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 Set 1.1: A 34 TYR OH : rot -63:sc= 1.22 USER MOD Set 1.2: A 71 ASN :FLIP amide:sc= 0.26 F(o=-4.5!,f=1.5) USER MOD Set 2.1: A 62 GLN : amide:sc= -3.19! C(o=-2.4!,f=-4.3!) USER MOD Set 2.2: A 65 THR OG1 : rot -61:sc= 0.786 USER MOD Set 2.3: A 86 HIS : no HD1:sc= -0.0207 X(o=-2.4,f=-2.7) USER MOD Single : A 12 TYR OH : rot 180:sc= -0.589 USER MOD Single : A 14 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 19 ASN : amide:sc= -1.94 K(o=-1.9,f=-4.8!) USER MOD Single : A 23 THR OG1 : rot 180:sc= 0.0706 USER MOD Single : A 29 THR OG1 : rot 80:sc= 0.926 USER MOD Single : A 32 SER OG : rot 32:sc= 0.708 USER MOD Single : A 43 SER OG : rot -168:sc= 0.276! USER MOD Single : A 56 TYR OH : rot 103:sc= 0.667 USER MOD Single : A 58 LYS NZ :NH3+ -109:sc= -0.444 (180deg=-1.15) USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 SER OG : rot 180:sc= -0.101 USER MOD Single : A 73 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ 164:sc= -0.0026 (180deg=-0.332) USER MOD Single : A 87 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot -120:sc= -1.76! USER MOD Single : B 314 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 317 SER OG : rot 180:sc= 0 USER MOD Single : B 323 HIS : no HD1:sc= -0.0578 X(o=-0.058,f=0) USER MOD Single : B 325 SER OG : rot 180:sc= 0 USER MOD Single : B 331 LYS NZ :NH3+ -138:sc= 0.974 (180deg=-0.47!) USER MOD Single : B 335 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.132) USER MOD Single : B 336 GLN : amide:sc= -0.276 K(o=-0.28,f=-0.94) USER MOD Single : B 337 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD ----------------------------------------------------------------- ATOM 142 N ALA A 11 -1.260 -15.998 -2.037 1.00 0.00 N ATOM 143 CA ALA A 11 -0.447 -16.901 -1.232 1.00 0.00 C ATOM 144 C ALA A 11 -0.988 -16.979 0.193 1.00 0.00 C ATOM 145 O ALA A 11 -1.392 -15.969 0.771 1.00 0.00 O ATOM 146 CB ALA A 11 1.003 -16.414 -1.207 1.00 0.00 C ATOM 0 HA ALA A 11 -0.487 -17.895 -1.678 1.00 0.00 H new ATOM 0 HB1 ALA A 11 1.605 -17.094 -0.604 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.395 -16.387 -2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.043 -15.414 -0.776 1.00 0.00 H new ATOM 152 N TYR A 12 -0.994 -18.187 0.760 1.00 0.00 N ATOM 153 CA TYR A 12 -1.490 -18.394 2.125 1.00 0.00 C ATOM 154 C TYR A 12 -0.396 -18.972 3.020 1.00 0.00 C ATOM 155 O TYR A 12 0.506 -19.660 2.543 1.00 0.00 O ATOM 156 CB TYR A 12 -2.691 -19.346 2.105 1.00 0.00 C ATOM 157 CG TYR A 12 -3.898 -18.640 1.526 1.00 0.00 C ATOM 158 CD1 TYR A 12 -4.685 -17.821 2.346 1.00 0.00 C ATOM 159 CD2 TYR A 12 -4.227 -18.798 0.174 1.00 0.00 C ATOM 160 CE1 TYR A 12 -5.801 -17.165 1.815 1.00 0.00 C ATOM 161 CE2 TYR A 12 -5.345 -18.142 -0.357 1.00 0.00 C ATOM 162 CZ TYR A 12 -6.131 -17.324 0.464 1.00 0.00 C ATOM 163 OH TYR A 12 -7.231 -16.675 -0.058 1.00 0.00 O ATOM 0 H TYR A 12 -0.663 -19.034 0.299 1.00 0.00 H new ATOM 0 HA TYR A 12 -1.795 -17.428 2.527 1.00 0.00 H new ATOM 0 HB2 TYR A 12 -2.456 -20.229 1.511 1.00 0.00 H new ATOM 0 HB3 TYR A 12 -2.910 -19.690 3.116 1.00 0.00 H new ATOM 0 HD1 TYR A 12 -4.430 -17.696 3.388 1.00 0.00 H new ATOM 0 HD2 TYR A 12 -3.618 -19.426 -0.460 1.00 0.00 H new ATOM 0 HE1 TYR A 12 -6.408 -16.535 2.448 1.00 0.00 H new ATOM 0 HE2 TYR A 12 -5.601 -18.267 -1.399 1.00 0.00 H new ATOM 0 HH TYR A 12 -7.318 -16.892 -1.010 1.00 0.00 H new ATOM 173 N ILE A 13 -0.477 -18.687 4.324 1.00 0.00 N ATOM 174 CA ILE A 13 0.512 -19.193 5.285 1.00 0.00 C ATOM 175 C ILE A 13 -0.153 -20.149 6.267 1.00 0.00 C ATOM 176 O ILE A 13 -1.254 -19.896 6.755 1.00 0.00 O ATOM 177 CB ILE A 13 1.156 -18.035 6.052 1.00 0.00 C ATOM 178 CG1 ILE A 13 0.061 -17.120 6.604 1.00 0.00 C ATOM 179 CG2 ILE A 13 2.065 -17.242 5.113 1.00 0.00 C ATOM 180 CD1 ILE A 13 0.684 -16.065 7.527 1.00 0.00 C ATOM 0 H ILE A 13 -1.212 -18.113 4.737 1.00 0.00 H new ATOM 0 HA ILE A 13 1.287 -19.725 4.733 1.00 0.00 H new ATOM 0 HB ILE A 13 1.749 -18.429 6.877 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -0.467 -16.633 5.784 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -0.675 -17.708 7.153 1.00 0.00 H new ATOM 0 HG21 ILE A 13 2.523 -16.418 5.660 1.00 0.00 H new ATOM 0 HG22 ILE A 13 2.845 -17.896 4.723 1.00 0.00 H new ATOM 0 HG23 ILE A 13 1.476 -16.846 4.286 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -0.099 -15.415 7.918 1.00 0.00 H new ATOM 0 HD12 ILE A 13 1.192 -16.560 8.355 1.00 0.00 H new ATOM 0 HD13 ILE A 13 1.403 -15.469 6.965 1.00 0.00 H new ATOM 192 N TYR A 14 0.524 -21.249 6.557 1.00 0.00 N ATOM 193 CA TYR A 14 -0.014 -22.236 7.482 1.00 0.00 C ATOM 194 C TYR A 14 0.258 -21.813 8.917 1.00 0.00 C ATOM 195 O TYR A 14 1.414 -21.710 9.335 1.00 0.00 O ATOM 196 CB TYR A 14 0.629 -23.599 7.223 1.00 0.00 C ATOM 197 CG TYR A 14 -0.090 -24.662 8.019 1.00 0.00 C ATOM 198 CD1 TYR A 14 -1.186 -25.330 7.462 1.00 0.00 C ATOM 199 CD2 TYR A 14 0.340 -24.979 9.313 1.00 0.00 C ATOM 200 CE1 TYR A 14 -1.855 -26.314 8.199 1.00 0.00 C ATOM 201 CE2 TYR A 14 -0.329 -25.965 10.050 1.00 0.00 C ATOM 202 CZ TYR A 14 -1.427 -26.632 9.493 1.00 0.00 C ATOM 203 OH TYR A 14 -2.086 -27.602 10.220 1.00 0.00 O ATOM 0 H TYR A 14 1.439 -21.480 6.170 1.00 0.00 H new ATOM 0 HA TYR A 14 -1.091 -22.308 7.328 1.00 0.00 H new ATOM 0 HB2 TYR A 14 0.586 -23.836 6.160 1.00 0.00 H new ATOM 0 HB3 TYR A 14 1.683 -23.573 7.501 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -1.516 -25.086 6.463 1.00 0.00 H new ATOM 0 HD2 TYR A 14 1.187 -24.464 9.743 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -2.702 -26.828 7.769 1.00 0.00 H new ATOM 0 HE2 TYR A 14 0.002 -26.211 11.048 1.00 0.00 H new ATOM 0 HH TYR A 14 -1.660 -27.700 11.097 1.00 0.00 H new ATOM 213 N ILE A 15 -0.816 -21.568 9.673 1.00 0.00 N ATOM 214 CA ILE A 15 -0.676 -21.157 11.072 1.00 0.00 C ATOM 215 C ILE A 15 -1.115 -22.300 11.986 1.00 0.00 C ATOM 216 O ILE A 15 -2.304 -22.478 12.240 1.00 0.00 O ATOM 217 CB ILE A 15 -1.536 -19.910 11.338 1.00 0.00 C ATOM 218 CG1 ILE A 15 -1.153 -18.797 10.351 1.00 0.00 C ATOM 219 CG2 ILE A 15 -1.288 -19.426 12.767 1.00 0.00 C ATOM 220 CD1 ILE A 15 -2.204 -17.682 10.391 1.00 0.00 C ATOM 0 H ILE A 15 -1.779 -21.646 9.346 1.00 0.00 H new ATOM 0 HA ILE A 15 0.367 -20.916 11.276 1.00 0.00 H new ATOM 0 HB ILE A 15 -2.589 -20.160 11.209 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -0.173 -18.394 10.606 