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 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -4.09! C(o=-4.1!,f=-6.9!) USER MOD Single : A 19 ASN :FLIP amide:sc= -3.81 F(o=-4.5!,f=-3.8) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot 75:sc= 0.666 USER MOD Single : A 32 SER OG : rot -64:sc= 0.27 USER MOD Single : A 34 TYR OH : rot 30:sc= -0.235 USER MOD Single : A 43 SER OG : rot 161:sc= 1.8 USER MOD Single : A 56 TYR OH : rot 90:sc= 1.46 USER MOD Single : A 58 LYS NZ :NH3+ -163:sc= -0.03 (180deg=-0.389) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 SER OG : rot 35:sc= 0.719 USER MOD Single : A 65 THR OG1 : rot -90:sc= 1.13 USER MOD Single : A 71 ASN :FLIP amide:sc= -4.4! C(o=-6.5!,f=-4.4!) USER MOD Single : A 73 ASN : amide:sc= -0.0169 X(o=-0.017,f=-0.14) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.121) USER MOD Single : A 86 HIS : no HD1:sc= -0.323 X(o=-0.32,f=-0.031) USER MOD Single : A 87 THR OG1 : rot -110:sc= -5.25! USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : B 314 MET CE :methyl 135:sc= -0.96 (180deg=-3.58!) 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=-0.0013) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 335 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 336 GLN : amide:sc= -0.263 K(o=-0.26,f=-1.1) USER MOD Single : B 337 ASN : amide:sc= -0.187 K(o=-0.19,f=-0.91) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -2.216 -16.672 -2.416 1.00 0.00 N ATOM 143 CA ALA A 11 -1.346 -16.163 -1.359 1.00 0.00 C ATOM 144 C ALA A 11 -1.976 -16.408 0.015 1.00 0.00 C ATOM 145 O ALA A 11 -3.025 -15.847 0.334 1.00 0.00 O ATOM 146 CB ALA A 11 -1.110 -14.656 -1.565 1.00 0.00 C ATOM 0 HA ALA A 11 -0.392 -16.689 -1.403 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -0.461 -14.278 -0.775 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -0.638 -14.491 -2.533 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -2.064 -14.130 -1.532 1.00 0.00 H new ATOM 152 N TYR A 12 -1.323 -17.240 0.826 1.00 0.00 N ATOM 153 CA TYR A 12 -1.821 -17.547 2.167 1.00 0.00 C ATOM 154 C TYR A 12 -0.693 -18.054 3.072 1.00 0.00 C ATOM 155 O TYR A 12 0.227 -18.728 2.606 1.00 0.00 O ATOM 156 CB TYR A 12 -2.933 -18.606 2.078 1.00 0.00 C ATOM 157 CG TYR A 12 -4.213 -17.969 1.590 1.00 0.00 C ATOM 158 CD1 TYR A 12 -5.088 -17.376 2.507 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.521 -17.968 0.224 1.00 0.00 C ATOM 160 CE1 TYR A 12 -6.274 -16.781 2.059 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.707 -17.374 -0.223 1.00 0.00 C ATOM 162 CZ TYR A 12 -6.583 -16.781 0.693 1.00 0.00 C ATOM 163 OH TYR A 12 -7.751 -16.196 0.251 1.00 0.00 O ATOM 0 H TYR A 12 -0.453 -17.711 0.580 1.00 0.00 H new ATOM 0 HA TYR A 12 -2.221 -16.631 2.601 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.633 -19.405 1.400 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -3.093 -19.061 3.056 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.849 -17.377 3.560 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.845 -18.425 -0.483 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.950 -16.323 2.766 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -5.946 -17.373 -1.276 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.812 -16.282 -0.723 1.00 0.00 H new ATOM 173 N ILE A 13 -0.769 -17.730 4.373 1.00 0.00 N ATOM 174 CA ILE A 13 0.258 -18.168 5.337 1.00 0.00 C ATOM 175 C ILE A 13 -0.314 -19.251 6.258 1.00 0.00 C ATOM 176 O ILE A 13 -1.384 -19.082 6.843 1.00 0.00 O ATOM 177 CB ILE A 13 0.750 -16.974 6.183 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.730 -15.703 5.332 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.186 -17.227 6.665 1.00 0.00 C ATOM 180 CD1 ILE A 13 1.268 -14.523 6.149 1.00 0.00 C ATOM 0 H ILE A 13 -1.521 -17.173 4.780 1.00 0.00 H new ATOM 0 HA ILE A 13 1.101 -18.576 4.780 1.00 0.00 H new ATOM 0 HB ILE A 13 0.092 -16.857 7.044 1.00 0.00 H new ATOM 0 HG12 ILE A 13 1.336 -15.844 4.437 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.286 -15.493 4.999 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.524 -16.379 7.261 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.212 -18.131 7.273 1.00 0.00 H new ATOM 0 HG23 ILE A 13 2.843 -17.350 5.804 1.00 0.00 H new ATOM 0 HD11 ILE A 13 1.252 -13.620 5.538 1.00 0.00 H new ATOM 0 HD12 ILE A 13 0.644 -14.376 7.031 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.292 -14.732 6.460 1.00 0.00 H new ATOM 192 N TYR A 14 0.403 -20.363 6.377 1.00 0.00 N ATOM 193 CA TYR A 14 -0.050 -21.470 7.217 1.00 0.00 C ATOM 194 C TYR A 14 0.139 -21.151 8.694 1.00 0.00 C ATOM 195 O TYR A 14 1.262 -20.932 9.148 1.00 0.00 O ATOM 196 CB TYR A 14 0.735 -22.737 6.872 1.00 0.00 C ATOM 197 CG TYR A 14 0.094 -23.929 7.540 1.00 0.00 C ATOM 198 CD1 TYR A 14 0.449 -24.272 8.850 1.00 0.00 C ATOM 199 CD2 TYR A 14 -0.856 -24.688 6.849 1.00 0.00 C ATOM 200 CE1 TYR A 14 -0.150 -25.376 9.470 1.00 0.00 C ATOM 201 CE2 TYR A 14 -1.455 -25.792 7.469 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.101 -26.136 8.779 1.00 0.00 C ATOM 203 OH TYR A 14 -1.689 -27.225 9.389 1.00 0.00 O ATOM 0 H TYR A 14 1.294 -20.523 5.907 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.112 -21.626 7.027 1.00 0.00 H new ATOM 0 HB2 TYR A 14 0.756 -22.881 5.792 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.770 -22.636 7.200 1.00 0.00 H new ATOM 0 HD1 TYR A 14 1.184 -23.686 9.382 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -1.128 -24.423 5.838 1.00 0.00 H new ATOM 0 HE1 TYR A 14 0.122 -25.641 10.481 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -2.190 -26.378 6.937 1.00 0.00 H new ATOM 0 HH TYR A 14 -2.327 -27.641 8.772 1.00 0.00 H new ATOM 213 N ILE A 15 -0.971 -21.126 9.447 1.00 0.00 N ATOM 214 CA ILE A 15 -0.909 -20.834 10.884 1.00 0.00 C ATOM 215 C ILE A 15 -1.429 -22.031 11.675 1.00 0.00 C ATOM 216 O ILE A 15 -2.618 -22.347 11.629 1.00 0.00 O ATOM 217 CB ILE A 15 -1.751 -19.592 11.208 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.334 -18.439 10.289 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.512 -19.188 12.666 1.00 0.00 C ATOM 220 CD1 ILE A 15 -2.329 -17.282 10.429 1.00 0.00 C ATOM 0 H ILE A 15 -1.910 -21.302 9.089 1.00 0.00 H new ATOM 0 HA ILE A 15 0.127 -20.640 11.162 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.807 -19.816 11.056 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.330 -18.101 10.546 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.301 -18.780 9.254 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -2.108 -18.306 12.902 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.802 -20.008 13.323 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.456 -18.962 12.812 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -2.030 -16.464 9.774 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.326 -17.624 10.150 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.340 -16.935 11.462 1.00 0.00 H new ATOM 232 N GLY A 16 -0.532 -22.695 12.411 1.00 0.00 N ATOM 233 CA GLY A 16 -0.914 -23.867 13.214 1.00 0.00 C ATOM 234 C GLY A 16 -0.391 -23.756 14.641 1.00 0.00 C ATOM 235 O GLY A 16 0.344 -22.825 14.968 1.00 0.00 O ATOM 0 H GLY A 16 0.455 -22.446 12.469 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -2.000 -23.962 13.229 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -0.521 -24.772 12.750 1.00 0.00 H new ATOM 239 N ASN A 17 -0.776 -24.715 15.486 1.00 0.00 N ATOM 240 CA ASN A 17 -0.340 -24.716 16.878 1.00 0.00 C ATOM 241 C ASN A 17 -0.706 -23.398 17.560 1.00 0.00 C ATOM 242 O ASN A 17 0.064 -22.867 18.362 1.00 0.00 O ATOM 243 CB ASN A 17 1.171 -24.932 16.943 1.00 0.00 C ATOM 244 CG ASN A 17 1.592 -25.246 18.375 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.851 -24.961 19.317 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.745 -25.815 18.596 1.00 0.00 N ATOM 0 H ASN A 17 -1.384 -25.493 15.231 1.00 0.00 H new ATOM 0 HA ASN A 17 -0.847 -25.527 17.401 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.458 -25.750 16.283 1.00 0.00 H new ATOM 0 HB3 ASN A 17 1.690 -24.041 16.590 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.035 -26.025 19.551 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.356 -26.050 17.814 1.00 0.00 H new ATOM 253 N LEU A 18 -1.890 -22.869 17.241 1.00 0.00 N ATOM 254 CA LEU A 18 -2.356 -21.610 17.835 1.00 0.00 C ATOM 255 C LEU A 18 -3.415 -21.888 18.899 1.00 0.00 C ATOM 256 O LEU A 18 -4.059 -22.937 18.888 1.00 0.00 O ATOM 257 CB LEU A 18 -2.951 -20.702 16.746 1.00 0.00 C ATOM 258 CG LEU A 18 -4.148 -21.416 16.043 1.00 0.00 C ATOM 259 CD1 LEU A 18 -5.479 -20.868 16.581 1.00 0.00 C ATOM 260 CD2 LEU A 18 -4.085 -21.172 14.529 1.00 0.00 C ATOM 0 H LEU A 18 -2.542 -23.289 16.578 1.00 0.00 H new ATOM 0 HA LEU A 18 -1.506 -21.110 18.298 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.287 -19.764 17.188 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -2.185 -20.453 16.012 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.084 -22.485 16.247 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -6.308 -21.373 16.084 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -5.538 -21.045 17.655 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -5.537 -19.797 16.386 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -4.923 -21.673 14.045 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -4.138 -20.102 14.330 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.149 -21.568 14.135 1.00 0.00 H new ATOM 272 N ASN A 19 -3.593 -20.941 19.814 1.00 0.00 N ATOM 273 CA ASN A 19 -4.586 -21.091 20.875 1.00 0.00 C ATOM 274 C ASN A 19 -5.973 -20.677 20.373 1.00 0.00 C ATOM 275 O ASN A 19 -6.118 -19.669 19.681 1.00 0.00 O ATOM 276 CB ASN A 19 -4.186 -20.230 22.098 1.00 0.00 C ATOM 277 CG ASN A 19 -3.453 -21.079 23.136 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.327 -20.656 23.644 1.00 0.00 O flip ATOM 279 ND2 ASN A 19 -3.922 -22.160 23.490 1.00 0.00 N flip ATOM 0 H ASN A 19 -3.068 -20.067 19.844 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.623 -22.139 21.173 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -3.548 -19.407 21.777 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.076 -19.788 22.545 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -4.802 -22.489 23.092 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -3.431 -22.727 24.181 1.00 0.00 H new ATOM 286 N ARG A 20 -6.986 -21.458 20.734 1.00 0.00 N ATOM 287 CA ARG A 20 -8.356 -21.159 20.325 1.00 0.00 C ATOM 288 C ARG A 20 -8.830 -19.856 20.958 1.00 0.00 C ATOM 289 O ARG A 20 -9.778 -19.231 20.483 1.00 0.00 O ATOM 290 CB ARG A 20 -9.286 -22.301 20.735 1.00 0.00 C ATOM 291 CG ARG A 20 -9.043 -22.658 22.203 1.00 0.00 C ATOM 292 CD ARG A 20 -10.192 -23.528 22.714 1.00 0.00 C ATOM 293 NE ARG A 20 -10.481 -24.594 21.762 1.00 0.00 N ATOM 294 CZ ARG A 20 -11.653 -25.220 21.767 1.00 0.00 C ATOM 295 NH1 ARG A 20 -12.567 -24.885 22.636 1.00 0.00 N ATOM 296 NH2 ARG A 20 -11.889 -26.169 20.904 1.00 0.00 N ATOM 0 H ARG A 20 -6.887 -22.297 21.305 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.377 -21.050 19.241 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.325 -22.007 20.589 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -9.109 -23.172 20.104 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.097 -23.189 22.307 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -8.967 -21.750 22.801 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -9.931 -23.956 23.682 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -11.081 -22.916 22.866 1.00 0.00 H new ATOM 0 HE ARG A 20 -9.771 -24.864 21.081 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -12.382 -24.143 23.311 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -13.467 -25.365 22.640 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -11.174 -26.431 20.225 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -12.789 -26.650 20.908 1.00 0.00 H new ATOM 310 N GLU A 21 -8.165 -19.453 22.033 1.00 0.00 N ATOM 311 CA GLU A 21 -8.526 -18.222 22.725 1.00 0.00 C ATOM 312 C GLU A 21 -8.369 -17.023 21.793 1.00 0.00 C ATOM 313 