.00 0.00 H new ATOM 2412 N LYS B 335 24.888 -12.860 13.915 1.00 0.00 N ATOM 2413 CA LYS B 335 25.549 -13.641 12.878 1.00 0.00 C ATOM 2414 C LYS B 335 25.874 -12.749 11.685 1.00 0.00 C ATOM 2415 O LYS B 335 26.885 -12.940 11.012 1.00 0.00 O ATOM 2416 CB LYS B 335 24.654 -14.807 12.429 1.00 0.00 C ATOM 2417 CG LYS B 335 25.489 -15.838 11.638 1.00 0.00 C ATOM 2418 CD LYS B 335 26.155 -16.825 12.607 1.00 0.00 C ATOM 2419 CE LYS B 335 26.938 -17.879 11.819 1.00 0.00 C ATOM 2420 NZ LYS B 335 25.985 -18.821 11.168 1.00 0.00 N ATOM 0 H LYS B 335 23.892 -13.053 14.022 1.00 0.00 H new ATOM 0 HA LYS B 335 26.474 -14.049 13.286 1.00 0.00 H new ATOM 0 HB2 LYS B 335 24.200 -15.284 13.298 1.00 0.00 H new ATOM 0 HB3 LYS B 335 23.839 -14.433 11.809 1.00 0.00 H new ATOM 0 HG2 LYS B 335 24.850 -16.377 10.939 1.00 0.00 H new ATOM 0 HG3 LYS B 335 26.249 -15.327 11.047 1.00 0.00 H new ATOM 0 HD2 LYS B 335 26.824 -16.291 13.281 1.00 0.00 H new ATOM 0 HD3 LYS B 335 25.398 -17.308 13.225 1.00 0.00 H new ATOM 0 HE2 LYS B 335 27.561 -17.397 11.066 1.00 0.00 H new ATOM 0 HE3 LYS B 335 27.607 -18.424 12.485 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 26.500 -19.661 10.836 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 25.258 -19.109 11.854 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 25.531 -18.351 10.359 1.00 0.00 H new ATOM 2434 N GLN B 336 25.003 -11.781 11.426 1.00 0.00 N ATOM 2435 CA GLN B 336 25.199 -10.862 10.313 1.00 0.00 C ATOM 2436 C GLN B 336 26.494 -10.081 10.495 1.00 0.00 C ATOM 2437 O GLN B 336 27.127 -9.684 9.518 1.00 0.00 O ATOM 2438 CB GLN B 336 24.016 -9.891 10.207 1.00 0.00 C ATOM 2439 CG GLN B 336 24.146 -9.047 8.935 1.00 0.00 C ATOM 2440 CD GLN B 336 24.026 -9.938 7.702 1.00 0.00 C ATOM 2441 OE1 GLN B 336 23.063 -10.692 7.571 1.00 0.00 O ATOM 2442 NE2 GLN B 336 24.954 -9.896 6.784 1.00 0.00 N ATOM 0 H GLN B 336 24.157 -11.613 11.970 1.00 0.00 H new ATOM 0 HA GLN B 336 25.262 -11.443 9.393 1.00 0.00 H new ATOM 0 HB2 GLN B 336 23.079 -10.447 10.191 1.00 0.00 H new ATOM 0 HB3 GLN B 336 23.987 -9.243 11.083 1.00 0.00 H new ATOM 0 HG2 GLN B 336 23.371 -8.281 8.917 1.00 0.00 H new ATOM 0 HG3 GLN B 336 25.106 -8.530 8.928 1.00 0.00 H new ATOM 0 HE21 GLN B 336 25.752 -9.270 6.894 1.00 0.00 H new ATOM 0 HE22 GLN B 336 24.881 -10.489 5.957 1.00 0.00 H new ATOM 2451 N ASN B 337 26.870 -9.847 11.746 1.00 0.00 N ATOM 2452 CA ASN B 337 28.096 -9.115 12.038 1.00 0.00 C ATOM 2453 C ASN B 337 29.308 -10.050 11.990 1.00 0.00 C ATOM 2454 O ASN B 337 30.359 -9.695 11.456 1.00 0.00 O ATOM 2455 CB ASN B 337 28.000 -8.471 13.422 1.00 0.00 C ATOM 2456 CG ASN B 337 29.218 -7.590 13.674 1.00 0.00 C ATOM 2457 OD1 ASN B 337 30.254 -7.763 13.032 1.00 0.00 O ATOM 2458 ND2 ASN B 337 29.157 -6.649 14.578 1.00 0.00 N ATOM 0 H ASN B 337 26.349 -10.150 12.569 1.00 0.00 H new ATOM 0 HA ASN B 337 28.222 -8.339 11.283 1.00 0.00 H new ATOM 0 HB2 ASN B 337 27.090 -7.876 13.493 1.00 0.00 H new ATOM 0 HB3 ASN B 337 27.935 -9.244 14.188 1.00 0.00 H new ATOM 0 HD21 ASN B 337 29.969 -6.056 14.753 1.00 0.00 H new ATOM 0 HD22 ASN B 337 28.298 -6.507 15.109 1.00 0.00 H new ATOM 2465 N GLU B 338 29.153 -11.249 12.555 1.00 0.00 N ATOM 2466 CA GLU B 338 30.242 -12.227 12.573 1.00 0.00 C ATOM 2467 C GLU B 338 30.509 -12.783 11.172 1.00 0.00 C ATOM 2468 O GLU B 338 31.659 -12.926 10.758 1.00 0.00 O ATOM 2469 CB GLU B 338 29.892 -13.381 13.520 1.00 0.00 C ATOM 2470 CG GLU B 338 31.065 -14.365 13.589 1.00 0.00 C ATOM 2471 CD GLU B 338 30.753 -15.481 14.580 1.00 0.00 C ATOM 2472 OE1 GLU B 338 29.718 -16.111 14.428 1.00 0.00 O ATOM 2473 OE2 GLU B 338 31.554 -15.690 15.476 1.00 0.00 O ATOM 0 H GLU B 338 28.292 -11.564 13.002 1.00 0.00 H new ATOM 0 HA GLU B 338 31.142 -11.722 12.923 1.00 0.00 H new ATOM 0 HB2 GLU B 338 29.670 -12.994 14.515 1.00 0.00 H new ATOM 0 HB3 GLU B 338 28.995 -13.893 13.170 1.00 0.00 H new ATOM 0 HG2 GLU B 338 31.255 -14.787 12.602 1.00 0.00 H new ATOM 0 HG3 GLU B 338 31.972 -13.842 13.892 1.00 0.00 H new