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -1.079 -19.203 9.342 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -1.895 -18.542 12.962 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -1.558 -20.214 13.470 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -0.234 -19.177 12.889 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.927 -16.896 9.689 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -3.177 -18.089 10.115 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.257 -17.268 11.398 1.00 0.00 H new ATOM 232 N GLY A 16 -0.144 -23.071 12.482 1.00 0.00 N ATOM 233 CA GLY A 16 -0.444 -24.201 13.367 1.00 0.00 C ATOM 234 C GLY A 16 -0.305 -23.810 14.835 1.00 0.00 C ATOM 235 O GLY A 16 0.138 -22.706 15.150 1.00 0.00 O ATOM 0 H GLY A 16 0.848 -22.936 12.289 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -1.457 -24.555 13.177 1.00 0.00 H new ATOM 0 HA3 GLY A 16 0.229 -25.029 13.144 1.00 0.00 H new ATOM 239 N ASN A 17 -0.687 -24.725 15.728 1.00 0.00 N ATOM 240 CA ASN A 17 -0.600 -24.467 17.160 1.00 0.00 C ATOM 241 C ASN A 17 -1.248 -23.128 17.497 1.00 0.00 C ATOM 242 O ASN A 17 -0.746 -22.379 18.335 1.00 0.00 O ATOM 243 CB ASN A 17 0.865 -24.458 17.603 1.00 0.00 C ATOM 244 CG ASN A 17 1.514 -25.802 17.294 1.00 0.00 C ATOM 245 OD1 ASN A 17 0.934 -26.852 17.571 1.00 0.00 O ATOM 246 ND2 ASN A 17 2.691 -25.833 16.733 1.00 0.00 N ATOM 0 H ASN A 17 -1.057 -25.644 15.484 1.00 0.00 H new ATOM 0 HA ASN A 17 -1.130 -25.259 17.689 1.00 0.00 H new ATOM 0 HB2 ASN A 17 1.403 -23.660 17.092 1.00 0.00 H new ATOM 0 HB3 ASN A 17 0.929 -24.252 18.671 1.00 0.00 H new ATOM 0 HD21 ASN A 17 3.132 -26.728 16.523 1.00 0.00 H new ATOM 0 HD22 ASN A 17 3.170 -24.962 16.504 1.00 0.00 H new ATOM 253 N LEU A 18 -2.365 -22.833 16.838 1.00 0.00 N ATOM 254 CA LEU A 18 -3.072 -21.580 17.074 1.00 0.00 C ATOM 255 C LEU A 18 -4.036 -21.720 18.245 1.00 0.00 C ATOM 256 O LEU A 18 -4.862 -22.633 18.277 1.00 0.00 O ATOM 257 CB LEU A 18 -3.856 -21.166 15.820 1.00 0.00 C ATOM 258 CG LEU A 18 -4.640 -19.848 16.089 1.00 0.00 C ATOM 259 CD1 LEU A 18 -4.507 -18.906 14.887 1.00 0.00 C ATOM 260 CD2 LEU A 18 -6.128 -20.159 16.320 1.00 0.00 C ATOM 0 H LEU A 18 -2.797 -23.440 16.141 1.00 0.00 H new ATOM 0 HA LEU A 18 -2.333 -20.814 17.309 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -3.171 -21.027 14.983 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -4.548 -21.959 15.537 1.00 0.00 H new ATOM 0 HG LEU A 18 -4.225 -19.370 16.976 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -5.058 -17.986 15.083 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -3.455 -18.671 14.724 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -4.913 -19.390 13.999 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -6.669 -19.231 16.507 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -6.539 -20.647 15.436 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -6.232 -20.820 17.180 1.00 0.00 H new ATOM 272 N ASN A 19 -3.927 -20.810 19.204 1.00 0.00 N ATOM 273 CA ASN A 19 -4.799 -20.841 20.369 1.00 0.00 C ATOM 274 C ASN A 19 -6.239 -20.533 19.964 1.00 0.00 C ATOM 275 O ASN A 19 -6.506 -19.542 19.284 1.00 0.00 O ATOM 276 CB ASN A 19 -4.322 -19.817 21.397 1.00 0.00 C ATOM 277 CG ASN A 19 -3.020 -20.283 22.038 1.00 0.00 C ATOM 278 OD1 ASN A 19 -2.693 -21.468 21.989 1.00 0.00 O ATOM 279 ND2 ASN A 19 -2.255 -19.416 22.642 1.00 0.00 N ATOM 0 H ASN A 19 -3.249 -20.048 19.199 1.00 0.00 H new ATOM 0 HA ASN A 19 -4.764 -21.838 20.807 1.00 0.00 H new ATOM 0 HB2 ASN A 19 -4.174 -18.850 20.916 1.00 0.00 H new ATOM 0 HB3 ASN A 19 -5.084 -19.678 22.164 1.00 0.00 H new ATOM 0 HD21 ASN A 19 -1.383 -19.720 23.075 1.00 0.00 H new ATOM 0 HD22 ASN A 19 -2.529 -18.434 22.681 1.00 0.00 H new ATOM 286 N ARG A 20 -7.166 -21.388 20.386 1.00 0.00 N ATOM 287 CA ARG A 20 -8.578 -21.199 20.062 1.00 0.00 C ATOM 288 C ARG A 20 -9.132 -19.948 20.742 1.00 0.00 C ATOM 289 O ARG A 20 -10.122 -19.372 20.295 1.00 0.00 O ATOM 290 CB ARG A 20 -9.382 -22.421 20.508 1.00 0.00 C ATOM 291 CG ARG A 20 -9.315 -22.548 22.030 1.00 0.00 C ATOM 292 CD ARG A 20 -9.859 -23.914 22.453 1.00 0.00 C ATOM 293 NE ARG A 20 -9.821 -24.045 23.906 1.00 0.00 N ATOM 294 CZ ARG A 20 -8.711 -24.420 24.535 1.00 0.00 C ATOM 295 NH1 ARG A 20 -7.630 -24.680 23.850 1.00 0.00 N ATOM 296 NH2 ARG A 20 -8.701 -24.531 25.835 1.00 0.00 N ATOM 0 H ARG A 20 -6.967 -22.214 20.950 1.00 0.00 H new ATOM 0 HA ARG A 20 -8.666 -21.076 18.983 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -10.419 -22.325 20.186 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.985 -23.322 20.039 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -8.286 -22.434 22.370 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -9.896 -21.753 22.498 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -10.882 -24.032 22.097 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -9.268 -24.707 21.994 1.00 0.00 H new ATOM 0 HE ARG A 20 -10.661 -23.845 24.449 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -7.638 -24.595 22.834 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -6.778 -24.968 24.331 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -9.546 -24.330 26.371 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -7.849 -24.819 26.316 1.00 0.00 H new ATOM 310 N GLU A 21 -8.485 -19.533 21.826 1.00 0.00 N ATOM 311 CA GLU A 21 -8.921 -18.351 22.562 1.00 0.00 C ATOM 312 C GLU A 21 -8.831 -17.103 21.688 1.00 0.00 C ATOM 313 O GLU A 21 -9.603 -16.160 21.851 1.00 0.00 O ATOM 314 CB GLU A 21 -8.055 -18.166 23.810 1.00 0.00 C ATOM 315 CG GLU A 21 -8.619 -17.022 24.658 1.00 0.00 C ATOM 316 CD GLU A 21 -7.826 -16.896 25.955 1.00 0.00 C ATOM 317 OE1 GLU A 21 -6.653 -16.571 25.880 1.00 0.00 O ATOM 318 OE2 GLU A 21 -8.406 -17.127 27.003 1.00 0.00 O ATOM 0 H GLU A 21 -7.662 -19.994 22.213 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.961 -18.496 22.856 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.034 -19.088 24.391 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -7.027 -17.947 23.523 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.571 -16.087 24.100 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.670 -17.207 24.881 1.00 0.00 H new ATOM 325 N LEU A 22 -7.879 -17.105 20.764 1.00 0.00 N ATOM 326 CA LEU A 22 -7.691 -15.965 19.873 1.00 0.00 C ATOM 327 C LEU A 22 -8.756 -15.959 18.778 1.00 0.00 C ATOM 328 O LEU A 22 -9.087 -17.002 18.215 1.00 0.00 O ATOM 329 CB LEU A 22 -6.292 -16.023 19.243 1.00 0.00 C ATOM 330 CG LEU A 22 -5.251 -15.473 20.234 1.00 0.00 C ATOM 331 CD1 LEU A 22 -5.413 -16.164 21.595 1.00 0.00 C ATOM 332 CD2 LEU A 22 -3.841 -15.737 19.691 1.00 0.00 C ATOM 0 H LEU A 22 -7.229 -17.876 20.612 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.787 -15.048 20.454 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -6.046 -17.051 18.976 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -6.274 -15.441 18.322 1.00 0.00 H new ATOM 0 HG LEU A 22 -5.401 -14.400 20.356 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -4.674 -15.771 22.293 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -6.414 -15.975 21.982 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -5.266 -17.238 21.478 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -3.102 -15.348 20.392 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -3.694 -16.810 19.567 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.723 -15.241 18.728 1.00 0.00 H new ATOM 344 N THR A 23 -9.292 -14.774 18.477 1.00 0.00 N ATOM 345 CA THR A 23 -10.324 -14.637 17.445 1.00 0.00 C ATOM 346 C THR A 23 -9.751 -13.974 16.194 1.00 0.00 C ATOM 347 O THR A 23 -8.540 -13.793 16.074 1.00 0.00 O ATOM 348 CB THR A 23 -11.490 -13.803 17.979 1.00 0.00 C ATOM 349 OG1 THR A 23 -12.506 -13.725 16.990 1.00 0.00 O ATOM 350 CG2 THR A 23 -10.998 -12.396 18.322 1.00 0.00 C ATOM 0 H THR A 23 -9.030 -13.899 18.931 1.00 0.00 H new ATOM 0 HA THR A 23 -10.680 -15.633 17.182 1.00 0.00 H new ATOM 0 HB THR A 23 -11.893 -14.273 18.877 1.00 0.00 H new ATOM 0 HG1 THR A 23 -13.255 -13.192 17.331 1.00 0.00 H new ATOM 0 HG21 THR A 23 -11.829 -11.802 18.702 1.00 0.00 H new ATOM 0 HG22 THR A 23 -10.219 -12.458 19.082 1.00 0.00 H new ATOM 0 HG23 THR A 23 -10.595 -11.923 17.427 1.00 0.00 H new ATOM 358 N GLU A 24 -10.632 -13.617 15.264 1.00 0.00 N ATOM 359 CA GLU A 24 -10.200 -12.978 14.025 1.00 0.00 C ATOM 360 C GLU A 24 -9.473 -11.667 14.319 1.00 0.00 C ATOM 361 O GLU A 24 -8.432 -11.378 13.728 1.00 0.00 O ATOM 362 CB GLU A 24 -11.423 -12.703 13.128 1.00 0.00 C ATOM 363 CG GLU A 24 -11.829 -13.990 12.373 1.00 0.00 C ATOM 364 CD GLU A 24 -11.146 -14.035 11.007 1.00 0.00 C ATOM 365 OE1 GLU A 24 -9.952 -13.792 10.958 1.00 0.00 O ATOM 366 OE2 GLU A 24 -11.826 -14.312 10.032 1.00 0.00 O ATOM 0 H GLU A 24 -11.639 -13.757 15.343 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.512 -13.649 13.510 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.257 -12.350 13.735 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.190 -11.912 12.415 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -11.550 -14.867 12.957 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.911 -14.022 12.248 1.00 0.00 H new ATOM 373 N GLY A 25 -10.023 -10.881 15.236 1.00 0.00 N ATOM 374 CA GLY A 25 -9.419 -9.605 15.597 1.00 0.00 C ATOM 375 C GLY A 25 -8.022 -9.798 16.182 1.00 0.00 C ATOM 376 O GLY A 25 -7.102 -9.037 15.881 1.00 0.00 O ATOM 0 H GLY A 25 -10.881 -11.103 15.741 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -9.362 -8.965 14.716 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -10.052 -9.093 16.322 1.00 0.00 H new ATOM 380 N ASP A 26 -7.873 -10.818 17.023 1.00 0.00 N ATOM 381 CA ASP A 26 -6.582 -11.094 17.648 1.00 0.00 C ATOM 382 C ASP A 26 -5.527 -11.431 16.596 1.00 0.00 C ATOM 383 O ASP A 26 -4.407 -10.932 16.645 1.00 0.00 O ATOM 384 CB ASP A 26 -6.719 -12.264 18.621 1.00 0.00 C ATOM 385 CG ASP A 26 -7.544 -11.842 19.831 1.00 0.00 C ATOM 386 OD1 ASP A 26 -7.776 -10.653 19.981 1.00 0.00 O ATOM 387 OD2 ASP A 26 -7.930 -12.713 20.592 1.00 0.00 O ATOM 0 H ASP A 26 -8.620 -11.461 17.285 1.00 0.00 H new ATOM 0 HA ASP A 26 -6.265 -10.200 18.186 1.00 0.00 H new ATOM 0 HB2 ASP A 26 -7.195 -13.108 18.123 1.00 0.00 H new ATOM 0 HB3 ASP A 26 -5.732 -12.598 18.942 1.00 0.00 H new ATOM 392 N ILE A 27 -5.899 -12.277 15.641 1.00 0.00 N ATOM 393 CA ILE A 27 -4.977 -12.671 14.580 1.00 0.00 C ATOM 394 C ILE A 27 -4.573 -11.457 13.750 1.00 0.00 C ATOM 395 O ILE A 27 -3.409 -11.302 13.389 1.00 0.00 O ATOM 396 CB ILE A 27 -5.623 -13.730 13.673 1.00 0.00 C ATOM 397 CG1 ILE A 27 -5.787 -15.045 14.454 1.00 0.00 C ATOM 398 CG2 ILE A 27 -4.744 -13.979 12.434 1.00 0.00 C ATOM 399 CD1 ILE A 27 -6.593 -16.051 13.617 1.00 0.00 C ATOM 0 H ILE A 27 -6.825 -12.701 15.579 1.00 0.00 H new ATOM 0 HA ILE A 27 -4.086 -13.097 15.041 1.00 0.00 H new ATOM 0 HB ILE A 27 -6.599 -13.369 13.350 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -4.808 -15.460 14.695 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -6.295 -14.856 15.400 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -5.213 -14.731 11.800 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -4.633 -13.050 11.874 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -3.762 -14.332 12.749 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -6.706 -16.981 14.175 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -7.577 -15.637 13.399 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -6.068 -16.250 12.683 1.00 0.00 H new ATOM 411 N LEU A 28 -5.545 -10.610 13.443 1.00 0.00 N ATOM 412 CA LEU A 28 -5.273 -9.425 12.645 1.00 0.00 C ATOM 413 C LEU A 28 -4.276 -8.503 13.343 1.00 0.00 C ATOM 414 O LEU A 28 -3.326 -8.028 12.726 1.00 0.00 O ATOM 415 CB LEU A 28 -6.584 -8.665 12.392 1.00 0.00 C ATOM 416 CG LEU A 28 -7.434 -9.411 11.338 1.00 0.00 C ATOM 417 CD1 LEU A 28 -8.897 -8.980 11.455 1.00 0.00 C ATOM 418 CD2 LEU A 28 -6.928 -9.075 9.923 1.00 0.00 C ATOM 0 H LEU A 28 -6.517 -10.719 13.731 1.00 0.00 H new ATOM 0 HA LEU A 28 -4.837 -9.744 11.698 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -7.144 -8.571 13.322 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -6.367 -7.654 12.047 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.349 -10.483 11.513 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.493 -9.508 10.710 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -9.268 -9.218 12.452 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.974 -7.906 11.286 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.532 -9.604 9.186 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -7.007 -8.001 9.754 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -5.886 -9.382 9.827 1.00 0.00 H new ATOM 430 N THR A 29 -4.493 -8.263 14.633 1.00 0.00 N ATOM 431 CA THR A 29 -3.611 -7.384 15.402 1.00 0.00 C ATOM 432 C THR A 29 -2.203 -7.970 15.483 1.00 0.00 C ATOM 433 O THR A 29 -1.212 -7.248 15.407 1.00 0.00 O ATOM 434 CB THR A 29 -4.161 -7.193 16.822 1.00 0.00 C ATOM 435 OG1 THR A 29 -5.540 -6.863 16.747 1.00 0.00 O ATOM 436 CG2 THR A 29 -3.403 -6.052 17.526 1.00 0.00 C ATOM 0 H THR A 29 -5.266 -8.661 15.167 1.00 0.00 H new ATOM 0 HA THR A 29 -3.567 -6.420 14.894 1.00 0.00 H new ATOM 0 HB THR A 29 -4.030 -8.115 17.388 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.064 -7.678 16.598 1.00 0.00 H new ATOM 0 HG21 THR A 29 -3.797 -5.921 18.534 1.00 0.00 H new ATOM 0 HG22 THR A 29 -2.343 -6.299 17.581 1.00 0.00 H new ATOM 0 HG23 THR A 29 -3.532 -5.128 16.963 1.00 0.00 H new ATOM 444 N VAL A 30 -2.123 -9.282 15.649 1.00 0.00 N ATOM 445 CA VAL A 30 -0.829 -9.943 15.749 1.00 0.00 C ATOM 446 C VAL A 30 -0.026 -9.790 14.455 1.00 0.00 C ATOM 447 O VAL A 30 1.135 -9.396 14.479 1.00 0.00 O ATOM 448 CB VAL A 30 -1.041 -11.435 16.047 1.00 0.00 C ATOM 449 CG1 VAL A 30 0.306 -12.163 15.991 1.00 0.00 C ATOM 450 CG2 VAL A 30 -1.661 -11.600 17.448 1.00 0.00 C ATOM 0 H VAL A 30 -2.928 -9.904 15.717 1.00 0.00 H new ATOM 0 HA VAL A 30 -0.266 -9.475 16.557 1.00 0.00 H new ATOM 0 HB VAL A 30 -1.715 -11.861 15.303 1.00 0.00 H new ATOM 0 HG11 VAL A 30 0.156 -13.222 16.202 1.00 0.00 H new ATOM 0 HG12 VAL A 30 0.740 -12.049 14.998 1.00 0.00 H new ATOM 0 HG13 VAL A 30 0.981 -11.737 16.733 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -1.811 -12.659 17.657 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -0.991 -11.174 18.195 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -2.620 -11.084 17.484 1.00 0.00 H new ATOM 460 N PHE A 31 -0.658 -10.102 13.328 1.00 0.00 N ATOM 461 CA PHE A 31 -0.001 -10.006 12.019 1.00 0.00 C ATOM 462 C PHE A 31 -0.116 -8.595 11.430 1.00 0.00 C ATOM 463 O PHE A 31 0.555 -8.261 10.454 1.00 0.00 O ATOM 464 CB PHE A 31 -0.614 -11.026 11.050 1.00 0.00 C ATOM 465 CG PHE A 31 -0.156 -12.419 11.420 1.00 0.00 C ATOM 466 CD1 PHE A 31 -0.838 -13.147 12.403 1.00 0.00 C ATOM 467 CD2 PHE A 31 0.953 -12.983 10.780 1.00 0.00 C ATOM 468 CE1 PHE A 31 -0.413 -14.435 12.744 1.00 0.00 C ATOM 469 CE2 PHE A 31 1.379 -14.273 11.121 1.00 0.00 C ATOM 470 CZ PHE A 31 0.696 -14.997 12.104 1.00 0.00 C ATOM 0 H PHE A 31 -1.625 -10.424 13.290 1.00 0.00 H new ATOM 0 HA PHE A 31 1.057 -10.224 12.161 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -1.702 -10.969 11.087 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -0.317 -10.795 10.027 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -1.694 -12.713 12.899 1.00 0.00 H new ATOM 0 HD2 PHE A 31 1.481 -12.423 10.022 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -0.941 -14.995 13.501 1.00 0.00 H new ATOM 0 HE2 PHE A 31 2.234 -14.708 10.625 1.00 0.00 H new ATOM 0 HZ PHE A 31 1.026 -15.991 12.369 1.00 0.00 H new ATOM 480 N SER A 32 -0.982 -7.775 12.020 1.00 0.00 N ATOM 481 CA SER A 32 -1.196 -6.412 11.522 1.00 0.00 C ATOM 482 C SER A 32 0.130 -5.735 11.139 1.00 0.00 C ATOM 483 O SER A 32 0.302 -5.287 10.004 1.00 0.00 O ATOM 484 CB SER A 32 -1.901 -5.572 12.585 1.00 0.00 C ATOM 485 OG SER A 32 -3.308 -5.709 12.445 1.00 0.00 O ATOM 0 H SER A 32 -1.543 -8.023 12.835 1.00 0.00 H new ATOM 0 HA SER A 32 -1.817 -6.481 10.629 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.592 -5.892 13.580 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.616 -4.525 12.484 1.00 0.00 H new ATOM 0 HG SER A 32 -3.517 -6.604 12.104 1.00 0.00 H new ATOM 491 N GLU A 33 1.055 -5.667 12.083 1.00 0.00 N ATOM 492 CA GLU A 33 2.358 -5.045 11.833 1.00 0.00 C ATOM 493 C GLU A 33 3.188 -5.875 10.854 1.00 0.00 C ATOM 494 O GLU A 33 3.911 -5.338 10.017 1.00 0.00 O ATOM 495 CB GLU A 33 3.128 -4.886 13.155 1.00 0.00 C ATOM 496 CG GLU A 33 4.475 -4.191 12.898 1.00 0.00 C ATOM 497 CD GLU A 33 4.241 -2.775 12.384 1.00 0.00 C ATOM 498 OE1 GLU A 33 3.152 -2.264 12.589 1.00 0.00 O ATOM 499 OE2 GLU A 33 5.153 -2.222 11.793 1.00 0.00 O ATOM 0 H GLU A 33 0.935 -6.032 13.028 1.00 0.00 H new ATOM 0 HA GLU A 33 2.183 -4.064 11.391 1.00 0.00 H new ATOM 0 HB2 GLU A 33 2.537 -4.303 13.862 1.00 0.00 H new ATOM 0 HB3 GLU A 33 3.294 -5.863 13.609 1.00 0.00 H new ATOM 0 HG2 GLU A 33 5.059 -4.161 13.818 1.00 0.00 H new ATOM 0 HG3 GLU A 33 5.054 -4.760 12.171 1.00 0.00 H new ATOM 506 N TYR A 34 3.090 -7.190 10.977 1.00 0.00 N ATOM 507 CA TYR A 34 3.846 -8.104 10.123 1.00 0.00 C ATOM 508 C TYR A 34 3.135 -8.347 8.790 1.00 0.00 C ATOM 509 O TYR A 34 3.173 -9.458 8.257 1.00 0.00 O ATOM 510 CB TYR A 34 4.080 -9.431 10.848 1.00 0.00 C ATOM 511 CG TYR A 34 4.763 -9.167 12.173 1.00 0.00 C ATOM 512 CD1 TYR A 34 6.057 -8.637 12.201 1.00 0.00 C ATOM 513 CD2 TYR A 34 4.095 -9.454 13.373 1.00 0.00 C ATOM 514 CE1 TYR A 34 6.688 -8.394 13.426 1.00 0.00 C ATOM 515 CE2 TYR A 34 4.728 -9.211 14.598 1.00 0.00 C ATOM 516 CZ TYR A 34 6.022 -8.680 14.625 1.00 0.00 C ATOM 517 OH TYR A 34 6.645 -8.440 15.833 1.00 0.00 O ATOM 0 H TYR A 34 2.493 -7.653 11.662 1.00 0.00 H new ATOM 0 HA TYR A 34 4.808 -7.639 9.906 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.131 -9.941 11.011 1.00 0.00 H new ATOM 0 HB3 TYR A 34 4.695 -10.090 10.234 1.00 0.00 H new ATOM 0 HD1 TYR A 34 6.569 -8.415 11.277 1.00 0.00 H new ATOM 0 HD2 TYR A 34 3.095 -9.861 13.352 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.688 -7.986 13.447 1.00 0.00 H new ATOM 0 HE2 TYR A 34 4.217 -9.434 15.523 1.00 0.00 H new ATOM 0 HH TYR A 34 7.445 -9.002 15.906 1.00 0.00 H new ATOM 527 N GLY A 35 2.471 -7.312 8.258 1.00 0.00 N ATOM 528 CA GLY A 35 1.743 -7.467 6.993 1.00 0.00 C ATOM 529 C GLY A 35 0.252 -7.675 7.226 1.00 0.00 C ATOM 530 O GLY A 35 -0.260 -8.774 7.035 1.00 0.00 O ATOM 0 H GLY A 35 2.423 -6.381 8.672 1.00 0.00 H new ATOM 0 HA2 GLY A 35 1.895 -6.583 6.374 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.148 -8.316 6.441 1.00 0.00 H new ATOM 534 N VAL A 36 -0.435 -6.613 7.655 1.00 0.00 N ATOM 535 CA VAL A 36 -1.861 -6.716 7.962 1.00 0.00 C ATOM 536 C VAL A 36 -2.631 -7.312 6.776 1.00 0.00 C ATOM 537 O VAL A 36 -2.822 -6.665 5.752 1.00 0.00 O ATOM 538 CB VAL A 36 -2.419 -5.309 8.269 1.00 0.00 C ATOM 539 CG1 VAL A 36 -2.352 -4.422 7.003 1.00 0.00 C ATOM 540 CG2 VAL A 36 -3.876 -5.438 8.731 1.00 0.00 C ATOM 0 H VAL A 36 -0.033 -5.686 7.796 1.00 0.00 H new ATOM 0 HA VAL A 36 -1.984 -7.369 8.826 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.821 -4.846 9.054 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -2.748 -3.432 7.231 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.316 -4.332 6.676 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.945 -4.876 6.209 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -4.277 -4.448 8.950 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -4.468 -5.903 7.943 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.920 -6.054 9.629 1.00 0.00 H new ATOM 550 N PRO A 37 -3.069 -8.563 6.911 1.00 0.00 N ATOM 551 CA PRO A 37 -3.816 -9.287 5.835 1.00 0.00 C ATOM 552 C PRO A 37 -5.115 -8.585 5.460 1.00 0.00 C ATOM 553 O PRO A 37 -5.684 -7.844 6.260 1.00 0.00 O ATOM 554 CB PRO A 37 -4.108 -10.671 6.444 1.00 0.00 C ATOM 555 CG PRO A 37 -3.151 -10.816 7.580 1.00 0.00 C ATOM 556 CD PRO A 37 -2.903 -9.422 8.107 1.00 0.00 C ATOM 0 HA PRO A 37 -3.238 -9.336 4.912 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -5.140 -10.738 6.789 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -3.966 -11.462 5.708 1.00 0.00 H new ATOM 0 HG2 PRO A 37 -3.565 -11.458 8.358 1.00 0.00 H new ATOM 0 HG3 PRO A 37 -2.221 -11.277 7.248 1.00 0.00 H new ATOM 0 HD2 PRO A 37 -3.612 -9.158 8.892 1.00 0.00 H new ATOM 0 HD3 PRO A 37 -1.905 -9.326 8.534 1.00 0.00 H new ATOM 564 N VAL A 38 -5.576 -8.823 4.238 1.00 0.00 N ATOM 565 CA VAL A 38 -6.815 -8.215 3.770 1.00 0.00 C ATOM 566 C VAL A 38 -7.984 -9.172 3.992 1.00 0.00 C ATOM 567 O VAL A 38 -9.128 -8.739 4.129 1.00 0.00 O ATOM 568 CB VAL A 38 -6.701 -7.868 2.281 1.00 0.00 C ATOM 569 CG1 VAL A 38 -5.662 -6.761 2.090 1.00 0.00 C ATOM 570 CG2 VAL A 38 -6.264 -9.112 1.498 1.00 0.00 C ATOM 0 H VAL A 38 -5.115 -9.428 3.558 1.00 0.00 H new ATOM 0 HA VAL A 38 -6.993 -7.300 4.335 1.00 0.00 H new ATOM 0 HB VAL A 38 -7.669 -7.526 1.916 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -5.582 -6.516 1.031 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -5.968 -5.875 2.646 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -4.694 -7.103 2.457 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -6.183 -8.866 0.439 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -5.296 -9.453 1.867 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -7.002 -9.903 1.631 1.00 0.00 H new ATOM 580 N ASP A 39 -7.690 -10.474 4.029 1.00 0.00 N ATOM 581 CA ASP A 39 -8.727 -11.491 4.238 1.00 0.00 C ATOM 582 C ASP A 39 -8.179 -12.670 5.047 1.00 0.00 C ATOM 583 O ASP A 39 -7.066 -13.138 4.800 1.00 0.00 O ATOM 584 CB ASP A 39 -9.246 -11.990 2.884 1.00 0.00 C ATOM 585 CG ASP A 39 -10.106 -10.917 2.222 1.00 0.00 C ATOM 586 OD1 ASP A 39 -10.629 -10.080 2.937 1.00 0.00 O ATOM 587 OD2 ASP A 39 -10.226 -10.946 1.007 1.00 0.00 O ATOM 0 H ASP A 39 -6.748 -10.849 3.918 1.00 0.00 H new ATOM 0 HA ASP A 39 -9.545 -11.038 4.798 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -8.407 -12.245 2.236 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -9.830 -12.900 3.023 1.00 0.00 H new ATOM 592 N VAL A 40 -8.967 -13.153 6.016 1.00 0.00 N ATOM 593 CA VAL A 40 -8.548 -14.287 6.858 1.00 0.00 C ATOM 594 C VAL A 40 -9.617 -15.379 6.852 1.00 0.00 C ATOM 595 O VAL A 40 -10.793 -15.109 7.094 1.00 0.00 O ATOM 596 CB VAL A 40 -8.296 -13.817 8.298 1.00 0.00 C ATOM 597 CG1 VAL A 40 -7.817 -15.000 9.148 1.00 0.00 C ATOM 598 CG2 VAL A 40 -7.231 -12.707 8.300 1.00 0.00 C ATOM 0 H VAL A 40 -9.891 -12.782 6.237 1.00 0.00 H new ATOM 0 HA VAL A 40 -7.623 -14.694 6.449 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.222 -13.425 8.719 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -7.638 -14.665 10.170 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.579 -15.779 9.149 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -6.892 -15.398 8.730 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -7.054 -12.375 9.323 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -6.303 -13.092 7.878 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.581 -11.866 7.701 1.00 0.00 H new ATOM 608 N ILE A 41 -9.203 -16.616 6.576 1.00 0.00 N ATOM 609 CA ILE A 41 -10.136 -17.746 6.539 1.00 0.00 C ATOM 610 C ILE A 41 -10.054 -18.557 7.831 1.00 0.00 C ATOM 611 O ILE A 41 -8.981 -19.018 8.221 1.00 0.00 O ATOM 612 CB ILE A 41 -9.814 -18.652 5.349 1.00 0.00 C ATOM 613 CG1 ILE A 41 -9.998 -17.869 4.045 1.00 0.00 C ATOM 614 CG2 ILE A 41 -10.754 -19.859 5.357 1.00 0.00 C ATOM 615 CD1 ILE A 41 -9.424 -18.674 2.873 1.00 0.00 C ATOM 0 H ILE A 41 -8.234 -16.862 6.376 1.00 0.00 H new ATOM 0 HA ILE A 41 -11.146 -17.351 6.434 1.00 0.00 H new ATOM 0 HB ILE A 41 -8.782 -18.995 5.423 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -11.056 -17.668 3.877 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -9.497 -16.904 4.116 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -10.525 -20.504 4.509 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -10.622 -20.417 6.284 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -11.786 -19.517 5.284 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -9.557 -18.114 1.947 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -8.362 -18.853 3.040 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -9.945 -19.628 2.797 1.00 0.00 H new ATOM 627 N LEU A 42 -11.199 -18.730 8.498 1.00 0.00 N ATOM 628 CA LEU A 42 -11.248 -19.494 9.751 1.00 0.00 C ATOM 629 C LEU A 42 -11.831 -20.883 9.498 1.00 0.00 C ATOM 630 O LEU A 42 -13.030 -21.028 9.254 1.00 0.00 O ATOM 631 CB LEU A 42 -12.099 -18.736 10.811 1.00 0.00 C ATOM 632 CG LEU A 42 -11.181 -17.918 11.765 1.00 0.00 C ATOM 633 CD1 LEU A 42 -10.291 -18.879 12.601 1.00 0.00 C ATOM 634 CD2 LEU A 42 -10.289 -16.981 10.929 1.00 0.00 C ATOM 0 H LEU A 42 -12.098 -18.355 8.196 1.00 0.00 H new ATOM 0 HA LEU A 42 -10.234 -19.605 10.134 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -12.801 -18.068 10.312 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -12.690 -19.448 11.387 1.00 0.00 H new ATOM 0 HG LEU A 42 -11.798 -17.329 12.444 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.652 -18.297 13.266 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -10.925 -19.539 13.193 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -9.671 -19.475 11.932 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -9.644 -16.405 11.592 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -9.676 -17.573 10.250 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -10.916 -16.301 10.352 