O GLU A 21 -9.087 -16.031 21.919 1.00 0.00 O ATOM 314 CB GLU A 21 -7.637 -18.036 23.959 1.00 0.00 C ATOM 315 CG GLU A 21 -8.095 -16.801 24.739 1.00 0.00 C ATOM 316 CD GLU A 21 -7.248 -16.633 25.997 1.00 0.00 C ATOM 317 OE1 GLU A 21 -6.445 -17.512 26.268 1.00 0.00 O ATOM 318 OE2 GLU A 21 -7.415 -15.631 26.670 1.00 0.00 O ATOM 0 H GLU A 21 -7.378 -19.956 22.443 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.568 -18.292 23.038 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.689 -18.920 24.594 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -6.596 -17.922 23.656 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.010 -15.913 24.112 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.146 -16.901 25.009 1.00 0.00 H new ATOM 325 N LEU A 22 -7.424 -17.120 20.863 1.00 0.00 N ATOM 326 CA LEU A 22 -7.184 -16.033 19.918 1.00 0.00 C ATOM 327 C LEU A 22 -8.357 -15.900 18.947 1.00 0.00 C ATOM 328 O LEU A 22 -8.802 -16.882 18.354 1.00 0.00 O ATOM 329 CB LEU A 22 -5.893 -16.302 19.129 1.00 0.00 C ATOM 330 CG LEU A 22 -4.682 -15.866 19.959 1.00 0.00 C ATOM 331 CD1 LEU A 22 -4.656 -16.651 21.273 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.397 -16.141 19.170 1.00 0.00 C ATOM 0 H LEU A 22 -6.817 -17.931 20.743 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.082 -15.103 20.478 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -5.817 -17.362 18.886 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -5.913 -15.759 18.184 1.00 0.00 H new ATOM 0 HG LEU A 22 -4.753 -14.800 20.175 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -3.794 -16.342 21.865 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -5.570 -16.454 21.833 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -4.585 -17.717 21.058 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.534 -15.831 19.760 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.324 -17.207 18.953 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.417 -15.581 18.235 1.00 0.00 H new ATOM 344 N THR A 23 -8.849 -14.675 18.784 1.00 0.00 N ATOM 345 CA THR A 23 -9.968 -14.417 17.875 1.00 0.00 C ATOM 346 C THR A 23 -9.457 -13.866 16.547 1.00 0.00 C ATOM 347 O THR A 23 -8.252 -13.692 16.358 1.00 0.00 O ATOM 348 CB THR A 23 -10.940 -13.418 18.508 1.00 0.00 C ATOM 349 OG1 THR A 23 -10.267 -12.188 18.741 1.00 0.00 O ATOM 350 CG2 THR A 23 -11.461 -13.977 19.833 1.00 0.00 C ATOM 0 H THR A 23 -8.495 -13.848 19.265 1.00 0.00 H new ATOM 0 HA THR A 23 -10.489 -15.357 17.691 1.00 0.00 H new ATOM 0 HB THR A 23 -11.780 -13.251 17.833 1.00 0.00 H new ATOM 0 HG1 THR A 23 -10.888 -11.547 19.145 1.00 0.00 H new ATOM 0 HG21 THR A 23 -12.153 -13.264 20.282 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.978 -14.919 19.652 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.624 -14.146 20.511 1.00 0.00 H new ATOM 358 N GLU A 24 -10.381 -13.594 15.631 1.00 0.00 N ATOM 359 CA GLU A 24 -10.010 -13.064 14.323 1.00 0.00 C ATOM 360 C GLU A 24 -9.306 -11.724 14.476 1.00 0.00 C ATOM 361 O GLU A 24 -8.336 -11.438 13.774 1.00 0.00 O ATOM 362 CB GLU A 24 -11.259 -12.895 13.455 1.00 0.00 C ATOM 363 CG GLU A 24 -11.798 -14.270 13.060 1.00 0.00 C ATOM 364 CD GLU A 24 -13.136 -14.123 12.345 1.00 0.00 C ATOM 365 OE1 GLU A 24 -13.701 -13.042 12.405 1.00 0.00 O ATOM 366 OE2 GLU A 24 -13.578 -15.090 11.749 1.00 0.00 O ATOM 0 H GLU A 24 -11.383 -13.730 15.767 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.330 -13.767 13.842 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.021 -12.337 14.000 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.019 -12.317 12.563 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.084 -14.776 12.411 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.918 -14.891 13.948 1.00 0.00 H new ATOM 373 N GLY A 25 -9.801 -10.907 15.397 1.00 0.00 N ATOM 374 CA GLY A 25 -9.204 -9.601 15.637 1.00 0.00 C ATOM 375 C GLY A 25 -7.768 -9.744 16.129 1.00 0.00 C ATOM 376 O GLY A 25 -6.886 -8.988 15.721 1.00 0.00 O ATOM 0 H GLY A 25 -10.606 -11.123 15.984 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.222 -9.014 14.719 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -9.793 -9.057 16.375 1.00 0.00 H new ATOM 380 N ASP A 26 -7.542 -10.718 17.009 1.00 0.00 N ATOM 381 CA ASP A 26 -6.206 -10.944 17.552 1.00 0.00 C ATOM 382 C ASP A 26 -5.220 -11.295 16.441 1.00 0.00 C ATOM 383 O ASP A 26 -4.106 -10.779 16.406 1.00 0.00 O ATOM 384 CB ASP A 26 -6.248 -12.082 18.574 1.00 0.00 C ATOM 385 CG ASP A 26 -6.962 -11.621 19.840 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.110 -10.422 20.012 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.353 -12.473 20.621 1.00 0.00 O ATOM 0 H ASP A 26 -8.258 -11.356 17.357 1.00 0.00 H new ATOM 0 HA ASP A 26 -5.873 -10.026 18.036 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -6.763 -12.944 18.150 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.235 -12.403 18.815 1.00 0.00 H new ATOM 392 N ILE A 27 -5.640 -12.169 15.530 1.00 0.00 N ATOM 393 CA ILE A 27 -4.786 -12.573 14.419 1.00 0.00 C ATOM 394 C ILE A 27 -4.460 -11.369 13.543 1.00 0.00 C ATOM 395 O ILE A 27 -3.321 -11.188 13.121 1.00 0.00 O ATOM 396 CB ILE A 27 -5.478 -13.656 13.581 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.551 -14.957 14.387 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.690 -13.905 12.284 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.476 -15.949 13.678 1.00 0.00 C ATOM 0 H ILE A 27 -6.561 -12.608 15.539 1.00 0.00 H new ATOM 0 HA ILE A 27 -3.859 -12.980 14.824 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.484 -13.321 13.330 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.555 -15.386 14.495 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -5.921 -14.754 15.392 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.190 -14.675 11.697 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.641 -12.983 11.705 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.680 -14.234 12.529 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.527 -16.874 14.253 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.474 -15.519 13.593 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.087 -16.162 12.682 1.00 0.00 H new ATOM 411 N LEU A 28 -5.472 -10.556 13.267 1.00 0.00 N ATOM 412 CA LEU A 28 -5.276 -9.377 12.438 1.00 0.00 C ATOM 413 C LEU A 28 -4.310 -8.408 13.101 1.00 0.00 C ATOM 414 O LEU A 28 -3.413 -7.881 12.452 1.00 0.00 O ATOM 415 CB LEU A 28 -6.621 -8.681 12.206 1.00 0.00 C ATOM 416 CG LEU A 28 -7.473 -9.503 11.210 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.950 -9.119 11.357 1.00 0.00 C ATOM 418 CD2 LEU A 28 -7.015 -9.210 9.764 1.00 0.00 C ATOM 0 H LEU A 28 -6.426 -10.690 13.601 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.854 -9.691 11.483 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.153 -8.574 13.151 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.458 -7.676 11.816 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.346 -10.564 11.424 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.548 -9.699 10.655 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.281 -9.328 12.374 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -9.072 -8.056 11.147 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.618 -9.791 9.066 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.137 -8.148 9.552 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.966 -9.484 9.652 1.00 0.00 H new ATOM 430 N THR A 29 -4.494 -8.188 14.399 1.00 0.00 N ATOM 431 CA THR A 29 -3.632 -7.276 15.142 1.00 0.00 C ATOM 432 C THR A 29 -2.190 -7.770 15.145 1.00 0.00 C ATOM 433 O THR A 29 -1.254 -6.987 15.000 1.00 0.00 O ATOM 434 CB THR A 29 -4.124 -7.150 16.584 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.440 -6.618 16.588 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.190 -6.222 17.359 1.00 0.00 C ATOM 0 H THR A 29 -5.228 -8.626 14.955 1.00 0.00 H new ATOM 0 HA THR A 29 -3.669 -6.303 14.653 1.00 0.00 H new ATOM 0 HB THR A 29 -4.131 -8.132 17.057 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.074 -7.311 16.308 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.539 -6.131 18.388 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.181 -6.634 17.353 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.183 -5.238 16.890 1.00 0.00 H new ATOM 444 N VAL A 30 -2.019 -9.071 15.321 1.00 0.00 N ATOM 445 CA VAL A 30 -0.684 -9.653 15.346 1.00 0.00 C ATOM 446 C VAL A 30 0.022 -9.498 13.996 1.00 0.00 C ATOM 447 O VAL A 30 1.175 -9.078 13.930 1.00 0.00 O ATOM 448 CB VAL A 30 -0.786 -11.145 15.708 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.588 -11.803 15.553 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.265 -11.293 17.160 1.00 0.00 C ATOM 0 H VAL A 30 -2.779 -9.739 15.448 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.095 -9.124 16.095 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.499 -11.630 15.042 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.516 -12.860 15.809 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.926 -11.702 14.522 1.00 0.00 H new ATOM 0 HG13 VAL A 30 1.302 -11.316 16.218 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.336 -12.351 17.414 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.555 -10.807 17.829 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.244 -10.827 17.269 1.00 0.00 H new ATOM 460 N PHE A 31 -0.678 -9.842 12.924 1.00 0.00 N ATOM 461 CA PHE A 31 -0.116 -9.754 11.573 1.00 0.00 C ATOM 462 C PHE A 31 -0.229 -8.331 11.005 1.00 0.00 C ATOM 463 O PHE A 31 0.369 -8.012 9.977 1.00 0.00 O ATOM 464 CB PHE A 31 -0.833 -10.749 10.648 1.00 0.00 C ATOM 465 CG PHE A 31 -0.328 -12.156 10.917 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.688 -12.818 12.096 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.496 -12.794 9.981 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.225 -14.114 12.343 1.00 0.00 C ATOM 469 CE2 PHE A 31 0.959 -14.092 10.229 1.00 0.00 C ATOM 470 CZ PHE A 31 0.599 -14.752 11.410 1.00 0.00 C ATOM 0 H PHE A 31 -1.638 -10.186 12.958 1.00 0.00 H new ATOM 0 HA PHE A 31 0.943 -10.005 11.631 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.910 -10.701 10.812 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.657 -10.483 9.606 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.325 -12.327 12.817 1.00 0.00 H new ATOM 0 HD2 PHE A 31 0.774 -12.286 9.070 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.504 -14.622 13.254 1.00 0.00 H new ATOM 0 HE2 PHE A 31 1.595 -14.585 9.508 1.00 0.00 H new ATOM 0 HZ PHE A 31 0.957 -15.753 11.601 1.00 0.00 H new ATOM 480 N SER A 32 -1.014 -7.486 11.669 1.00 0.00 N ATOM 481 CA SER A 32 -1.221 -6.111 11.195 1.00 0.00 C ATOM 482 C SER A 32 0.087 -5.461 10.729 1.00 0.00 C ATOM 483 O SER A 32 0.196 -5.027 9.579 1.00 0.00 O ATOM 484 CB SER A 32 -1.808 -5.257 12.314 1.00 0.00 C ATOM 485 OG SER A 32 -0.906 -5.243 13.410 1.00 0.00 O ATOM 0 H SER A 32 -1.514 -7.720 12.527 1.00 0.00 H new ATOM 0 HA SER A 32 -1.906 -6.165 10.349 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.984 -4.242 11.959 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.773 -5.657 12.626 1.00 0.00 H new ATOM 0 HG SER A 32 -0.818 -6.149 13.773 1.00 0.00 H new ATOM 491 N GLU A 33 1.077 -5.406 11.615 1.00 0.00 N ATOM 492 CA GLU A 33 2.374 -4.812 11.279 1.00 0.00 C ATOM 493 C GLU A 33 3.152 -5.683 10.297 1.00 0.00 C ATOM 494 O GLU A 33 3.826 -5.182 9.396 1.00 0.00 O ATOM 495 CB GLU A 33 3.202 -4.614 12.553 1.00 0.00 C ATOM 496 CG GLU A 33 4.521 -3.916 12.205 1.00 0.00 C ATOM 497 CD GLU A 33 5.313 -3.631 13.476 1.00 0.00 C ATOM 498 OE1 GLU A 33 4.869 -4.045 14.533 1.00 0.00 O ATOM 499 OE2 GLU A 33 6.351 -2.997 13.373 1.00 0.00 O ATOM 0 H GLU A 33 1.010 -5.763 12.568 1.00 0.00 H new ATOM 0 HA GLU A 33 2.186 -3.849 10.805 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.642 -4.018 13.274 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.401 -5.577 13.023 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.108 -4.544 11.534 1.00 0.00 H new ATOM 0 HG3 GLU A 33 4.320 -2.985 11.676 1.00 0.00 H new ATOM 506 N TYR A 34 3.060 -6.989 10.483 1.00 0.00 N ATOM 507 CA TYR A 34 3.764 -7.938 9.626 1.00 0.00 C ATOM 508 C TYR A 34 3.016 -8.156 8.313 1.00 0.00 C ATOM 509 O TYR A 34 3.016 -9.262 7.772 1.00 0.00 O ATOM 510 CB TYR A 34 3.956 -9.272 10.359 1.00 0.00 C ATOM 511 CG TYR A 34 4.548 -9.024 11.736 1.00 0.00 C ATOM 512 CD1 TYR A 34 5.754 -8.324 11.865 1.00 0.00 C ATOM 513 CD2 TYR A 34 3.883 -9.483 12.881 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.297 -8.091 13.135 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.424 -9.250 14.149 1.00 0.00 C ATOM 516 CZ TYR A 34 5.632 -8.554 14.276 1.00 0.00 C ATOM 517 OH TYR A 34 6.166 -8.322 15.528 1.00 0.00 O ATOM 0 H TYR A 34 2.504 -7.421 11.221 1.00 0.00 H new ATOM 0 HA TYR A 34 4.742 -7.520 9.389 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.000 -9.787 10.452 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.614 -9.923 9.782 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.266 -7.964 10.985 1.00 0.00 H new ATOM 0 HD2 TYR A 34 2.950 -10.018 12.784 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.229 -7.554 13.234 1.00 0.00 H new ATOM 0 HE2 TYR A 34 3.910 -9.607 15.030 1.00 0.00 H new ATOM 0 HH TYR A 34 6.678 -7.486 15.516 1.00 0.00 H new ATOM 527 N GLY A 35 2.367 -7.101 7.808 1.00 0.00 N ATOM 528 CA GLY A 35 1.610 -7.235 6.560 1.00 0.00 C ATOM 529 C GLY A 35 0.132 -7.466 6.831 1.00 0.00 C ATOM 530 O GLY A 35 -0.363 -8.579 6.672 1.00 0.00 O ATOM 0 H GLY A 35 2.349 -6.172 8.229 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.735 -6.335 5.958 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.009 -8.066 5.978 1.00 0.00 H new ATOM 534 N VAL A 36 -0.564 -6.415 7.264 1.00 0.00 N ATOM 535 CA VAL A 36 -1.976 -6.546 7.612 1.00 0.00 C ATOM 536 C VAL A 36 -2.764 -7.200 6.462 1.00 0.00 C ATOM 537 O VAL A 36 -2.979 -6.600 5.409 1.00 0.00 O ATOM 538 CB VAL A 36 -2.561 -5.147 7.886 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.568 -4.308 6.588 1.00 0.00 C ATOM 540 CG2 VAL A 36 -3.995 -5.297 8.410 1.00 0.00 C ATOM 0 H VAL A 36 -0.179 -5.478 7.381 1.00 0.00 H new ATOM 0 HA VAL A 36 -2.059 -7.175 8.498 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.946 -4.639 8.629 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -2.984 -3.322 6.795 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.548 -4.202 6.218 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -3.177 -4.808 5.835 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.416 -4.311 8.606 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.603 -5.809 7.664 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.986 -5.878 9.332 1.00 0.00 H new ATOM 550 N PRO A 37 -3.194 -8.445 6.660 1.00 0.00 N ATOM 551 CA PRO A 37 -3.972 -9.215 5.640 1.00 0.00 C ATOM 552 C PRO A 37 -5.290 -8.532 5.288 1.00 0.00 C ATOM 553 O PRO A 37 -5.828 -7.756 6.077 1.00 0.00 O ATOM 554 CB PRO A 37 -4.234 -10.581 6.311 1.00 0.00 C ATOM 555 CG PRO A 37 -3.239 -10.676 7.417 1.00 0.00 C ATOM 556 CD PRO A 37 -2.980 -9.260 7.879 1.00 0.00 C ATOM 0 HA PRO A 37 -3.427 -9.298 4.700 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.253 -10.642 6.693 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -4.111 -11.398 5.600 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.623 -11.287 8.234 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -2.318 -11.147 7.072 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.661 -8.969 8.679 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -1.967 -9.144 8.265 1.00 0.00 H new ATOM 564 N VAL A 38 -5.804 -8.826 4.101 1.00 0.00 N ATOM 565 CA VAL A 38 -7.068 -8.235 3.657 1.00 0.00 C ATOM 566 C VAL A 38 -8.221 -9.206 3.895 1.00 0.00 C ATOM 567 O VAL A 38 -9.389 -8.837 3.772 1.00 0.00 O ATOM 568 CB VAL A 38 -6.985 -7.882 2.169 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.907 -6.817 1.954 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.627 -9.136 1.366 1.00 0.00 C ATOM 0 H VAL A 38 -5.373 -9.463 3.431 1.00 0.00 H new ATOM 0 HA VAL A 38 -7.250 -7.327 4.232 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.948 -7.497 1.835 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.849 -6.567 0.895 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -6.159 -5.923 2.525 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.944 -7.201 2.289 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.568 -8.885 0.307 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.664 -9.521 1.702 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.394 -9.896 1.517 1.00 0.00 H new ATOM 580 N ASP A 39 -7.887 -10.450 4.237 1.00 0.00 N ATOM 581 CA ASP A 39 -8.905 -11.467 4.491 1.00 0.00 C ATOM 582 C ASP A 39 -8.339 -12.598 5.352 1.00 0.00 C ATOM 583 O ASP A 39 -7.198 -13.020 5.158 1.00 0.00 O ATOM 584 CB ASP A 39 -9.411 -12.034 3.163 1.00 0.00 C ATOM 585 CG ASP A 39 -10.652 -12.888 3.401 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.949 -13.159 4.552 1.00 0.00 O ATOM 587 OD2 ASP A 39 -11.286 -13.258 2.426 1.00 0.00 O ATOM 0 H ASP A 39 -6.926 -10.776 4.344 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.731 -11.002 5.029 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -9.645 -11.221 2.476 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -8.631 -12.633 2.693 1.00 0.00 H new ATOM 592 N VAL A 40 -9.140 -13.087 6.307 1.00 0.00 N ATOM 593 CA VAL A 40 -8.700 -14.175 7.197 1.00 0.00 C ATOM 594 C VAL A 40 -9.700 -15.331 7.160 1.00 0.00 C ATOM 595 O VAL A 40 -10.898 -15.132 7.358 1.00 0.00 O ATOM 596 CB VAL A 40 -8.559 -13.663 8.644 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.896 -14.744 9.529 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.705 -12.389 8.649 1.00 0.00 C ATOM 0 H VAL A 40 -10.087 -12.752 6.484 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.730 -14.529 6.848 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.548 -13.441 9.046 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.801 -14.371 10.549 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.511 -15.644 9.527 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.907 -14.980 9.136 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.603 -12.023 9.671 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.718 -12.611 8.243 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.186 -11.626 8.037 1.00 0.00 H new ATOM 608 N ILE A 41 -9.198 -16.544 6.908 1.00 0.00 N ATOM 609 CA ILE A 41 -10.060 -17.730 6.853 1.00 0.00 C ATOM 610 C ILE A 41 -9.829 -18.603 8.083 1.00 0.00 C ATOM 611 O ILE A 41 -8.746 -19.159 8.267 1.00 0.00 O ATOM 612 CB ILE A 41 -9.763 -18.540 5.588 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.989 -17.662 4.356 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.697 -19.751 5.526 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.484 -18.390 3.107 1.00 0.00 C ATOM 0 H ILE A 41 -8.209 -16.730 6.740 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.100 -17.404 6.834 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.727 -18.879 5.610 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.049 -17.431 4.251 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.466 -16.713 4.472 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.486 -20.328 4.626 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.539 -20.378 6.404 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.732 -19.411 5.505 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.646 -17.763 2.230 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.419 -18.598 3.213 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -10.027 -19.328 2.988 1.00 0.00 H new ATOM 627 N LEU A 42 -10.857 -18.725 8.925 1.00 0.00 N ATOM 628 CA LEU A 42 -10.762 -19.539 10.142 1.00 0.00 C ATOM 629 C LEU A 42 -11.750 -20.703 10.090 1.00 0.00 C ATOM 630 O LEU A 42 -12.935 -20.513 9.818 1.00 0.00 O ATOM 631 CB LEU A 42 -11.045 -18.661 11.395 1.00 0.00 C ATOM 632 CG LEU A 42 -9.726 -18.284 12.095 1.00 0.00 C ATOM 633 CD1 LEU A 42 -8.952 -17.293 11.223 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.022 -17.645 13.452 1.00 0.00 C ATOM 0 H LEU A 42 -11.762 -18.274 8.789 1.00 0.00 H new ATOM 0 HA LEU A 42 -9.752 -19.943 10.208 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -11.579 -17.758 11.101 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -11.690 -19.202 12.088 1.00 0.00 H new ATOM 0 HG LEU A 42 -9.129 -19.184 12.245 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -8.018 -17.025 11.717 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -8.734 -17.751 10.258 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.552 -16.396 11.071 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.085 -17.381 13.942 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -10.622 -16.747 13.308 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.570 -18.352 14.075 1.00 0.00 H new ATOM 646 N SER A 43 -11.253 -21.904 10.363 1.00 0.00 N ATOM 647 CA SER A 43 -12.098 -23.088 10.362 1.00 0.00 C ATOM 648 C SER A 43 -13.184 -22.962 11.433 1.00 0.00 C ATOM 649 O SER A 43 -13.018 -22.237 12.415 1.00 0.00 O ATOM 650 CB SER A 43 -11.251 -24.336 10.616 1.00 0.00 C ATOM 651 OG SER A 43 -10.784 -24.852 9.376 1.00 0.00 O ATOM 0 H SER A 43 -10.274 -22.081 10.587 1.00 0.00 H new ATOM 0 HA SER A 43 -12.576 -23.178 9.387 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.407 -24.091 11.261 1.00 0.00 H new ATOM 0 HB3 SER A 43 -11.842 -25.090 11.137 1.00 0.00 H new ATOM 0 HG SER A 43 -10.013 -25.436 9.534 1.00 0.00 H new ATOM 657 N ARG A 44 -14.300 -23.672 11.237 1.00 0.00 N ATOM 658 CA ARG A 44 -15.420 -23.630 12.188 1.00 0.00 C ATOM 659 C ARG A 44 -15.708 -25.018 12.753 1.00 0.00 C ATOM 660 O ARG A 44 -15.138 -26.012 12.308 1.00 0.00 O ATOM 661 CB ARG A 44 -16.670 -23.083 11.497 1.00 0.00 C ATOM 662 CG ARG A 44 -16.356 -21.722 10.870 1.00 0.00 C ATOM 663 CD ARG A 44 -17.661 -21.004 10.514 1.00 0.00 C ATOM 664 NE ARG A 44 -18.289 -20.476 11.719 1.00 0.00 N ATOM 665 CZ ARG A 44 -19.405 -19.756 11.654 1.00 0.00 C ATOM 666 NH1 ARG A 44 -19.955 -19.510 10.497 1.00 0.00 N ATOM 667 NH2 ARG A 44 -19.947 -19.293 12.747 1.00 0.00 N ATOM 0 H ARG A 44 -14.453 -24.281 10.433 1.00 0.00 H new ATOM 0 HA ARG A 44 -15.144 -22.973 13.013 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -17.008 -23.779 10.729 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -17.482 -22.984 12.217 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -15.774 -21.116 11.565 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -15.747 -21.855 9.976 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -17.459 -20.193 9.815 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -18.340 -21.695 10.014 1.00 0.00 H new ATOM 0 HE ARG A 44 -17.865 -20.662 12.628 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -19.529 -19.870 9.643 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -20.811 -18.958 10.446 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -19.515 -19.483 13.651 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -20.803 -18.741 12.697 1.00 0.00 H new ATOM 786 N GLY A 53 -7.918 -25.878 14.534 1.00 0.00 N ATOM 787 CA GLY A 53 -6.527 -26.278 14.765 1.00 0.00 C ATOM 788 C GLY A 53 -5.590 -25.622 13.755 1.00 0.00 C ATOM 789 O GLY A 53 -4.371 -25.790 13.826 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.229 -26.000 15.776 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.441 -27.362 14.694 1.00 0.00 H new ATOM 793 N PHE A 54 -6.163 -24.874 12.815 1.00 0.00 N ATOM 794 CA PHE A 54 -5.370 -24.191 11.795 1.00 0.00 C ATOM 795 C PHE A 54 -6.147 -23.022 11.193 1.00 0.00 C ATOM 796 O PHE A 54 -7.373 -22.962 11.300 1.00 0.00 O ATOM 797 CB PHE A 54 -4.984 -25.173 10.689 1.00 0.00 C ATOM 798 CG PHE A 54 -6.231 -25.830 10.146 1.00 0.00 C ATOM 799 CD1 PHE A 54 -6.984 -25.193 9.153 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.632 -27.079 10.634 1.00 0.00 C ATOM 801 CE1 PHE A 54 -8.138 -25.803 8.648 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.786 -27.690 10.130 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.540 -27.052 9.138 1.00 0.00 C ATOM 0 H PHE A 54 -7.169 -24.726 