1.00 0.00 H new ATOM 646 N SER A 43 -10.980 -21.898 9.562 1.00 0.00 N ATOM 647 CA SER A 43 -11.425 -23.268 9.342 1.00 0.00 C ATOM 648 C SER A 43 -12.304 -23.737 10.495 1.00 0.00 C ATOM 649 O SER A 43 -12.204 -23.225 11.610 1.00 0.00 O ATOM 650 CB SER A 43 -10.217 -24.191 9.211 1.00 0.00 C ATOM 651 OG SER A 43 -9.565 -24.291 10.470 1.00 0.00 O ATOM 0 H SER A 43 -9.985 -21.801 9.763 1.00 0.00 H new ATOM 0 HA SER A 43 -12.008 -23.299 8.421 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.533 -25.178 8.873 1.00 0.00 H new ATOM 0 HB3 SER A 43 -9.528 -23.803 8.461 1.00 0.00 H new ATOM 0 HG SER A 43 -8.694 -24.725 10.354 1.00 0.00 H new ATOM 657 N ARG A 44 -13.171 -24.716 10.222 1.00 0.00 N ATOM 658 CA ARG A 44 -14.067 -25.249 11.252 1.00 0.00 C ATOM 659 C ARG A 44 -14.007 -26.774 11.284 1.00 0.00 C ATOM 660 O ARG A 44 -14.136 -27.432 10.252 1.00 0.00 O ATOM 661 CB ARG A 44 -15.503 -24.801 10.970 1.00 0.00 C ATOM 662 CG ARG A 44 -15.596 -23.278 11.097 1.00 0.00 C ATOM 663 CD ARG A 44 -16.997 -22.817 10.690 1.00 0.00 C ATOM 664 NE ARG A 44 -17.216 -23.060 9.269 1.00 0.00 N ATOM 665 CZ ARG A 44 -18.421 -22.919 8.726 1.00 0.00 C ATOM 666 NH1 ARG A 44 -19.433 -22.559 9.469 1.00 0.00 N ATOM 667 NH2 ARG A 44 -18.594 -23.141 7.452 1.00 0.00 N ATOM 0 H ARG A 44 -13.271 -25.152 9.305 1.00 0.00 H new ATOM 0 HA ARG A 44 -13.745 -24.866 12.220 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -15.803 -25.112 9.969 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -16.188 -25.278 11.671 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -15.385 -22.974 12.122 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -14.847 -22.803 10.463 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -17.747 -23.348 11.277 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -17.115 -21.755 10.907 1.00 0.00 H new ATOM 0 HE ARG A 44 -16.431 -23.343 8.682 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -19.298 -22.386 10.465 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -20.358 -22.451 9.053 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -17.804 -23.423 6.872 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -19.519 -23.032 7.036 1.00 0.00 H new ATOM 786 N GLY A 53 -7.937 -24.324 15.685 1.00 0.00 N ATOM 787 CA GLY A 53 -6.549 -24.674 15.984 1.00 0.00 C ATOM 788 C GLY A 53 -5.618 -24.213 14.868 1.00 0.00 C ATOM 789 O GLY A 53 -4.395 -24.251 15.015 1.00 0.00 O ATOM 0 HA2 GLY A 53 -6.249 -24.215 16.926 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -6.462 -25.753 16.113 1.00 0.00 H new ATOM 793 N PHE A 54 -6.200 -23.776 13.756 1.00 0.00 N ATOM 794 CA PHE A 54 -5.409 -23.302 12.623 1.00 0.00 C ATOM 795 C PHE A 54 -6.243 -22.383 11.734 1.00 0.00 C ATOM 796 O PHE A 54 -7.473 -22.428 11.763 1.00 0.00 O ATOM 797 CB PHE A 54 -4.898 -24.493 11.807 1.00 0.00 C ATOM 798 CG PHE A 54 -6.070 -25.295 11.295 1.00 0.00 C ATOM 799 CD1 PHE A 54 -6.657 -26.271 12.108 1.00 0.00 C ATOM 800 CD2 PHE A 54 -6.573 -25.060 10.009 1.00 0.00 C ATOM 801 CE1 PHE A 54 -7.745 -27.015 11.635 1.00 0.00 C ATOM 802 CE2 PHE A 54 -7.662 -25.804 9.537 1.00 0.00 C ATOM 803 CZ PHE A 54 -8.247 -26.780 10.350 1.00 0.00 C ATOM 0 H PHE A 54 -7.209 -23.740 13.614 1.00 0.00 H new ATOM 0 HA PHE A 54 -4.559 -22.738 13.006 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -4.292 -24.142 10.972 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -4.256 -25.121 12.424 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -6.271 -26.451 13.101 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -6.121 -24.306 9.382 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -8.197 -27.770 12.262 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -8.050 -25.624 8.545 1.00 0.00 H new ATOM 0 HZ PHE A 54 -9.087 -27.353 9.986 1.00 0.00 H new ATOM 813 N ALA A 55 -5.567 -21.554 10.943 1.00 0.00 N ATOM 814 CA ALA A 55 -6.258 -20.628 10.049 1.00 0.00 C ATOM 815 C ALA A 55 -5.344 -20.209 8.900 1.00 0.00 C ATOM 816 O ALA A 55 -4.137 -20.449 8.938 1.00 0.00 O ATOM 817 CB ALA A 55 -6.711 -19.389 10.823 1.00 0.00 C ATOM 0 H ALA A 55 -4.549 -21.504 10.902 1.00 0.00 H new ATOM 0 HA ALA A 55 -7.131 -21.135 9.638 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -7.225 -18.705 10.147 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -7.389 -19.687 11.622 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -5.842 -18.890 11.252 1.00 0.00 H new ATOM 823 N TYR A 56 -5.925 -19.580 7.875 1.00 0.00 N ATOM 824 CA TYR A 56 -5.144 -19.130 6.717 1.00 0.00 C ATOM 825 C TYR A 56 -5.457 -17.674 6.387 1.00 0.00 C ATOM 826 O TYR A 56 -6.620 -17.296 6.244 1.00 0.00 O ATOM 827 CB TYR A 56 -5.471 -20.001 5.509 1.00 0.00 C ATOM 828 CG TYR A 56 -5.418 -21.458 5.911 1.00 0.00 C ATOM 829 CD1 TYR A 56 -4.232 -22.003 6.411 1.00 0.00 C ATOM 830 CD2 TYR A 56 -6.560 -22.263 5.784 1.00 0.00 C ATOM 831 CE1 TYR A 56 -4.187 -23.351 6.785 1.00 0.00 C ATOM 832 CE2 TYR A 56 -6.513 -23.610 6.158 1.00 0.00 C ATOM 833 CZ TYR A 56 -5.326 -24.154 6.657 1.00 0.00 C ATOM 834 OH TYR A 56 -5.279 -25.485 7.025 1.00 0.00 O ATOM 0 H TYR A 56 -6.922 -19.372 7.822 1.00 0.00 H new ATOM 0 HA TYR A 56 -4.085 -19.215 6.961 1.00 0.00 H new ATOM 0 HB2 TYR A 56 -6.461 -19.754 5.126 1.00 0.00 H new ATOM 0 HB3 TYR A 56 -4.761 -19.808 4.705 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -3.352 -21.385 6.509 1.00 0.00 H new ATOM 0 HD2 TYR A 56 -7.476 -21.842 5.397 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -3.271 -23.772 7.173 1.00 0.00 H new ATOM 0 HE2 TYR A 56 -7.393 -24.229 6.061 1.00 0.00 H new ATOM 0 HH TYR A 56 -5.723 -25.601 7.891 1.00 0.00 H new ATOM 844 N LEU A 57 -4.413 -16.854 6.263 1.00 0.00 N ATOM 845 CA LEU A 57 -4.586 -15.433 5.944 1.00 0.00 C ATOM 846 C LEU A 57 -3.641 -15.019 4.819 1.00 0.00 C ATOM 847 O LEU A 57 -2.529 -15.537 4.712 1.00 0.00 O ATOM 848 CB LEU A 57 -4.319 -14.580 7.190 1.00 0.00 C ATOM 849 CG LEU A 57 -2.890 -14.865 7.729 1.00 0.00 C ATOM 850 CD1 LEU A 57 -1.839 -13.974 6.990 1.00 0.00 C ATOM 851 CD2 LEU A 57 -2.855 -14.569 9.240 1.00 0.00 C ATOM 0 H LEU A 57 -3.442 -17.146 6.378 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.613 -15.274 5.614 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -4.421 -13.523 6.946 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -5.058 -14.803 7.959 1.00 0.00 H new ATOM 0 HG LEU A 57 -2.641 -15.911 7.550 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -0.844 -14.186 7.380 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -1.864 -14.191 5.922 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.075 -12.922 7.152 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -1.855 -14.767 9.626 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.110 -13.523 9.412 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.575 -15.207 9.753 1.00 0.00 H new ATOM 863 N LYS A 58 -4.086 -14.078 3.973 1.00 0.00 N ATOM 864 CA LYS A 58 -3.265 -13.600 2.851 1.00 0.00 C ATOM 865 C LYS A 58 -3.193 -12.076 2.833 1.00 0.00 C ATOM 866 O LYS A 58 -4.171 -11.396 3.144 1.00 0.00 O ATOM 867 CB LYS A 58 -3.856 -14.090 1.533 1.00 0.00 C ATOM 868 CG LYS A 58 -5.336 -13.715 1.469 1.00 0.00 C ATOM 869 CD LYS A 58 -5.896 -14.062 0.077 1.00 0.00 C ATOM 870 CE LYS A 58 -5.735 -12.860 -0.861 1.00 0.00 C ATOM 871 NZ LYS A 58 -6.619 -11.751 -0.399 1.00 0.00 N ATOM 0 H LYS A 58 -5.003 -13.636 4.043 1.00 0.00 H new ATOM 0 HA LYS A 58 -2.257 -13.995 2.977 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.320 -13.645 0.694 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.739 -15.170 1.449 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.891 -14.250 2.239 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -5.461 -12.651 1.668 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.372 -14.926 -0.331 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -6.948 -14.335 0.156 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.696 -12.531 -0.874 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -5.992 -13.144 -1.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -7.408 -11.635 -1.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.994 -11.976 0.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.072 -10.867 -0.353 1.00 0.00 H new ATOM 885 N TYR A 59 -2.026 -11.539 2.467 1.00 0.00 N ATOM 886 CA TYR A 59 -1.831 -10.085 2.402 1.00 0.00 C ATOM 887 C TYR A 59 -1.505 -9.649 0.978 1.00 0.00 C ATOM 888 O TYR A 59 -1.216 -10.480 0.115 1.00 0.00 O ATOM 889 CB TYR A 59 -0.708 -9.652 3.350 1.00 0.00 C ATOM 890 CG TYR A 59 -0.479 -8.152 3.230 1.00 0.00 C ATOM 891 CD1 TYR A 59 -1.533 -7.265 3.475 1.00 0.00 C ATOM 892 CD2 TYR A 59 0.784 -7.660 2.879 1.00 0.00 C ATOM 893 CE1 TYR A 59 -1.322 -5.884 3.363 1.00 0.00 C ATOM 894 CE2 TYR A 59 0.993 -6.280 2.770 1.00 0.00 C ATOM 895 CZ TYR A 59 -0.059 -5.394 3.012 1.00 0.00 C ATOM 896 OH TYR A 59 0.148 -4.032 2.903 1.00 0.00 O ATOM 0 H TYR A 59 -1.204 -12.086 2.212 1.00 0.00 H new ATOM 0 HA TYR A 59 -2.759 -9.604 2.711 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -0.968 -9.908 4.377 1.00 0.00 H new ATOM 0 HB3 TYR A 59 0.210 -10.189 3.110 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -2.506 -7.644 3.750 1.00 0.00 H new ATOM 0 HD2 TYR A 59 1.597 -8.345 2.692 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -2.135 -5.197 3.548 1.00 0.00 H new ATOM 0 HE2 TYR A 59 1.967 -5.901 2.499 1.00 0.00 H new ATOM 0 HH TYR A 59 1.080 -3.862 2.653 1.00 0.00 H new ATOM 906 N GLU A 60 -1.552 -8.346 0.736 1.00 0.00 N ATOM 907 CA GLU A 60 -1.263 -7.815 -0.590 1.00 0.00 C ATOM 908 C GLU A 60 0.155 -8.186 -1.018 1.00 0.00 C ATOM 909 O GLU A 60 0.386 -8.577 -2.161 1.00 0.00 O ATOM 910 CB GLU A 60 -1.415 -6.293 -0.583 1.00 0.00 C ATOM 911 CG GLU A 60 -1.385 -5.770 -2.020 1.00 0.00 C ATOM 912 CD GLU A 60 -2.648 -6.198 -2.757 1.00 0.00 C ATOM 913 OE1 GLU A 60 -3.620 -6.514 -2.090 1.00 0.00 O ATOM 914 OE2 GLU A 60 -2.628 -6.203 -3.977 1.00 0.00 O ATOM 0 H GLU A 60 -1.786 -7.641 1.435 1.00 0.00 H new ATOM 0 HA GLU A 60 -1.968 -8.248 -1.299 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -2.352 -6.013 -0.102 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -0.611 -5.839 -0.003 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -1.306 -4.683 -2.018 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -0.505 -6.153 -2.537 1.00 0.00 H new ATOM 921 N ASP A 61 1.108 -8.064 -0.093 1.00 0.00 N ATOM 922 CA ASP A 61 2.507 -8.393 -0.391 1.00 0.00 C ATOM 923 C ASP A 61 2.892 -9.725 0.242 1.00 0.00 C ATOM 924 O ASP A 61 2.951 -9.851 1.464 1.00 0.00 O ATOM 925 CB ASP A 61 3.427 -7.296 0.146 1.00 0.00 C ATOM 926 CG ASP A 61 3.023 -5.947 -0.441 1.00 0.00 C ATOM 927 OD1 ASP A 61 2.872 -5.868 -1.648 1.00 0.00 O ATOM 928 OD2 ASP A 61 2.871 -5.012 0.327 1.00 0.00 O ATOM 0 H ASP A 61 0.942 -7.743 0.861 1.00 0.00 H new ATOM 0 HA ASP A 61 2.617 -8.468 -1.473 1.00 0.00 H new ATOM 0 HB2 ASP A 61 3.369 -7.261 1.234 1.00 0.00 H new ATOM 0 HB3 ASP A 61 4.462 -7.519 -0.111 1.00 0.00 H new ATOM 933 N GLN A 62 3.156 -10.716 -0.598 1.00 0.00 N ATOM 934 CA GLN A 62 3.548 -12.035 -0.116 1.00 0.00 C ATOM 935 C GLN A 62 4.877 -11.958 0.627 1.00 0.00 C ATOM 936 O GLN A 62 5.114 -12.706 1.575 1.00 0.00 O ATOM 937 CB GLN A 62 3.668 -13.017 -1.288 1.00 0.00 C ATOM 938 CG GLN A 62 3.988 -14.426 -0.755 1.00 0.00 C ATOM 939 CD GLN A 62 5.483 -14.552 -0.474 1.00 0.00 C ATOM 940 OE1 GLN A 62 6.295 -13.891 -1.121 1.00 0.00 O ATOM 941 NE2 GLN A 62 5.897 -15.364 0.460 1.00 0.00 N ATOM 0 H GLN A 62 3.106 -10.633 -1.613 1.00 0.00 H new ATOM 0 HA GLN A 62 2.779 -12.391 0.570 1.00 0.00 H new ATOM 0 HB2 GLN A 62 2.738 -13.035 -1.856 1.00 0.00 H new ATOM 0 HB3 GLN A 62 4.452 -12.689 -1.971 1.00 0.00 H new ATOM 0 HG2 GLN A 62 3.421 -14.616 0.156 1.00 0.00 H new ATOM 0 HG3 GLN A 62 3.682 -15.177 -1.483 1.00 0.00 H new ATOM 0 HE21 GLN A 62 5.223 -15.911 0.996 1.00 0.00 H new ATOM 0 HE22 GLN A 62 6.894 -15.451 0.655 1.00 0.00 H new ATOM 950 N ARG A 63 5.747 -11.057 0.184 1.00 0.00 N ATOM 951 CA ARG A 63 7.059 -10.902 0.801 1.00 0.00 C ATOM 952 C ARG A 63 6.922 -10.563 2.283 1.00 0.00 C ATOM 953 O ARG A 63 7.788 -10.901 3.090 1.00 0.00 O ATOM 954 CB ARG A 63 7.840 -9.794 0.093 1.00 0.00 C ATOM 955 CG ARG A 63 9.300 -9.840 0.537 1.00 0.00 C ATOM 956 CD ARG A 63 10.080 -8.720 -0.155 1.00 0.00 C ATOM 957 NE ARG A 63 9.646 -7.421 0.344 1.00 0.00 N ATOM 958 CZ ARG A 63 10.148 -6.294 -0.150 1.00 0.00 C ATOM 959 NH1 ARG A 63 11.046 -6.338 -1.096 1.00 0.00 N ATOM 960 NH2 ARG A 63 9.743 -5.143 0.311 1.00 0.00 N ATOM 0 H ARG A 63 5.569 -10.425 -0.597 1.00 0.00 H new ATOM 0 HA ARG A 63 7.597 -11.845 0.706 1.00 0.00 H new ATOM 0 HB2 ARG A 63 7.773 -9.920 -0.988 1.00 0.00 H new ATOM 0 HB3 ARG A 63 7.407 -8.822 0.328 1.00 0.00 H new ATOM 0 HG2 ARG A 63 9.366 -9.728 1.619 1.00 0.00 H new ATOM 0 HG3 ARG A 63 9.736 -10.808 