12.738 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.469 -23.802 12.269 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.458 -24.650 9.890 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.302 -25.928 11.079 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -6.674 -24.230 8.776 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.051 -27.571 11.400 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.718 -25.311 7.881 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.095 -28.654 10.507 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.431 -27.523 8.751 1.00 0.00 H new ATOM 813 N ALA A 55 -5.429 -22.098 10.555 1.00 0.00 N ATOM 814 CA ALA A 55 -6.063 -20.933 9.935 1.00 0.00 C ATOM 815 C ALA A 55 -5.224 -20.421 8.764 1.00 0.00 C ATOM 816 O ALA A 55 -4.010 -20.636 8.718 1.00 0.00 O ATOM 817 CB ALA A 55 -6.239 -19.819 10.968 1.00 0.00 C ATOM 0 H ALA A 55 -4.415 -22.132 10.454 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.041 -21.235 9.559 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -6.711 -18.957 10.497 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -6.867 -20.176 11.784 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.264 -19.529 11.360 1.00 0.00 H new ATOM 823 N TYR A 56 -5.875 -19.741 7.815 1.00 0.00 N ATOM 824 CA TYR A 56 -5.171 -19.201 6.644 1.00 0.00 C ATOM 825 C TYR A 56 -5.631 -17.775 6.348 1.00 0.00 C ATOM 826 O TYR A 56 -6.824 -17.481 6.377 1.00 0.00 O ATOM 827 CB TYR A 56 -5.441 -20.089 5.424 1.00 0.00 C ATOM 828 CG TYR A 56 -5.362 -21.543 5.832 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.198 -22.043 6.422 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.459 -22.391 5.622 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.126 -23.387 6.801 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.386 -23.736 6.000 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.221 -24.234 6.590 1.00 0.00 C ATOM 834 OH TYR A 56 -5.149 -25.560 6.964 1.00 0.00 O ATOM 0 H TYR A 56 -6.877 -19.552 7.832 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.103 -19.186 6.859 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.426 -19.869 5.011 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.713 -19.880 4.640 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.353 -21.391 6.585 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.360 -22.006 5.168 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.226 -23.772 7.257 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.230 -24.390 5.836 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.460 -25.657 7.888 1.00 0.00 H new ATOM 844 N LEU A 57 -4.678 -16.885 6.060 1.00 0.00 N ATOM 845 CA LEU A 57 -4.993 -15.482 5.760 1.00 0.00 C ATOM 846 C LEU A 57 -4.229 -15.020 4.515 1.00 0.00 C ATOM 847 O LEU A 57 -3.089 -15.426 4.296 1.00 0.00 O ATOM 848 CB LEU A 57 -4.645 -14.579 6.972 1.00 0.00 C ATOM 849 CG LEU A 57 -3.491 -15.197 7.794 1.00 0.00 C ATOM 850 CD1 LEU A 57 -2.199 -15.193 6.949 1.00 0.00 C ATOM 851 CD2 LEU A 57 -3.272 -14.384 9.097 1.00 0.00 C ATOM 0 H LEU A 57 -3.683 -17.108 6.028 1.00 0.00 H new ATOM 0 HA LEU A 57 -6.062 -15.401 5.563 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.360 -13.586 6.623 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.524 -14.455 7.605 1.00 0.00 H new ATOM 0 HG LEU A 57 -3.747 -16.223 8.059 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.384 -15.629 7.528 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.355 -15.779 6.043 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -1.944 -14.168 6.678 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -2.457 -14.827 9.670 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.020 -13.354 8.845 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.184 -14.399 9.693 1.00 0.00 H new ATOM 863 N LYS A 58 -4.865 -14.164 3.703 1.00 0.00 N ATOM 864 CA LYS A 58 -4.234 -13.651 2.481 1.00 0.00 C ATOM 865 C LYS A 58 -3.503 -12.341 2.755 1.00 0.00 C ATOM 866 O LYS A 58 -4.076 -11.402 3.310 1.00 0.00 O ATOM 867 CB LYS A 58 -5.292 -13.424 1.397 1.00 0.00 C ATOM 868 CG LYS A 58 -4.610 -12.983 0.099 1.00 0.00 C ATOM 869 CD LYS A 58 -5.656 -12.841 -1.007 1.00 0.00 C ATOM 870 CE LYS A 58 -4.962 -12.481 -2.322 1.00 0.00 C ATOM 871 NZ LYS A 58 -4.302 -11.152 -2.190 1.00 0.00 N ATOM 0 H LYS A 58 -5.809 -13.815 3.869 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.512 -14.392 2.138 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -5.858 -14.340 1.229 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -6.003 -12.665 1.722 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -4.095 -12.034 0.251 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.854 -13.712 -0.193 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -6.211 -13.773 -1.119 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.379 -12.069 -0.742 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.224 -13.242 -2.576 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.688 -12.459 -3.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.084 -10.777 -3.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.939 -10.495 -1.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.421 -11.254 -1.647 1.00 0.00 H new ATOM 885 N TYR A 59 -2.231 -12.281 2.362 1.00 0.00 N ATOM 886 CA TYR A 59 -1.426 -11.078 2.573 1.00 0.00 C ATOM 887 C TYR A 59 -1.409 -10.212 1.317 1.00 0.00 C ATOM 888 O TYR A 59 -1.582 -10.709 0.205 1.00 0.00 O ATOM 889 CB TYR A 59 0.006 -11.468 2.939 1.00 0.00 C ATOM 890 CG TYR A 59 0.537 -12.458 1.924 1.00 0.00 C ATOM 891 CD1 TYR A 59 0.941 -12.020 0.658 1.00 0.00 C ATOM 892 CD2 TYR A 59 0.628 -13.817 2.257 1.00 0.00 C ATOM 893 CE1 TYR A 59 1.433 -12.939 -0.277 1.00 0.00 C ATOM 894 CE2 TYR A 59 1.122 -14.735 1.322 1.00 0.00 C ATOM 895 CZ TYR A 59 1.524 -14.296 0.054 1.00 0.00 C ATOM 896 OH TYR A 59 2.010 -15.201 -0.869 1.00 0.00 O ATOM 0 H TYR A 59 -1.739 -13.045 1.899 1.00 0.00 H new ATOM 0 HA TYR A 59 -1.871 -10.507 3.388 1.00 0.00 H new ATOM 0 HB2 TYR A 59 0.640 -10.582 2.964 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.031 -11.906 3.937 1.00 0.00 H new ATOM 0 HD1 TYR A 59 0.873 -10.973 0.402 1.00 0.00 H new ATOM 0 HD2 TYR A 59 0.317 -14.156 3.234 1.00 0.00 H new ATOM 0 HE1 TYR A 59 1.743 -12.600 -1.255 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.193 -15.782 1.579 1.00 0.00 H new ATOM 0 HH TYR A 59 2.008 -16.100 -0.478 1.00 0.00 H new ATOM 906 N GLU A 60 -1.203 -8.913 1.503 1.00 0.00 N ATOM 907 CA GLU A 60 -1.157 -7.985 0.377 1.00 0.00 C ATOM 908 C GLU A 60 0.123 -8.173 -0.439 1.00 0.00 C ATOM 909 O GLU A 60 0.100 -8.127 -1.668 1.00 0.00 O ATOM 910 CB GLU A 60 -1.231 -6.541 0.886 1.00 0.00 C ATOM 911 CG GLU A 60 -1.211 -5.573 -0.302 1.00 0.00 C ATOM 912 CD GLU A 60 -1.377 -4.138 0.188 1.00 0.00 C ATOM 913 OE1 GLU A 60 -2.435 -3.829 0.709 1.00 0.00 O ATOM 914 OE2 GLU A 60 -0.441 -3.370 0.034 1.00 0.00 O ATOM 0 H GLU A 60 -1.066 -8.480 2.416 1.00 0.00 H new ATOM 0 HA GLU A 60 -2.012 -8.192 -0.267 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.140 -6.397 1.470 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.391 -6.335 1.549 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -0.272 -5.673 -0.847 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -2.012 -5.823 -0.998 1.00 0.00 H new ATOM 921 N ASP A 61 1.245 -8.379 0.255 1.00 0.00 N ATOM 922 CA ASP A 61 2.543 -8.559 -0.412 1.00 0.00 C ATOM 923 C ASP A 61 3.205 -9.867 0.015 1.00 0.00 C ATOM 924 O ASP A 61 3.003 -10.339 1.130 1.00 0.00 O ATOM 925 CB ASP A 61 3.461 -7.384 -0.069 1.00 0.00 C ATOM 926 CG ASP A 61 2.823 -6.076 -0.524 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.194 -6.078 -1.569 1.00 0.00 O ATOM 928 OD2 ASP A 61 2.973 -5.091 0.181 1.00 0.00 O ATOM 0 H ASP A 61 1.284 -8.426 1.273 1.00 0.00 H new ATOM 0 HA ASP A 61 2.374 -8.597 -1.488 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.643 -7.355 1.005 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.429 -7.514 -0.553 1.00 0.00 H new ATOM 933 N GLN A 62 3.995 -10.447 -0.884 1.00 0.00 N ATOM 934 CA GLN A 62 4.688 -11.697 -0.591 1.00 0.00 C ATOM 935 C GLN A 62 5.715 -11.494 0.518 1.00 0.00 C ATOM 936 O GLN A 62 5.952 -12.388 1.330 1.00 0.00 O ATOM 937 CB GLN A 62 5.378 -12.226 -1.849 1.00 0.00 C ATOM 938 CG GLN A 62 4.324 -12.698 -2.852 1.00 0.00 C ATOM 939 CD GLN A 62 4.998 -13.172 -4.134 1.00 0.00 C ATOM 940 OE1 GLN A 62 5.155 -12.397 -5.077 1.00 0.00 O ATOM 941 NE2 GLN A 62 5.412 -14.408 -4.225 1.00 0.00 N ATOM 0 H GLN A 62 4.171 -10.074 -1.817 1.00 0.00 H new ATOM 0 HA GLN A 62 3.952 -12.427 -0.255 1.00 0.00 H new ATOM 0 HB2 GLN A 62 5.994 -11.445 -2.294 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.044 -13.049 -1.592 1.00 0.00 H new ATOM 0 HG2 GLN A 62 3.736 -13.508 -2.420 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.632 -11.885 -3.074 1.00 0.00 H new ATOM 0 HE21 GLN A 62 5.281 -15.049 -3.442 1.00 0.00 H new ATOM 0 HE22 GLN A 62 5.866 -14.732 -5.079 1.00 0.00 H new ATOM 950 N ARG A 63 6.324 -10.315 0.540 1.00 0.00 N ATOM 951 CA ARG A 63 7.332 -10.004 1.547 1.00 0.00 C ATOM 952 C ARG A 63 6.744 -10.142 2.949 1.00 0.00 C ATOM 953 O ARG A 63 7.476 -10.304 3.926 1.00 0.00 O ATOM 954 CB ARG A 63 7.849 -8.578 1.348 1.00 0.00 C ATOM 955 CG ARG A 63 8.744 -8.528 0.108 1.00 0.00 C ATOM 956 CD ARG A 63 9.225 -7.092 -0.117 1.00 0.00 C ATOM 957 NE ARG A 63 10.305 -7.069 -1.102 1.00 0.00 N ATOM 958 CZ ARG A 63 10.054 -6.999 -2.408 1.00 0.00 C ATOM 959 NH1 ARG A 63 8.821 -6.948 -2.832 1.00 0.00 N ATOM 960 NH2 ARG A 63 11.039 -6.981 -3.262 1.00 0.00 N ATOM 0 H ARG A 63 6.140 -9.562 -0.123 1.00 0.00 H new ATOM 0 HA ARG A 63 8.158 -10.707 1.438 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.012 -7.889 1.234 1.00 0.00 H new ATOM 0 HB3 ARG A 63 8.408 -8.257 2.227 1.00 0.00 H new ATOM 0 HG2 ARG A 63 9.598 -9.193 0.236 1.00 0.00 H new ATOM 0 HG3 ARG A 63 8.194 -8.880 -0.765 1.00 0.00 H new ATOM 0 HD2 ARG A 63 8.396 -6.473 -0.461 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.572 -6.666 0.824 1.00 0.00 H new ATOM 0 HE ARG A 63 11.273 -7.107 -0.782 1.00 0.00 H new ATOM 0 HH11 ARG A 63 8.051 -6.962 -2.163 1.00 0.00 H new ATOM 0 HH12 ARG A 63 8.627 -6.894 -3.832 1.00 0.00 H new ATOM 0 HH21 ARG A 63 12.003 -7.021 -2.930 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.846 -6.927 -4.262 1.00 0.00 H new ATOM 974 N SER A 64 5.420 -10.078 3.041 1.00 0.00 N ATOM 975 CA SER A 64 4.744 -10.207 4.325 1.00 0.00 C ATOM 976 C SER A 64 5.032 -11.563 4.956 1.00 0.00 C ATOM 977 O SER A 64 5.241 -11.660 6.164 1.00 0.00 O ATOM 978 CB SER A 64 3.238 -10.049 4.145 1.00 0.00 C ATOM 979 OG SER A 64 2.591 -10.253 5.393 1.00 0.00 O ATOM 0 H SER A 64 4.797 -9.938 2.246 1.00 0.00 H new ATOM 0 HA SER A 64 5.120 -9.423 4.982 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.009 -9.055 3.762 1.00 0.00 H new ATOM 0 HB3 SER A 64 2.871 -10.766 3.411 1.00 0.00 H new ATOM 0 HG SER A 64 3.157 -9.908 6.115 1.00 0.00 H new ATOM 985 N THR A 65 5.033 -12.604 4.129 1.00 0.00 N ATOM 986 CA THR A 65 5.283 -13.952 4.623 1.00 0.00 C ATOM 987 C THR A 65 6.660 -14.044 5.261 1.00 0.00 C ATOM 988 O THR A 65 6.823 -14.648 6.317 1.00 0.00 O ATOM 989 CB THR A 65 5.192 -14.955 3.467 1.00 0.00 C ATOM 990 OG1 THR A 65 6.222 -14.685 2.528 1.00 0.00 O ATOM 991 CG2 THR A 65 3.829 -14.825 2.779 1.00 0.00 C ATOM 0 H THR A 65 4.865 -12.541 3.125 1.00 0.00 H new ATOM 0 HA THR A 65 4.530 -14.187 5.375 1.00 0.00 H new ATOM 0 HB THR A 65 5.306 -15.967 3.855 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.896 -14.047 1.859 1.00 0.00 H new ATOM 0 HG21 THR A 65 3.766 -15.539 1.958 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.037 -15.030 3.499 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.713 -13.813 2.390 1.00 0.00 H new ATOM 999 N ILE A 66 7.643 -13.432 4.620 1.00 0.00 N ATOM 1000 CA ILE A 66 9.005 -13.451 5.138 1.00 0.00 C ATOM 1001 C ILE A 66 9.056 -12.789 6.506 1.00 0.00 C ATOM 1002 O ILE A 66 9.696 -13.296 7.428 1.00 0.00 O ATOM 1003 CB ILE A 66 9.942 -12.719 4.172 1.00 0.00 C ATOM 1004 CG1 ILE A 66 10.046 -13.508 2.866 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.335 -12.598 4.801 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.759 -12.661 1.810 1.00 0.00 C ATOM 0 H ILE A 66 7.527 -12.919 3.746 1.00 0.00 H new ATOM 0 HA ILE A 66 9.329 -14.487 5.235 1.00 0.00 H new ATOM 0 HB ILE A 66 9.545 -11.724 3.969 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.593 -14.436 3.033 1.00 0.00 H new ATOM 0 HG13 ILE A 66 9.051 -13.783 2.515 1.00 0.00 H new ATOM 0 HG21 ILE A 66 12.001 -12.077 4.113 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.266 -12.037 5.733 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.730 -13.593 5.005 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.832 -13.225 0.880 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.194 -11.745 1.636 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.760 -12.409 2.161 1.00 0.00 H new ATOM 1018 N LEU A 67 8.383 -11.651 6.630 1.00 0.00 N ATOM 1019 CA LEU A 67 8.364 -10.929 7.895 1.00 0.00 C ATOM 1020 C LEU A 67 7.658 -11.732 8.979 1.00 0.00 C ATOM 1021 O LEU A 67 8.270 -12.117 9.970 1.00 0.00 O ATOM 1022 CB LEU A 67 7.642 -9.580 7.716 1.00 0.00 C ATOM 1023 CG LEU A 67 8.623 -8.537 7.148 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.832 -7.319 6.662 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.632 -8.102 8.245 1.00 0.00 C ATOM 0 H LEU A 67 7.849 -11.213 5.879 1.00 0.00 H new ATOM 0 HA LEU A 67 9.397 -10.763 8.201 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.792 -9.698 7.044 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.247 -9.238 8.673 1.00 0.00 H new ATOM 0 HG LEU A 67 9.175 -8.974 6.316 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.520 -6.576 6.258 1.00 0.00 H new ATOM 0 HD12 LEU A 67 7.132 -7.626 5.885 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.280 -6.887 7.497 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.321 -7.365 7.834 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.091 -7.665 9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.193 -8.971 8.588 1.00 0.00 H new ATOM 1037 N ALA A 68 6.373 -11.994 8.773 1.00 0.00 N ATOM 1038 CA ALA A 68 5.591 -12.731 9.758 1.00 0.00 C ATOM 1039 C ALA A 68 6.304 -14.006 10.181 1.00 0.00 C ATOM 1040 O ALA A 68 6.313 -14.357 11.360 1.00 0.00 O ATOM 1041 CB ALA A 68 4.225 -13.090 9.173 1.00 0.00 C ATOM 0 H ALA A 68 5.854 -11.711 7.942 1.00 0.00 H new ATOM 0 HA ALA A 68 5.466 -12.094 10.634 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.645 -13.641 9.914 1.00 0.00 H new ATOM 0 HB2 ALA A 68 3.694 -12.177 8.902 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.360 -13.708 8.286 1.00 0.00 H new ATOM 1047 N VAL A 69 6.902 -14.689 9.218 1.00 0.00 N ATOM 1048 CA VAL A 69 7.609 -15.922 9.517 1.00 0.00 C ATOM 1049 C VAL A 69 8.779 -15.674 10.473 1.00 0.00 C ATOM 1050 O VAL A 69 8.748 -16.098 11.619 1.00 0.00 O ATOM 1051 CB VAL A 69 8.136 -16.545 8.209 1.00 0.00 C ATOM 1052 CG1 VAL A 69 9.111 -17.691 8.530 1.00 0.00 C ATOM 1053 CG2 VAL A 69 6.956 -17.101 7.385 1.00 0.00 C ATOM 0 H VAL A 69 6.912 -14.415 8.236 1.00 0.00 H new ATOM 0 HA VAL A 69 6.912 -16.605 10.001 1.00 0.00 H new ATOM 0 HB VAL A 69 8.654 -15.776 7.636 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.479 -18.126 7.601 1.00 0.00 H new ATOM 0 HG12 VAL A 69 9.951 -17.303 9.107 1.00 0.00 H new ATOM 0 HG13 VAL A 69 8.595 -18.456 9.110 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.332 -17.540 6.461 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.435 -17.864 7.964 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.265 -16.292 7.147 1.00 0.00 H new ATOM 1063 N ASP A 70 9.798 -14.972 9.996 1.00 0.00 N ATOM 1064 CA ASP A 70 10.981 -14.700 10.813 1.00 0.00 C ATOM 1065 C ASP A 70 10.641 -13.863 12.049 1.00 0.00 C ATOM 1066 O ASP A 70 11.376 -13.863 13.035 1.00 0.00 O ATOM 1067 CB ASP A 70 12.021 -13.952 9.978 1.00 0.00 C ATOM 1068 CG ASP A 70 12.612 -14.883 8.924 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.426 -16.082 9.051 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.238 -14.383 8.004 1.00 0.00 O ATOM 0 H ASP A 70 9.833 -14.581 9.054 1.00 0.00 H new ATOM 0 HA ASP A 70 11.376 -15.659 11.148 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.560 -13.090 9.496 1.00 0.00 H new ATOM 0 HB3 ASP A 70 12.812 -13.571 10.624 1.00 0.00 H new ATOM 1075 N ASN A 71 9.530 -13.145 11.982 1.00 0.00 N ATOM 1076 CA ASN A 71 9.115 -12.296 13.100 1.00 0.00 C ATOM 1077 C ASN A 71 8.497 -13.101 14.244 1.00 0.00 C ATOM 1078 O ASN A 71 8.865 -12.925 15.404 1.00 0.00 O ATOM 1079 CB ASN A 71 8.091 -11.271 12.610 1.00 0.00 C ATOM 1080 CG ASN A 71 8.771 -10.252 11.699 1.00 0.00 C ATOM 1081 OD1 ASN A 71 10.067 -10.283 11.546 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 8.103 -9.408 11.107 1.00 0.00 N flip ATOM 0 H ASN A 71 8.903 -13.129 11.178 1.00 0.00 H new ATOM 0 HA ASN A 71 10.009 -11.802 13.480 1.00 0.00 H new ATOM 0 HB2 ASN A 71 7.288 -11.775 12.071 1.00 0.00 H new ATOM 0 HB3 ASN A 71 7.635 -10.764 13.461 1.00 0.00 H new ATOM 0 HD21 ASN A 71 7.090 -9.384 11.226 1.00 0.00 H new ATOM 0 HD22 ASN A 71 8.561 -8.732 10.496 1.00 0.00 H new ATOM 1089 N LEU A 72 7.554 -13.991 13.914 1.00 0.00 N ATOM 1090 CA LEU A 72 6.873 -14.810 14.933 1.00 0.00 C ATOM 1091 C LEU A 72 7.295 -16.290 14.851 1.00 0.00 C ATOM 1092 O LEU A 72 6.609 -17.172 15.368 1.00 0.00 O ATOM 1093 CB LEU A 72 5.338 -14.671 14.748 1.00 0.00 C ATOM 1094 CG LEU A 72 4.780 -13.583 15.693 1.00 0.00 C ATOM 1095 CD1 LEU A 72 5.400 -12.227 15.349 1.00 0.00 C ATOM 1096 CD2 LEU A 72 3.262 -13.498 15.539 1.00 0.00 C ATOM 0 H LEU A 72 7.244 -14.165 12.958 1.00 0.00 H new ATOM 0 HA LEU A 72 7.162 -14.450 15.920 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.111 -14.414 13.713 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.852 -15.625 14.954 1.00 0.00 H new ATOM 0 HG LEU A 72 5.029 -13.844 16.722 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.002 -11.465 16.019 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.483 -12.282 15.464 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.157 -11.967 14.319 1.00 0.00 H new ATOM 0 HD21 LEU A 72 2.871 -12.730 16.206 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.015 -13.243 14.508 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.816 -14.460 15.792 1.00 0.00 H new ATOM 1108 N ASN A 73 8.425 -16.551 14.207 1.00 0.00 N ATOM 1109 CA ASN A 73 8.922 -17.921 14.078 1.00 0.00 C ATOM 1110 C ASN A 73 9.568 -18.349 15.391 1.00 0.00 C ATOM 1111 O ASN A 73 10.633 -17.855 15.760 1.00 0.00 O ATOM 1112 CB ASN A 73 9.948 -18.017 12.930 1.00 0.00 C ATOM 1113 CG ASN A 73 10.890 -19.204 13.136 1.00 0.00 C ATOM 1114 OD1 ASN A 73 10.436 -20.337 13.302 1.00 0.00 O ATOM 1115 ND2 ASN A 73 12.181 -19.008 13.147 1.00 0.00 N ATOM 0 H ASN A 73 9.012 -15.842 13.768 1.00 0.00 H new ATOM 0 HA ASN A 73 8.087 -18.583 13.849 1.00 0.00 H new ATOM 0 HB2 ASN A 73 9.426 -18.123 11.979 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.526 -17.094 12.876 1.00 0.00 H new ATOM 0 HD21 ASN A 73 12.815 -19.794 13.293 1.00 0.00 H new ATOM 0 HD22 ASN A 73 12.556 -18.069 13.009 1.00 0.00 H new ATOM 1122 N GLY A 74 8.922 -19.278 16.083 1.00 0.00 N ATOM 1123 CA GLY A 74 9.447 -19.770 17.348 1.00 0.00 C ATOM 1124 C GLY A 74 8.929 -18.928 18.509 1.00 0.00 C ATOM 1125 O GLY A 74 9.269 -19.180 19.665 1.00 0.00 O ATOM 0 H GLY A 74 8.041 -19.703 15.792 1.00 0.00 H new ATOM 0 HA2 GLY A 74 9.156 -20.811 17.488 1.00 0.00 H new ATOM 0 HA3 GLY A 74 10.537 -19.744 17.330 1.00 0.00 H new ATOM 1129 N PHE A 75 8.106 -17.926 18.192 1.00 0.00 N ATOM 1130 CA PHE A 75 7.550 -17.054 19.220 1.00 0.00 C ATOM 1131 C PHE A 75 6.381 -17.739 19.921 1.00 0.00 C ATOM 1132 O PHE A 75 5.507 -18.312 19.270 1.00 0.00 O ATOM 1133 CB PHE A 75 7.084 -15.737 18.595 1.00 0.00 C ATOM 1134 CG PHE A 75 6.750 -14.751 19.691 1.00 0.00 C ATOM 1135 CD1 PHE A 75 7.762 -14.270 20.529 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.425 -14.323 19.872 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.453 -13.358 21.545 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.119 -13.410 20.885 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.131 -12.927 21.723 1.00 0.00 C ATOM 0 H PHE A 75 7.814 -17.702 17.241 1.00 0.00 H new ATOM 0 HA PHE A 75 8.326 -16.844 19.956 1.00 0.00 H new ATOM 0 HB2 PHE A 75 7.864 -15.331 17.951 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.210 -15.909 17.967 1.00 0.00 H new ATOM 0 HD1 PHE A 75 8.781 -14.602 20.392 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.643 -14.699 19.229 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.234 -12.986 22.192 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.101 -13.077 21.021 1.00 0.00 H new ATOM 0 HZ PHE A 75 5.893 -12.223 22.506 1.00 0.00 H new ATOM 1149 N LYS A 76 6.372 -17.685 21.253 1.00 0.00 N ATOM 1150 CA LYS A 76 5.304 -18.311 22.034 1.00 0.00 C ATOM 1151 C LYS A 76 4.195 -17.315 22.367 1.00 0.00 C ATOM 1152 O LYS A 76 4.466 -16.193 22.795 1.00 0.00 O ATOM 1153 CB LYS A 76 5.879 -18.877 23.333 1.00 0.00 C ATOM 1154 CG LYS A 76 6.781 -20.069 23.014 1.00 0.00 C ATOM 1155 CD LYS A 76 7.354 -20.635 24.312 1.00 0.00 C ATOM 1156 CE LYS A 76 8.230 -21.849 23.995 1.00 0.00 C ATOM 1157 NZ LYS A 76 8.767 -22.417 25.264 1.00 0.00 N ATOM 0 H LYS A 76 7.087 -17.218 21.811 1.00 0.00 H new ATOM 0 HA LYS A 76 4.876 -19.112 21.431 1.00 0.00 H new ATOM 0 HB2 LYS A 76 6.446 -18.108 23.858 1.00 0.00 H new ATOM 0 HB3 LYS A 76 5.071 -19.186 23.997 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.214 -20.837 22.489 1.00 0.00 H new ATOM 0 HG3 LYS A 76 7.589 -19.760 22.351 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.941 -19.874 24.826 1.00 0.00 H new ATOM 0 HD3 LYS A 76 6.546 -20.922 24.985 1.00 0.00 H new ATOM 0 HE2 LYS A 76 7.648 -22.602 23.464 1.00 0.00 H new ATOM 0 HE3 LYS A 76 9.050 -21.558 23.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 9.363 -23.242 25.050 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 9.336 -21.697 25.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 7.978 -22.709 25.875 1.00 0.00 H new ATOM 1171 N ILE A 77 2.942 -17.730 22.166 1.00 0.00 N ATOM 1172 CA ILE A 77 1.790 -16.872 22.457 1.00 0.00 C ATOM 1173 C ILE A 77 0.646 -17.695 23.047 1.00 0.00 C ATOM 1174 O ILE A 77 0.203 -18.675 22.448 1.00 0.00 O ATOM 1175 CB ILE A 77 1.311 -16.148 21.175 1.00 0.00 C ATOM 1176 CG1 ILE A 77 2.221 -14.946 20.897 1.00 0.00 C ATOM 1177 CG2 ILE A 77 -0.139 -15.663 21.346 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.936 -14.392 19.499 1.00 0.00 C ATOM 0 H ILE A 77 2.699 -18.652 21.804 1.00 0.00 H new ATOM 0 HA ILE A 77 2.100 -16.124 23.187 1.00 0.00 H new ATOM 0 HB ILE A 77 1.355 -16.845 20.338 1.00 0.00 H new ATOM 0 HG12 ILE A 77 2.055 -14.172 21.646 1.00 0.00 H new ATOM 0 HG13 ILE A 77 3.267 -15.244 20.974 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -0.463 -15.156 20.437 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -0.789 -16.518 21.536 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -0.195 -14.971 22.187 1.00 0.00 H new ATOM 0 HD11 ILE A 77 2.585 -13.538 19.307 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.125 -15.166 18.755 1.00 0.00 H new ATOM 0 HD13 ILE A 77 0.894 -14.077 19.438 1.00 0.00 H new ATOM 1190 N GLY A 78 0.167 -17.282 24.215 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.934 -17.979 24.861 1.00 0.00 C ATOM 1192 C GLY A 78 -0.474 -19.308 25.442 1.00 0.00 C ATOM 1193 O GLY A 78 -1.291 -20.167 25.772 1.00 0.00 O ATOM 0 H GLY A 78 0.521 -16.475 24.729 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.348 -17.356 25.654 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.733 -18.151 24.140 1.00 0.00 H new ATOM 1197 N GLY A 79 0.843 -19.472 25.567 1.00 0.00 N ATOM 1198 CA GLY A 79 1.403 -20.706 26.112 1.00 0.00 C ATOM 1199 C GLY A 79 1.630 -21.732 25.009 1.00 0.00 C ATOM 1200 O GLY A 79 2.196 -22.799 25.250 1.00 0.00 O ATOM 0 H GLY A 79 1.536 -18.772 25.301 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.346 -20.491 26.615 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.728 -21.116 26.863 1.00 0.00 H new ATOM 1204 N ARG A 80 1.186 -21.408 23.790 1.00 0.00 N ATOM 1205 CA ARG A 80 1.349 -22.315 22.647 1.00 0.00 C ATOM 1206 C ARG A 80 2.196 -21.660 21.558 1.00 0.00 C ATOM 1207 O ARG A 80 1.986 -20.499 21.207 1.00 0.00 O ATOM 1208 CB ARG A 80 -0.030 -22.689 22.081 1.00 0.00 C ATOM 1209 CG ARG A 80 -0.875 -23.388 23.169 1.00 0.00 C ATOM 1210 CD ARG A 80 -0.562 -24.892 23.192 1.00 0.00 C ATOM 1211 NE ARG A 80 -1.072 -25.529 21.982 1.00 0.00 N ATOM 1212 CZ ARG A 80 -0.792 -26.798 21.703 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -0.049 -27.496 22.518 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -1.260 -27.345 20.615 1.00 0.00 N ATOM 0 H ARG A 80 0.714 -20.531 23.569 1.00 0.00 H new ATOM 0 HA ARG A 80 1.858 -23.217 22.987 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.543 -21.794 21.729 1.00 0.00 H new ATOM 0 HB3 ARG A 80 0.087 -23.348 21.221 1.00 0.00 H new ATOM 0 HG2 ARG A 80 -0.663 -22.949 24.144 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -1.936 -23.232 22.973 1.00 0.00 H new ATOM 0 HD2 ARG A 80 0.514 -25.046 23.267 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -1.012 -25.352 24.072 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.653 -24.991 21.339 1.00 0.00 H new ATOM 0 HH11 ARG A 80 0.316 -27.068 23.368 1.00 0.00 H new ATOM 0 HH12 ARG A 80 0.166 -28.470 22.304 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -1.841 -26.799 19.979 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -1.045 -28.319 20.401 1.00 0.00 H new ATOM 1228 N ALA A 81 3.154 -22.413 21.026 1.00 0.00 N ATOM 1229 CA ALA A 81 4.029 -21.893 19.976 1.00 0.00 C ATOM 1230 C ALA A 81 3.391 -22.073 18.606 1.00 0.00 C ATOM 1231 O ALA A 81 3.213 -23.197 18.144 1.00 0.00 O ATOM 1232 CB ALA A 81 5.376 -22.618 20.018 1.00 0.00 C ATOM 0 H ALA A 81 3.345 -23.377 21.300 1.00 0.00 H new ATOM 0 HA ALA A 81 4.183 -20.828 20.150 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.024 -22.227 19.234 1.00 0.00 H new ATOM 0 HB2 ALA A 81 5.845 -22.459 20.989 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.220 -23.685 19.861 1.00 0.00 H new ATOM 1238 N LEU A 82 3.050 -20.957 17.961 1.00 0.00 N ATOM 1239 CA LEU A 82 2.427 -20.993 16.640 1.00 0.00 C ATOM 1240 C LEU A 82 3.457 -21.400 15.585 1.00 0.00 C ATOM 1241 O LEU A 82 4.653 -21.157 15.746 1.00 0.00 O ATOM 1242 CB LEU A 82 1.816 -19.607 16.286 1.00 0.00 C ATOM 1243 CG LEU A 82 2.616 -18.483 16.969 1.00 0.00 C ATOM 1244 CD1 LEU A 82 4.089 -18.557 16.534 1.00 0.00 C ATOM 1245 CD2 LEU A 82 2.037 -17.122 16.572 1.00 0.00 C ATOM 0 H LEU A 82 3.195 -20.018 18.332 1.00 0.00 H new ATOM 0 HA LEU A 82 1.624 -21.730 16.655 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.823 -19.464 15.206 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.775 -19.568 16.606 1.00 0.00 H new ATOM 0 HG LEU A 82 2.550 -18.604 18.050 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.652 -17.760 17.019 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.505 -19.522 16.822 1.00 0.00 H new ATOM 0 HD13 LEU A 82 4.155 -18.441 15.452 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.606 -16.329 17.057 1.00 0.00 H new ATOM 0 HD22 LEU A 82 2.098 -17.002 15.490 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.995 -17.065 16.885 1.00 0.00 H new ATOM 1257 N LYS A 83 2.987 -22.019 14.501 1.00 0.00 N ATOM 1258 CA LYS A 83 3.882 -22.451 13.422 1.00 0.00 C ATOM 1259 C LYS A 83 3.583 -21.682 12.139 1.00 0.00 C ATOM 1260 O LYS A 83 2.505 -21.825 11.558 1.00 0.00 O ATOM 1261 CB LYS A 83 3.713 -23.956 13.170 1.00 0.00 C ATOM 1262 CG LYS A 83 4.782 -24.449 12.169 1.00 0.00 C ATOM 1263 CD LYS A 83 6.180 -24.428 12.828 1.00 0.00 C ATOM 1264 CE LYS A 83 7.112 -25.413 12.115 1.00 0.00 C ATOM 1265 NZ LYS A 83 7.267 -25.008 10.689 1.00 0.00 N ATOM 0 H LYS A 83 2.002 -22.232 14.346 1.00 0.00 H new ATOM 0 HA LYS A 83 4.909 -22.247 13.724 1.00 0.00 H new ATOM 0 HB2 LYS A 83 3.803 -24.502 14.109 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.716 -24.158 12.778 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.543 -25.460 11.839 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.780 -23.815 11.282 1.00 0.00 H new ATOM 0 HD2 LYS A 83 6.597 -23.422 12.782 1.00 0.00 H new ATOM 0 HD3 LYS A 83 6.098 -24.691 13.883 1.00 0.00 H new ATOM 0 HE2 LYS A 83 8.085 -25.431 12.607 1.00 0.00 H new ATOM 0 HE3 LYS A 83 6.706 -26.423 12.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 8.047 -25.545 10.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 6.385 -25.206 10.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.477 -23.991 10.638 1.00 0.00 H new ATOM 1279 N ILE A 84 4.549 -20.868 11.698 1.00 0.00 N ATOM 1280 CA ILE A 84 4.384 -20.070 10.479 1.00 0.00 C ATOM 1281 C ILE A 84 5.062 -20.772 9.304 1.00 0.00 C ATOM 1282 O ILE A 84 6.256 -21.070 9.350 1.00 0.00 O ATOM 1283 CB ILE A 84 4.997 -18.650 10.664 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.776 -18.157 12.128 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.322 -17.663 9.678 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.309 -17.767 12.344 1.00 0.00 C ATOM 0 H ILE A 84 5.448 -20.745 12.164 1.00 0.00 H new ATOM 0 HA ILE A 84 3.318 -19.967 10.276 1.00 0.00 H new ATOM 0 HB ILE A 84 6.067 -18.695 10.462 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.057 -18.942 12.830 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.420 -17.302 12.332 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.751 -16.669 9.807 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.489 -18.000 8.655 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.251 -17.625 9.877 1.00 0.00 H new ATOM 0 HD11 ILE A 84 3.171 -17.425 13.370 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.040 -16.966 11.655 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.672 -18.632 12.161 1.00 0.00 H new ATOM 1298 N ASP A 85 4.296 -21.029 8.255 1.00 0.00 N ATOM 1299 CA ASP A 85 4.837 -21.693 7.069 1.00 0.00 C ATOM 1300 C ASP A 85 4.022 -21.322 5.838 1.00 0.00 C ATOM 1301 O ASP A 85 2.858 -20.939 5.945 1.00 0.00 O ATOM 1302 CB ASP A 85 4.822 -23.217 7.260 1.00 0.00 C ATOM 1303 CG ASP A 85 5.793 -23.880 6.287 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.872 -23.341 6.100 1.00 0.00 O ATOM 1305 OD2 ASP A 85 5.443 -24.914 5.742 1.00 0.00 O ATOM 0 H ASP A 85 3.306 -20.792 8.196 1.00 0.00 H new ATOM 0 HA ASP A 85 5.866 -21.362 6.927 1.00 0.00 H new ATOM 0 HB2 ASP A 85 5.097 -23.465 8.285 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.815 -23.601 7.098 1.00 0.00 H new ATOM 1310 N HIS A 86 4.642 -21.438 4.672 1.00 0.00 N ATOM 1311 CA HIS A 86 3.962 -21.106 3.429 1.00 0.00 C ATOM 1312 C HIS A 86 2.774 -22.038 3.212 1.00 0.00 C ATOM 1313 O HIS A 86 2.889 -23.255 3.358 1.00 0.00 O ATOM 1314 CB HIS A 86 4.938 -21.231 2.261 1.00 0.00 C ATOM 1315 CG HIS A 86 6.118 -20.326 2.495 1.00 0.00 C ATOM 1316 ND1 HIS A 86 6.181 -19.041 1.982 1.00 0.00 N ATOM 1317 CD2 HIS A 86 7.290 -20.510 3.188 1.00 0.00 C ATOM 1318 CE1 HIS A 86 7.355 -18.506 2.370 1.00 0.00 C ATOM 1319 NE2 HIS A 86 8.069 -19.359 3.107 1.00 0.00 N ATOM 0 H HIS A 86 5.605 -21.756 4.561 1.00 0.00 H new ATOM 0 HA HIS A 86 3.597 -20.081 3.488 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.272 -22.264 2.161 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.441 -20.965 1.328 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.565 -21.411 3.716 1.00 0.00 H new ATOM 0 HE1 HIS A 86 7.679 -17.508 2.115 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.988 -19.202 3.522 1.00 0.00 H new ATOM 1328 N THR A 87 1.628 -21.461 2.861 1.00 0.00 N ATOM 1329 CA THR A 87 0.419 -22.254 2.639 1.00 0.00 C ATOM 1330 C THR A 87 0.325 -22.716 1.189 1.00 0.00 C ATOM 1331 O THR A 87 0.411 -21.908 0.262 1.00 0.00 O ATOM 1332 CB THR A 87 -0.811 -21.417 2.975 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.614 -20.779 4.219 1.00 0.00 O ATOM 1334 CG2 THR A 87 -2.036 -22.319 3.067 1.00 0.00 C ATOM 0 H THR A 87 1.509 -20.457 2.725 1.00 0.00 H new ATOM 0 HA THR A 87 0.465 -23.132 3.284 1.00 0.00 H new ATOM 0 HB THR A 87 -0.965 -20.672 2.195 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.208 -21.178 4.889 1.00 0.00 H new ATOM 0 HG21 THR A 87 -2.913 -21.718 3.307 1.00 0.00 H new ATOM 0 HG22 THR A 87 -2.191 -22.821 2.112 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.882 -23.064 3.848 1.00 0.00 H new ATOM 1342 N PHE A 88 0.148 -24.021 0.994 1.00 0.00 N ATOM 1343 CA PHE A 88 0.037 -24.583 -0.355 1.00 0.00 C ATOM 1344 C PHE A 88 -1.424 -24.879 -0.688 1.00 0.00 C ATOM 1345 O PHE A 88 -1.763 -25.168 -1.835 1.00 0.00 O ATOM 1346 CB PHE A 88 0.860 -25.868 -0.456 1.00 0.00 C ATOM 1347 CG PHE A 88 0.468 -26.808 0.658 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.114 -26.728 1.898 1.00 0.00 C ATOM 1349 CD2 PHE A 88 -0.540 -27.757 0.454 1.00 0.00 C ATOM 1350 CE1 PHE A 88 0.751 -27.599 2.933 1.00 0.00 C ATOM 1351 CE2 PHE A 88 -0.902 -28.628 1.489 1.00 0.00 C ATOM 1352 CZ PHE A 88 -0.256 -28.549 2.728 1.00 0.00 C ATOM 0 H PHE A 88 0.078 -24.707 1.746 1.00 0.00 H new ATOM 0 HA PHE A 88 0.421 -23.854 -1.068 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.694 -26.344 -1.423 1.00 0.00 H new ATOM 0 HB3 PHE A 88 1.923 -25.637 -0.393 1.00 0.00 H new ATOM 0 HD1 PHE A 88 1.891 -25.995 2.056 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -1.039 -27.818 -0.502 1.00 0.00 H new ATOM 0 HE1 PHE A 88 1.248 -27.537 3.890 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -1.680 -29.361 1.331 1.00 0.00 H new ATOM 0 HZ PHE A 88 -0.535 -29.221 3.526 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.285 -24.805 0.324 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.708 -25.063 0.130 1.00 0.00 C ATOM 1364 C TYR A 89 -4.382 -23.877 -0.561 1.00 0.00 C ATOM 1365 O TYR A 89 -4.142 -22.723 -0.204 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.388 -25.327 1.482 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.889 -25.381 1.298 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -6.488 -26.520 0.745 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.680 -24.288 1.677 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -7.878 -26.565 0.572 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -8.069 -24.333 1.503 1.00 0.00 C ATOM 1372 CZ TYR A 89 -8.667 -25.472 0.951 1.00 0.00 C ATOM 1373 OH TYR A 89 -10.036 -25.518 0.779 1.00 0.00 O ATOM 0 H TYR A 89 -2.023 -24.570 1.281 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.812 -25.944 -0.503 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -4.030 -26.267 1.902 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -4.127 -24.541 2.190 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.879 -27.363 0.452 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -6.218 -23.410 2.104 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -8.341 -27.443 0.146 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.678 -23.490 1.794 1.00 0.00 H new ATOM 0 HH TYR A 89 -10.434 -24.680 1.094 1.00 0.00 H new ATOM 2031 N PHE B 311 12.976 -4.570 6.224 1.00 0.00 N ATOM 2032 CA PHE B 311 11.819 -4.172 5.422 1.00 0.00 C ATOM 2033 C PHE B 311 11.362 -2.771 5.805 1.00 0.00 C ATOM 2034 O PHE B 311 11.499 -2.356 6.955 1.00 0.00 O ATOM 2035 CB PHE B 311 10.679 -5.158 5.618 1.00 0.00 C ATOM 2036 CG PHE B 311 11.044 -6.487 4.994 1.00 0.00 C ATOM 2037 CD1 PHE B 311 10.775 -6.721 3.641 1.00 0.00 C ATOM 2038 CD2 PHE B 311 11.647 -7.481 5.772 1.00 0.00 C ATOM 2039 CE1 PHE B 311 11.112 -7.950 3.064 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.982 -8.711 5.194 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.714 -8.945 3.842 1.00 0.00 C ATOM 0 HA PHE B 311 12.112 -4.171 4.372 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.476 -5.288 6.681 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.767 -4.770 5.164 1.00 0.00 H new ATOM 0 HD1 PHE B 311 10.307 -5.953 3.042 1.00 0.00 H new ATOM 0 HD2 PHE B 311 11.854 -7.300 6.816 1.00 0.00 H new ATOM 0 HE1 PHE B 311 10.908 -8.131 2.019 1.00 0.00 H new ATOM 0 HE2 PHE B 311 12.448 -9.480 5.793 1.00 0.00 H new ATOM 0 HZ PHE B 311 11.972 -9.895 3.398 1.00 0.00 H new ATOM 2051 N ALA B 312 10.817 -2.044 4.837 1.00 0.00 N ATOM 2052 CA ALA B 312 10.340 -0.682 5.084 1.00 0.00 C ATOM 2053 C ALA B 312 8.814 -0.645 5.168 1.00 0.00 C ATOM 2054 O ALA B 312 8.176 0.228 4.580 1.00 0.00 O ATOM 2055 CB ALA B 312 10.819 0.243 3.964 1.00 0.00 C ATOM 0 H ALA B 312 10.693 -2.369 3.878 1.00 0.00 H new ATOM 0 HA ALA B 312 10.745 -0.342 6.037 1.00 0.00 H new ATOM 0 HB1 ALA B 312 10.462 1.256 4.151 1.00 0.00 H new ATOM 0 HB2 ALA B 312 11.909 0.242 3.932 1.00 0.00 H new ATOM 0 HB3 ALA B 312 10.428 -0.109 3.009 1.00 0.00 H new ATOM 2061 N ILE B 313 8.231 -1.600 5.902 1.00 0.00 N ATOM 2062 CA ILE B 313 6.771 -1.661 6.056 1.00 0.00 C ATOM 2063 C ILE B 313 6.348 -1.061 7.395 1.00 0.00 C ATOM 2064 O ILE B 313 6.755 -1.533 8.457 1.00 0.00 O ATOM 2065 CB ILE B 313 6.297 -3.113 5.972 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.597 -3.679 4.572 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.786 -3.177 6.233 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.394 -5.205 4.565 1.00 0.00 C ATOM 0 H ILE B 313 8.740 -2.334 6.394 1.00 0.00 H new ATOM 0 HA ILE B 313 6.315 -1.084 5.252 1.00 0.00 H new ATOM 0 HB ILE B 313 6.823 -3.704 6.722 1.00 0.00 H new ATOM 0 HG12 ILE B 313 5.943 -3.214 3.835 1.00 0.00 H new ATOM 0 HG13 ILE B 313 7.621 -3.439 4.286 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.450 -4.212 6.173 1.00 0.00 H new ATOM 0 HG22 ILE B 313 4.571 -2.783 7.226 1.00 0.00 H new ATOM 0 HG23 ILE B 313 4.262 -2.581 5.485 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.609 -5.596 3.570 1.00 0.00 H new ATOM 0 HD12 ILE B 313 7.067 -5.665 5.289 1.00 0.00 H new ATOM 0 HD13 ILE B 313 5.362 -5.436 4.831 1.00 0.00 H new ATOM 2080 N MET B 314 5.525 -0.015 7.341 1.00 0.00 N ATOM 2081 CA MET B 314 5.047 0.648 8.559 1.00 0.00 C ATOM 2082 C MET B 314 3.723 0.029 9.048 1.00 0.00 C ATOM 2083 O MET B 314 2.943 -0.489 8.249 1.00 0.00 O ATOM 2084 CB MET B 314 4.853 2.151 8.291 1.00 0.00 C ATOM 2085 CG MET B 314 6.187 2.887 8.465 1.00 0.00 C ATOM 2086 SD MET B 314 7.436 2.145 7.384 1.00 0.00 S ATOM 2087 CE MET B 314 6.631 2.523 5.810 1.00 0.00 C ATOM 0 H MET B 314 5.175 0.392 6.473 1.00 0.00 H new ATOM 0 HA MET B 314 5.795 0.508 9.339 1.00 0.00 H new ATOM 0 HB2 MET B 314 4.472 2.303 7.281 1.00 0.00 H new ATOM 0 HB3 MET B 314 4.110 2.559 8.977 1.00 0.00 H new ATOM 0 HG2 MET B 314 6.065 3.943 8.225 1.00 0.00 H new ATOM 0 HG3 MET B 314 6.512 2.832 9.504 1.00 0.00 H new ATOM 0 HE1 MET B 314 7.368 2.914 5.109 1.00 0.00 H new ATOM 0 HE2 MET B 314 6.187 1.615 5.401 1.00 0.00 H new ATOM 0 HE3 MET B 314 5.851 3.268 5.970 1.00 0.00 H new ATOM 2097 N PRO B 315 3.461 0.083 10.342 1.00 0.00 N ATOM 2098 CA PRO B 315 2.207 -0.475 10.944 1.00 0.00 C ATOM 2099 C PRO B 315 0.967 0.338 10.563 1.00 0.00 C ATOM 2100 O PRO B 315 1.055 1.544 10.329 1.00 0.00 O ATOM 2101 CB PRO B 315 2.464 -0.400 12.457 1.00 0.00 C ATOM 2102 CG PRO B 315 3.471 0.694 12.632 1.00 0.00 C ATOM 2103 CD PRO B 315 4.335 0.678 11.369 1.00 0.00 C ATOM 0 HA PRO B 315 2.001 -1.485 10.590 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.546 -0.180 13.002 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.842 -1.348 12.839 1.00 0.00 H new ATOM 0 HG2 PRO B 315 2.981 1.659 12.757 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.078 0.527 13.522 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.651 1.683 11.090 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.240 0.088 11.513 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.188 -0.329 10.504 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.444 0.344 10.155 1.00 0.00 C ATOM 2113 C GLY B 316 -2.298 0.584 11.401 1.00 0.00 C ATOM 2114 O GLY B 316 -1.932 0.180 12.504 1.00 0.00 O ATOM 0 H GLY B 316 -0.281 -1.327 10.692 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.229 1.295 9.668 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -2.000 -0.262 9.439 1.00 0.00 H new ATOM 2118 N SER B 317 -3.436 1.247 11.217 1.00 0.00 N ATOM 2119 CA SER B 317 -4.333 1.536 12.336 1.00 0.00 C ATOM 2120 C SER B 317 -4.935 0.247 12.898 1.00 0.00 C ATOM 2121 O SER B 317 -5.273 0.168 14.079 1.00 0.00 O ATOM 2122 CB SER B 317 -5.459 2.459 11.872 1.00 0.00 C ATOM 2123 OG SER B 317 -6.279 1.770 10.938 1.00 0.00 O ATOM 0 H SER B 317 -3.759 1.592 10.313 1.00 0.00 H new ATOM 0 HA SER B 317 -3.754 2.024 13.120 1.00 0.00 H new ATOM 0 HB2 SER B 317 -6.054 2.783 12.726 1.00 0.00 H new ATOM 0 HB3 SER B 317 -5.043 3.357 11.415 1.00 0.00 H new ATOM 0 HG SER B 317 -7.003 2.360 10.641 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.065 -0.761 12.046 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.629 -2.042 12.465 1.00 0.00 C ATOM 2131 C ARG B 318 -4.760 -2.690 13.544 1.00 0.00 C ATOM 2132 O ARG B 318 -5.211 -3.575 14.270 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.751 -2.979 11.258 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.796 -4.064 11.550 1.00 0.00 C ATOM 2135 CD ARG B 318 -7.001 -4.927 10.308 1.00 0.00 C ATOM 2136 NE ARG B 318 -8.265 -5.650 10.394 1.00 0.00 N ATOM 2137 CZ ARG B 318 -8.765 -6.289 9.342 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -8.122 -6.279 8.206 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -9.901 -6.926 9.443 1.00 0.00 N ATOM 0 H ARG B 318 -4.790 -0.720 11.065 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.620 -1.863 12.883 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.039 -2.412 10.373 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.786 -3.438 11.043 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.468 -4.683 12.385 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -7.739 -3.604 11.845 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -6.993 -4.300 9.416 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -6.177 -5.633 10.208 1.00 0.00 H new ATOM 0 HE ARG B 318 -8.774 -5.665 11.278 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -7.236 -5.781 8.126 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -8.506 -6.770 7.398 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -10.405 -6.933 10.330 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.284 -7.416 8.635 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.512 -2.245 13.641 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.586 -2.789 14.631 1.00 0.00 C ATOM 2155 C TRP B 319 -3.110 -2.576 16.055 1.00 0.00 C ATOM 2156 O TRP B 319 -2.643 -3.200 17.004 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.208 -2.127 14.482 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.296 -2.607 15.570 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.292 -3.855 16.089 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.736 -1.864 16.284 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.673 -3.931 17.072 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.333 -2.730 17.230 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.205 -0.540 16.204 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.361 -2.296 18.064 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.241 -0.102 17.045 1.00 0.00 C ATOM 2166 CH2 TRP B 319 2.817 -0.978 17.974 1.00 0.00 C ATOM 0 H TRP B 319 -3.118 -1.513 13.050 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.496 -3.861 14.455 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.783 -2.365 13.507 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.308 -1.043 14.530 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.940 -4.663 15.783 1.00 0.00 H new ATOM 0 HE1 TRP B 319 0.874 -4.771 17.615 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.766 0.143 15.492 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 2.804 -2.975 18.777 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 2.596 0.916 16.975 1.00 0.00 H new ATOM 0 HH2 TRP B 319 3.612 -0.635 18.620 1.00 0.00 H new ATOM 2177 N ASP B 320 -4.071 -1.684 16.199 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.657 -1.387 17.512 1.00 0.00 C ATOM 2179 C ASP B 320 -3.617 -0.770 18.457 1.00 0.00 C ATOM 2180 O ASP B 320 -3.949 0.054 19.310 1.00 0.00 O ATOM 2181 CB ASP B 320 -5.211 -2.672 18.132 1.00 0.00 C ATOM 2182 CG ASP B 320 -6.182 -2.335 19.260 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -6.368 -1.157 19.521 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.724 -3.259 19.845 1.00 0.00 O ATOM 0 H ASP B 320 -4.469 -1.147 15.429 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.462 -0.666 17.369 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.718 -3.263 17.370 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.393 -3.282 18.516 1.00 0.00 H new ATOM 2189 N GLY B 321 -2.354 -1.166 18.300 1.00 0.00 N ATOM 2190 CA GLY B 321 -1.274 -0.649 19.144 1.00 0.00 C ATOM 2191 C GLY B 321 -0.803 -1.707 20.145 1.00 0.00 C ATOM 2192 O GLY B 321 -0.042 -1.406 21.065 1.00 0.00 O ATOM 0 H GLY B 321 -2.053 -1.842 17.598 1.00 0.00 H new ATOM 0 HA2 GLY B 321 -0.437 -0.337 18.519 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -1.619 0.235 19.680 1.00 0.00 H new ATOM 2196 N VAL B 322 -1.259 -2.945 19.959 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.872 -4.042 20.850 1.00 0.00 C ATOM 2198 C VAL B 322 0.620 -4.330 20.706 1.00 0.00 C ATOM 2199 O VAL B 322 1.141 -4.395 19.596 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.681 -5.302 20.525 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -1.101 -6.506 21.280 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -3.136 -5.098 20.953 1.00 0.00 C ATOM 0 H VAL B 322 -1.892 -3.214 19.206 1.00 0.00 H new ATOM 0 HA VAL B 322 -1.080 -3.747 21.878 1.00 0.00 H new ATOM 0 HB VAL B 322 -1.632 -5.489 19.452 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.682 -7.398 21.044 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.064 -6.658 20.980 1.00 0.00 H new ATOM 0 HG13 VAL B 322 -1.145 -6.318 22.353 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -3.712 -5.994 20.722 1.00 0.00 H new ATOM 0 HG22 VAL B 322 -3.176 -4.907 22.025 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -3.557 -4.248 20.417 1.00 0.00 H new ATOM 2212 N HIS B 323 1.297 -4.501 21.836 1.00 0.00 N ATOM 2213 CA HIS B 323 2.729 -4.775 21.822 1.00 0.00 C ATOM 2214 C HIS B 323 3.016 -6.174 21.281 1.00 0.00 C ATOM 2215 O HIS B 323 2.264 -7.115 21.532 1.00 0.00 O ATOM 2216 CB HIS B 323 3.295 -4.654 23.239 1.00 0.00 C ATOM 2217 CG HIS B 323 3.036 -3.271 23.767 1.00 0.00 C ATOM 2218 ND1 HIS B 323 2.054 -3.014 24.712 1.00 0.00 N ATOM 2219 CD2 HIS B 323 3.620 -2.059 23.494 1.00 0.00 C ATOM 2220 CE1 HIS B 323 2.076 -1.694 24.971 1.00 0.00 C ATOM 2221 NE2 HIS B 323 3.011 -1.064 24.255 1.00 0.00 N ATOM 0 H HIS B 323 0.881 -4.455 22.766 1.00 0.00 H new ATOM 0 HA HIS B 323 3.206 -4.045 21.168 1.00 0.00 H new ATOM 0 HB2 HIS B 323 2.833 -5.396 23.891 1.00 0.00 H new ATOM 0 HB3 HIS B 323 4.366 -4.858 23.233 1.00 0.00 H new ATOM 0 HD2 HIS B 323 4.428 -1.901 22.796 1.00 0.00 H new ATOM 0 HE1 HIS B 323 1.418 -1.203 25.673 1.00 0.00 H new ATOM 0 HE2 HIS B 323 3.232 -0.068 24.264 1.00 0.00 H new ATOM 2230 N ARG B 324 4.109 -6.307 20.531 1.00 0.00 N ATOM 2231 CA ARG B 324 4.490 -7.600 19.955 1.00 0.00 C ATOM 2232 C ARG B 324 6.001 -7.802 20.065 1.00 0.00 C ATOM 2233 O ARG B 324 6.762 -6.835 20.085 1.00 0.00 O ATOM 2234 CB ARG B 324 4.052 -7.670 18.476 1.00 0.00 C ATOM 2235 CG ARG B 324 4.795 -6.588 17.646 1.00 0.00 C ATOM 2236 CD ARG B 324 4.277 -5.173 18.013 1.00 0.00 C ATOM 2237 NE ARG B 324 5.230 -4.498 18.886 1.00 0.00 N ATOM 2238 CZ ARG B 324 6.392 -4.051 18.422 1.00 0.00 C ATOM 2239 NH1 ARG B 324 6.699 -4.214 17.163 1.00 0.00 N ATOM 2240 NH2 ARG B 324 7.228 -3.451 19.225 1.00 0.00 N ATOM 0 H ARG B 324 4.745 -5.541 20.308 1.00 0.00 H new ATOM 0 HA ARG B 324 3.989 -8.393 20.510 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.266 -8.659 18.072 1.00 0.00 H new ATOM 0 HB3 ARG B 324 2.975 -7.521 18.400 1.00 0.00 H new ATOM 0 HG2 ARG B 324 5.867 -6.649 17.834 1.00 0.00 H new ATOM 0 HG3 ARG B 324 4.647 -6.772 16.582 1.00 0.00 H new ATOM 0 HD2 ARG B 324 4.125 -4.587 17.107 1.00 0.00 H new ATOM 0 HD3 ARG B 324 3.309 -5.249 18.509 1.00 0.00 H new ATOM 0 HE ARG B 324 5.000 -4.367 19.871 1.00 0.00 H new ATOM 0 HH11 ARG B 324 6.047 -4.685 16.536 1.00 0.00 H new ATOM 0 HH12 ARG B 324 7.591 -3.871 16.807 1.00 0.00 H new ATOM 0 HH21 ARG B 324 6.989 -3.325 20.209 1.00 0.00 H new ATOM 0 HH22 ARG B 324 8.120 -3.108 18.869 1.00 0.00 H new ATOM 2254 N SER B 325 6.432 -9.060 20.129 1.00 0.00 N ATOM 2255 CA SER B 325 7.861 -9.374 20.225 1.00 0.00 C ATOM 2256 C SER B 325 8.247 -10.419 19.186 1.00 0.00 C ATOM 2257 O SER B 325 7.445 -11.284 18.835 1.00 0.00 O ATOM 2258 CB SER B 325 8.188 -9.897 21.623 1.00 0.00 C ATOM 2259 OG SER B 325 7.895 -8.891 22.583 1.00 0.00 O ATOM 0 H SER B 325 5.819 -9.875 20.116 1.00 0.00 H new ATOM 0 HA SER B 325 8.429 -8.463 20.038 1.00 0.00 H new ATOM 0 HB2 SER B 325 7.607 -10.795 21.832 1.00 0.00 H new ATOM 0 HB3 SER B 325 9.240 -10.176 21.682 1.00 0.00 H new ATOM 0 HG SER B 325 8.102 -9.225 23.481 1.00 0.00 H new ATOM 2286 N PHE B 328 15.197 -11.055 20.516 1.00 0.00 N ATOM 2287 CA PHE B 328 15.889 -10.209 21.481 1.00 0.00 C ATOM 2288 C PHE B 328 16.662 -9.102 20.771 1.00 0.00 C ATOM 2289 O PHE B 328 16.891 -8.043 21.331 1.00 0.00 O ATOM 2290 CB PHE B 328 16.848 -11.058 22.326 1.00 0.00 C ATOM 2291 CG PHE B 328 17.987 -11.545 21.464 1.00 0.00 C ATOM 2292 CD1 PHE B 328 17.859 -12.739 20.743 1.00 0.00 C ATOM 2293 CD2 PHE B 328 19.169 -10.801 21.377 1.00 0.00 C ATOM 2294 CE1 PHE B 328 18.914 -13.191 19.941 1.00 0.00 C ATOM 2295 CE2 PHE B 328 20.224 -11.252 20.574 1.00 0.00 C ATOM 2296 CZ PHE B 328 20.096 -12.446 19.856 1.00 0.00 C ATOM 0 HA PHE B 328 15.147 -9.748 22.133 1.00 0.00 H new ATOM 0 HB2 PHE B 328 17.234 -10.469 23.158 1.00 0.00 H new ATOM 0 HB3 PHE B 328 16.316 -11.906 22.756 1.00 0.00 H new ATOM 0 HD1 PHE B 328 16.945 -13.312 20.806 1.00 0.00 H new ATOM 0 HD2 PHE B 328 19.268 -9.878 21.930 1.00 0.00 H new ATOM 0 HE1 PHE B 328 18.816 -14.114 19.388 1.00 0.00 H new ATOM 0 HE2 PHE B 328 21.137 -10.678 20.509 1.00 0.00 H new ATOM 0 HZ PHE B 328 20.909 -12.793 19.236 1.00 0.00 H new ATOM 2306 N GLU B 329 17.052 -9.356 19.528 1.00 0.00 N ATOM 2307 CA GLU B 329 17.808 -8.375 18.745 1.00 0.00 C ATOM 2308 C GLU B 329 17.016 -7.076 18.604 1.00 0.00 C ATOM 2309 O GLU B 329 17.577 -6.016 18.322 1.00 0.00 O ATOM 2310 CB GLU B 329 18.120 -8.946 17.349 1.00 0.00 C ATOM 2311 CG GLU B 329 19.070 -10.162 17.470 1.00 0.00 C ATOM 2312 CD GLU B 329 18.260 -11.450 17.624 1.00 0.00 C ATOM 2313 OE1 GLU B 329 17.091 -11.353 17.956 1.00 0.00 O ATOM 2314 OE2 GLU B 329 18.822 -12.511 17.410 1.00 0.00 O ATOM 0 H GLU B 329 16.860 -10.230 19.038 1.00 0.00 H new ATOM 0 HA GLU B 329 18.741 -8.162 19.266 1.00 0.00 H new ATOM 0 HB2 GLU B 329 17.195 -9.245 16.855 1.00 0.00 H new ATOM 0 HB3 GLU B 329 18.579 -8.177 16.728 1.00 0.00 H new ATOM 0 HG2 GLU B 329 19.705 -10.226 16.586 1.00 0.00 H new ATOM 0 HG3 GLU B 329 19.730 -10.034 18.328 1.00 0.00 H new ATOM 2321 N GLU B 330 15.712 -7.166 18.799 1.00 0.00 N ATOM 2322 CA GLU B 330 14.851 -5.996 18.685 1.00 0.00 C ATOM 2323 C GLU B 330 15.384 -4.824 19.533 1.00 0.00 C ATOM 2324 O GLU B 330 15.062 -3.665 19.276 1.00 0.00 O ATOM 2325 CB GLU B 330 13.425 -6.350 19.140 1.00 0.00 C ATOM 2326 CG GLU B 330 12.463 -5.210 18.778 1.00 0.00 C ATOM 2327 CD GLU B 330 12.355 -5.078 17.261 1.00 0.00 C ATOM 2328 OE1 GLU B 330 12.698 -6.030 16.579 1.00 0.00 O ATOM 2329 OE2 GLU B 330 11.933 -4.029 16.805 1.00 0.00 O ATOM 0 H GLU B 330 15.226 -8.031 19.036 1.00 0.00 H new ATOM 0 HA GLU B 330 14.840 -5.687 17.640 1.00 0.00 H new ATOM 0 HB2 GLU B 330 13.101 -7.276 18.664 1.00 0.00 H new ATOM 0 HB3 GLU B 330 13.410 -6.523 20.216 1.00 0.00 H new ATOM 0 HG2 GLU B 330 11.479 -5.404 19.205 1.00 0.00 H new ATOM 0 HG3 GLU B 330 12.818 -4.273 19.208 1.00 0.00 H new ATOM 2336 N LYS B 331 16.199 -5.134 20.543 1.00 0.00 N ATOM 2337 CA LYS B 331 16.765 -4.101 21.426 1.00 0.00 C ATOM 2338 C LYS B 331 17.450 -2.977 20.618 1.00 0.00 C ATOM 2339 O LYS B 331 17.047 -1.816 20.690 1.00 0.00 O ATOM 2340 CB LYS B 331 17.798 -4.733 22.405 1.00 0.00 C ATOM 2341 CG LYS B 331 18.704 -5.765 21.656 1.00 0.00 C ATOM 2342 CD LYS B 331 20.196 -5.388 21.802 1.00 0.00 C ATOM 2343 CE LYS B 331 20.660 -5.635 23.248 1.00 0.00 C ATOM 2344 NZ LYS B 331 22.149 -5.718 23.288 1.00 0.00 N ATOM 0 H LYS B 331 16.484 -6.086 20.773 1.00 0.00 H new ATOM 0 HA LYS B 331 15.940 -3.667 21.991 1.00 0.00 H new ATOM 0 HB2 LYS B 331 18.416 -3.951 22.846 1.00 0.00 H new ATOM 0 HB3 LYS B 331 17.276 -5.226 23.225 1.00 0.00 H new ATOM 0 HG2 LYS B 331 18.535 -6.764 22.058 1.00 0.00 H new ATOM 0 HG3 LYS B 331 18.433 -5.796 20.601 1.00 0.00 H new ATOM 0 HD2 LYS B 331 20.798 -5.979 21.112 1.00 0.00 H new ATOM 0 HD3 LYS B 331 20.343 -4.341 21.538 1.00 0.00 H new ATOM 0 HE2 LYS B 331 20.313 -4.829 23.895 1.00 0.00 H new ATOM 0 HE3 LYS B 331 20.224 -6.559 23.628 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 22.461 -5.885 24.266 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 22.469 -6.501 22.684 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 22.556 -4.825 22.942 1.00 0.00 H new ATOM 2358 N TRP B 332 18.489 -3.332 19.855 1.00 0.00 N ATOM 2359 CA TRP B 332 19.226 -2.348 19.048 1.00 0.00 C ATOM 2360 C TRP B 332 18.481 -2.031 17.752 1.00 0.00 C ATOM 2361 O TRP B 332 18.675 -0.975 17.146 1.00 0.00 O ATOM 2362 CB TRP B 332 20.634 -2.890 18.721 1.00 0.00 C ATOM 2363 CG TRP B 332 20.544 -3.984 17.688 1.00 0.00 C ATOM 2364 CD1 TRP B 332 20.222 -5.271 17.944 1.00 0.00 C ATOM 2365 CD2 TRP B 332 20.777 -3.903 16.247 1.00 0.00 C ATOM 2366 NE1 TRP B 332 20.236 -5.984 16.758 1.00 0.00 N ATOM 2367 CE2 TRP B 332 20.575 -5.187 15.684 1.00 0.00 C ATOM 2368 CE3 TRP B 332 21.140 -2.854 15.384 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 20.716 -5.414 14.317 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 21.291 -3.081 14.007 1.00 0.00 C ATOM 2371 CH2 TRP B 332 21.081 -4.359 13.474 1.00 0.00 C ATOM 0 H TRP B 332 18.839 -4.287 19.778 1.00 0.00 H new ATOM 0 HA TRP B 332 19.313 -1.428 19.626 1.00 0.00 H new ATOM 0 HB2 TRP B 332 21.266 -2.082 18.352 1.00 0.00 H new ATOM 0 HB3 TRP B 332 21.104 -3.273 19.627 1.00 0.00 H new ATOM 0 HD1 TRP B 332 19.991 -5.678 18.917 1.00 0.00 H new ATOM 0 HE1 TRP B 332 20.022 -6.979 16.686 1.00 0.00 H new ATOM 0 HE3 TRP B 332 21.304 -1.864 15.784 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 20.544 -6.400 13.910 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 21.570 -2.266 13.355 1.00 0.00 H new ATOM 0 HH2 TRP B 332 21.201 -4.530 12.414 1.00 0.00 H new ATOM 2382 N PHE B 333 17.637 -2.960 17.333 1.00 0.00 N ATOM 2383 CA PHE B 333 16.880 -2.779 16.103 1.00 0.00 C ATOM 2384 C PHE B 333 15.748 -1.775 16.314 1.00 0.00 C ATOM 2385 O PHE B 333 15.341 -1.079 15.385 1.00 0.00 O ATOM 2386 CB PHE B 333 16.306 -4.140 15.634 1.00 0.00 C ATOM 2387 CG PHE B 333 16.388 -4.246 14.122 1.00 0.00 C ATOM 2388 CD1 PHE B 333 17.634 -4.181 13.490 1.00 0.00 C ATOM 2389 CD2 PHE B 333 15.221 -4.408 13.362 1.00 0.00 C ATOM 2390 CE1 PHE B 333 17.721 -4.270 12.101 1.00 0.00 C ATOM 2391 CE2 PHE B 333 15.307 -4.500 11.968 1.00 0.00 C ATOM 2392 CZ PHE B 333 16.556 -4.432 11.339 1.00 0.00 C ATOM 0 H PHE B 333 17.459 -3.839 17.820 1.00 0.00 H new ATOM 0 HA PHE B 333 17.548 -2.389 15.335 1.00 0.00 H new ATOM 0 HB2 PHE B 333 16.862 -4.956 16.095 1.00 0.00 H new ATOM 0 HB3 PHE B 333 15.270 -4.238 15.958 1.00 0.00 H new ATOM 0 HD1 PHE B 333 18.531 -4.062 14.079 1.00 0.00 H new ATOM 0 HD2 PHE B 333 14.259 -4.462 13.850 1.00 0.00 H new ATOM 0 HE1 PHE B 333 18.683 -4.214 11.614 1.00 0.00 H new ATOM 0 HE2 PHE B 333 14.411 -4.623 11.378 1.00 0.00 H new ATOM 0 HZ PHE B 333 16.622 -4.505 10.263 1.00 0.00 H new ATOM 2402 N ALA B 334 15.238 -1.715 17.542 1.00 0.00 N ATOM 2403 CA ALA B 334 14.149 -0.802 17.857 1.00 0.00 C ATOM 2404 C ALA B 334 14.577 0.639 17.618 1.00 0.00 C ATOM 2405 O ALA B 334 13.840 1.423 17.020 1.00 0.00 O ATOM 2406 CB ALA B 334 13.734 -0.971 19.319 1.00 0.00 C ATOM 0 H ALA B 334 15.559 -2.283 18.326 1.00 0.00 H new ATOM 0 HA ALA B 334 13.305 -1.035 17.208 1.00 0.00 H new ATOM 0 HB1 ALA B 334 12.919 -0.285 19.547 1.00 0.00 H new ATOM 0 HB2 ALA B 334 13.403 -1.996 19.487 1.00 0.00 H new ATOM 0 HB3 ALA B 334 14.584 -0.753 19.966 1.00 0.00 H new ATOM 2412 N LYS B 335 15.774 0.982 18.087 1.00 0.00 N ATOM 2413 CA LYS B 335 16.289 2.332 17.912 1.00 0.00 C ATOM 2414 C LYS B 335 16.577 2.597 16.439 1.00 0.00 C ATOM 2415 O LYS B 335 16.228 3.651 15.910 1.00 0.00 O ATOM 2416 CB LYS B 335 17.573 2.533 18.740 1.00 0.00 C ATOM 2417 CG LYS B 335 18.100 3.980 18.585 1.00 0.00 C ATOM 2418 CD LYS B 335 17.086 4.974 19.172 1.00 0.00 C ATOM 2419 CE LYS B 335 17.753 6.332 19.395 1.00 0.00 C ATOM 2420 NZ LYS B 335 16.754 7.295 19.937 1.00 0.00 N ATOM 0 H LYS B 335 16.399 0.349 18.586 1.00 0.00 H new ATOM 0 HA LYS B 335 15.534 3.036 18.261 1.00 0.00 H new ATOM 0 HB2 LYS B 335 17.371 2.324 19.791 1.00 0.00 H new ATOM 0 HB3 LYS B 335 18.336 1.826 18.415 1.00 0.00 H new ATOM 0 HG2 LYS B 335 19.059 4.083 19.093 1.00 0.00 H new ATOM 0 HG3 LYS B 335 18.272 4.202 17.532 1.00 0.00 H new ATOM 0 HD2 LYS B 335 16.238 5.083 18.496 1.00 0.00 H new ATOM 0 HD3 LYS B 335 16.695 4.593 20.115 1.00 0.00 H new ATOM 0 HE2 LYS B 335 18.588 6.229 20.088 1.00 0.00 H new ATOM 0 HE3 LYS B 335 18.162 6.706 18.457 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 17.208 8.218 20.088 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 15.971 7.401 19.260 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 16.384 6.939 20.841 1.00 0.00 H new ATOM 2434 N GLN B 336 17.219 1.629 15.783 1.00 0.00 N ATOM 2435 CA GLN B 336 17.553 1.770 14.368 1.00 0.00 C ATOM 2436 C GLN B 336 16.287 1.781 13.522 1.00 0.00 C ATOM 2437 O GLN B 336 16.298 2.235 12.378 1.00 0.00 O ATOM 2438 CB GLN B 336 18.463 0.617 13.927 1.00 0.00 C ATOM 2439 CG GLN B 336 19.847 0.774 14.564 1.00 0.00 C ATOM 2440 CD GLN B 336 20.545 2.010 14.003 1.00 0.00 C ATOM 2441 OE1 GLN B 336 20.402 2.318 12.819 1.00 0.00 O ATOM 2442 NE2 GLN B 336 21.295 2.738 14.783 1.00 0.00 N ATOM 0 H GLN B 336 17.515 0.749 16.205 1.00 0.00 H new ATOM 0 HA GLN B 336 18.077 2.715 14.227 1.00 0.00 H new ATOM 0 HB2 GLN B 336 18.024 -0.337 14.220 1.00 0.00 H new ATOM 0 HB3 GLN B 336 18.552 0.607 12.841 1.00 0.00 H new ATOM 0 HG2 GLN B 336 19.750 0.861 15.646 1.00 0.00 H new ATOM 0 HG3 GLN B 336 20.449 -0.113 14.368 1.00 0.00 H new ATOM 0 HE21 GLN B 336 21.412 2.481 15.763 1.00 0.00 H new ATOM 0 HE22 GLN B 336 21.765 3.564 14.413 1.00 0.00 H new ATOM 2451 N ASN B 337 15.198 1.268 14.086 1.00 0.00 N ATOM 2452 CA ASN B 337 13.928 1.232 13.373 1.00 0.00 C ATOM 2453 C ASN B 337 13.195 2.566 13.506 1.00 0.00 C ATOM 2454 O ASN B 337 12.640 3.079 12.535 1.00 0.00 O ATOM 2455 CB ASN B 337 13.049 0.112 13.934 1.00 0.00 C ATOM 2456 CG ASN B 337 11.724 0.064 13.180 1.00 0.00 C ATOM 2457 OD1 ASN B 337 10.834 0.875 13.435 1.00 0.00 O ATOM 2458 ND2 ASN B 337 11.537 -0.846 12.263 1.00 0.00 N ATOM 0 H ASN B 337 15.170 0.875 15.027 1.00 0.00 H new ATOM 0 HA ASN B 337 14.132 1.046 12.318 1.00 0.00 H new ATOM 0 HB2 ASN B 337 13.563 -0.845 13.844 1.00 0.00 H new ATOM 0 HB3 ASN B 337 12.867 0.278 14.996 1.00 0.00 H new ATOM 0 HD21 ASN B 337 10.652 -0.886 11.757 1.00 0.00 H new ATOM 0 HD22 ASN B 337 12.275 -1.517 12.053 1.00 0.00 H new ATOM 2465 N GLU B 338 13.196 3.119 14.717 1.00 0.00 N ATOM 2466 CA GLU B 338 12.526 4.392 14.968 1.00 0.00 C ATOM 2467 C GLU B 338 13.370 5.568 14.480 1.00 0.00 C ATOM 2468 O GLU B 338 12.872 6.466 13.800 1.00 0.00 O ATOM 2469 CB GLU B 338 12.251 4.549 16.465 1.00 0.00 C ATOM 2470 CG GLU B 338 11.430 5.818 16.704 1.00 0.00 C ATOM 2471 CD GLU B 338 11.073 5.938 18.182 1.00 0.00 C ATOM 2472 OE1 GLU B 338 11.469 5.067 18.939 1.00 0.00 O ATOM 2473 OE2 GLU B 338 10.408 6.898 18.535 1.00 0.00 O ATOM 0 H GLU B 338 13.649 2.709 15.534 1.00 0.00 H new ATOM 0 HA GLU B 338 11.585 4.391 14.417 1.00 0.00 H new ATOM 0 HB2 GLU B 338 11.712 3.679 16.840 1.00 0.00 H new ATOM 0 HB3 GLU B 338 13.191 4.603 17.014 1.00 0.00 H new ATOM 0 HG2 GLU B 338 11.997 6.693 16.386 1.00 0.00 H new ATOM 0 HG3 GLU B 338 10.521 5.792 16.103 1.00 0.00 H new