0.289 1.00 0.00 H new ATOM 0 HD2 ARG A 63 11.148 -8.847 0.022 1.00 0.00 H new ATOM 0 HD3 ARG A 63 9.927 -8.773 -1.233 1.00 0.00 H new ATOM 0 HE ARG A 63 8.946 -7.376 1.084 1.00 0.00 H new ATOM 0 HH11 ARG A 63 11.363 -7.238 -1.457 1.00 0.00 H new ATOM 0 HH12 ARG A 63 11.431 -5.473 -1.475 1.00 0.00 H new ATOM 0 HH21 ARG A 63 9.041 -5.108 1.050 1.00 0.00 H new ATOM 0 HH22 ARG A 63 10.128 -4.278 -0.068 1.00 0.00 H new ATOM 974 N SER A 64 5.831 -9.893 2.634 1.00 0.00 N ATOM 975 CA SER A 64 5.593 -9.509 4.023 1.00 0.00 C ATOM 976 C SER A 64 5.512 -10.742 4.920 1.00 0.00 C ATOM 977 O SER A 64 5.782 -10.666 6.119 1.00 0.00 O ATOM 978 CB SER A 64 4.294 -8.715 4.127 1.00 0.00 C ATOM 979 OG SER A 64 4.441 -7.481 3.439 1.00 0.00 O ATOM 0 H SER A 64 5.101 -9.605 1.982 1.00 0.00 H new ATOM 0 HA SER A 64 6.427 -8.890 4.355 1.00 0.00 H new ATOM 0 HB2 SER A 64 3.470 -9.287 3.700 1.00 0.00 H new ATOM 0 HB3 SER A 64 4.048 -8.534 5.173 1.00 0.00 H new ATOM 0 HG SER A 64 3.607 -6.970 3.503 1.00 0.00 H new ATOM 985 N THR A 65 5.140 -11.874 4.332 1.00 0.00 N ATOM 986 CA THR A 65 5.021 -13.114 5.091 1.00 0.00 C ATOM 987 C THR A 65 6.374 -13.518 5.671 1.00 0.00 C ATOM 988 O THR A 65 6.444 -14.219 6.681 1.00 0.00 O ATOM 989 CB THR A 65 4.500 -14.232 4.186 1.00 0.00 C ATOM 990 OG1 THR A 65 5.425 -14.454 3.130 1.00 0.00 O ATOM 991 CG2 THR A 65 3.145 -13.829 3.604 1.00 0.00 C ATOM 0 H THR A 65 4.917 -11.959 3.340 1.00 0.00 H new ATOM 0 HA THR A 65 4.320 -12.951 5.909 1.00 0.00 H new ATOM 0 HB THR A 65 4.385 -15.147 4.767 1.00 0.00 H new ATOM 0 HG1 THR A 65 5.515 -13.637 2.597 1.00 0.00 H new ATOM 0 HG21 THR A 65 2.774 -14.626 2.959 1.00 0.00 H new ATOM 0 HG22 THR A 65 2.437 -13.659 4.415 1.00 0.00 H new ATOM 0 HG23 THR A 65 3.257 -12.914 3.022 1.00 0.00 H new ATOM 999 N ILE A 66 7.446 -13.070 5.026 1.00 0.00 N ATOM 1000 CA ILE A 66 8.793 -13.386 5.485 1.00 0.00 C ATOM 1001 C ILE A 66 9.023 -12.823 6.884 1.00 0.00 C ATOM 1002 O ILE A 66 9.661 -13.462 7.721 1.00 0.00 O ATOM 1003 CB ILE A 66 9.830 -12.803 4.521 1.00 0.00 C ATOM 1004 CG1 ILE A 66 9.730 -13.520 3.168 1.00 0.00 C ATOM 1005 CG2 ILE A 66 11.237 -13.000 5.098 1.00 0.00 C ATOM 1006 CD1 ILE A 66 10.599 -12.796 2.132 1.00 0.00 C ATOM 0 H ILE A 66 7.409 -12.490 4.188 1.00 0.00 H new ATOM 0 HA ILE A 66 8.901 -14.470 5.516 1.00 0.00 H new ATOM 0 HB ILE A 66 9.639 -11.738 4.386 1.00 0.00 H new ATOM 0 HG12 ILE A 66 10.055 -14.555 3.270 1.00 0.00 H new ATOM 0 HG13 ILE A 66 8.693 -13.543 2.834 1.00 0.00 H new ATOM 0 HG21 ILE A 66 11.974 -12.584 4.410 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.310 -12.492 6.059 1.00 0.00 H new ATOM 0 HG23 ILE A 66 11.428 -14.064 5.235 1.00 0.00 H new ATOM 0 HD11 ILE A 66 10.525 -13.309 1.173 1.00 0.00 H new ATOM 0 HD12 ILE A 66 10.253 -11.768 2.022 1.00 0.00 H new ATOM 0 HD13 ILE A 66 11.637 -12.796 2.464 1.00 0.00 H new ATOM 1018 N LEU A 67 8.503 -11.624 7.129 1.00 0.00 N ATOM 1019 CA LEU A 67 8.675 -10.986 8.427 1.00 0.00 C ATOM 1020 C LEU A 67 8.169 -11.893 9.546 1.00 0.00 C ATOM 1021 O LEU A 67 8.868 -12.118 10.535 1.00 0.00 O ATOM 1022 CB LEU A 67 7.897 -9.664 8.456 1.00 0.00 C ATOM 1023 CG LEU A 67 8.687 -8.575 7.689 1.00 0.00 C ATOM 1024 CD1 LEU A 67 7.740 -7.448 7.291 1.00 0.00 C ATOM 1025 CD2 LEU A 67 9.813 -8.002 8.585 1.00 0.00 C ATOM 0 H LEU A 67 7.965 -11.081 6.454 1.00 0.00 H new ATOM 0 HA LEU A 67 9.737 -10.797 8.582 1.00 0.00 H new ATOM 0 HB2 LEU A 67 6.914 -9.800 8.004 1.00 0.00 H new ATOM 0 HB3 LEU A 67 7.734 -9.350 9.487 1.00 0.00 H new ATOM 0 HG LEU A 67 9.130 -9.020 6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 67 8.294 -6.680 6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 67 6.952 -7.844 6.651 1.00 0.00 H new ATOM 0 HD13 LEU A 67 7.296 -7.013 8.186 1.00 0.00 H new ATOM 0 HD21 LEU A 67 10.362 -7.237 8.035 1.00 0.00 H new ATOM 0 HD22 LEU A 67 9.376 -7.562 9.481 1.00 0.00 H new ATOM 0 HD23 LEU A 67 10.495 -8.803 8.870 1.00 0.00 H new ATOM 1037 N ALA A 68 6.959 -12.415 9.383 1.00 0.00 N ATOM 1038 CA ALA A 68 6.380 -13.300 10.383 1.00 0.00 C ATOM 1039 C ALA A 68 7.195 -14.580 10.511 1.00 0.00 C ATOM 1040 O ALA A 68 7.396 -15.093 11.610 1.00 0.00 O ATOM 1041 CB ALA A 68 4.940 -13.648 10.003 1.00 0.00 C ATOM 0 H ALA A 68 6.364 -12.242 8.573 1.00 0.00 H new ATOM 0 HA ALA A 68 6.390 -12.782 11.342 1.00 0.00 H new ATOM 0 HB1 ALA A 68 4.515 -14.311 10.757 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.348 -12.735 9.947 1.00 0.00 H new ATOM 0 HB3 ALA A 68 4.930 -14.147 9.034 1.00 0.00 H new ATOM 1047 N VAL A 69 7.657 -15.089 9.375 1.00 0.00 N ATOM 1048 CA VAL A 69 8.448 -16.312 9.360 1.00 0.00 C ATOM 1049 C VAL A 69 9.803 -16.091 10.038 1.00 0.00 C ATOM 1050 O VAL A 69 10.377 -17.003 10.621 1.00 0.00 O ATOM 1051 CB VAL A 69 8.658 -16.789 7.916 1.00 0.00 C ATOM 1052 CG1 VAL A 69 9.643 -17.966 7.899 1.00 0.00 C ATOM 1053 CG2 VAL A 69 7.315 -17.240 7.325 1.00 0.00 C ATOM 0 H VAL A 69 7.498 -14.675 8.456 1.00 0.00 H new ATOM 0 HA VAL A 69 7.904 -17.077 9.914 1.00 0.00 H new ATOM 0 HB VAL A 69 9.062 -15.970 7.321 1.00 0.00 H new ATOM 0 HG11 VAL A 69 9.790 -18.303 6.873 1.00 0.00 H new ATOM 0 HG12 VAL A 69 10.598 -17.647 8.317 1.00 0.00 H new ATOM 0 HG13 VAL A 69 9.241 -18.785 8.495 1.00 0.00 H new ATOM 0 HG21 VAL A 69 7.464 -17.579 6.300 1.00 0.00 H new ATOM 0 HG22 VAL A 69 6.911 -18.057 7.922 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.615 -16.404 7.333 1.00 0.00 H new ATOM 1063 N ASP A 70 10.330 -14.881 9.928 1.00 0.00 N ATOM 1064 CA ASP A 70 11.618 -14.554 10.534 1.00 0.00 C ATOM 1065 C ASP A 70 11.448 -13.994 11.953 1.00 0.00 C ATOM 1066 O ASP A 70 12.417 -13.882 12.703 1.00 0.00 O ATOM 1067 CB ASP A 70 12.344 -13.525 9.665 1.00 0.00 C ATOM 1068 CG ASP A 70 12.770 -14.163 8.348 1.00 0.00 C ATOM 1069 OD1 ASP A 70 12.758 -15.381 8.271 1.00 0.00 O ATOM 1070 OD2 ASP A 70 13.102 -13.426 7.434 1.00 0.00 O ATOM 0 H ASP A 70 9.890 -14.109 9.427 1.00 0.00 H new ATOM 0 HA ASP A 70 12.203 -15.472 10.600 1.00 0.00 H new ATOM 0 HB2 ASP A 70 11.691 -12.674 9.472 1.00 0.00 H new ATOM 0 HB3 ASP A 70 13.218 -13.143 10.193 1.00 0.00 H new ATOM 1075 N ASN A 71 10.209 -13.618 12.309 1.00 0.00 N ATOM 1076 CA ASN A 71 9.933 -13.036 13.638 1.00 0.00 C ATOM 1077 C ASN A 71 8.954 -13.870 14.488 1.00 0.00 C ATOM 1078 O ASN A 71 9.265 -14.256 15.615 1.00 0.00 O ATOM 1079 CB ASN A 71 9.326 -11.646 13.434 1.00 0.00 C ATOM 1080 CG ASN A 71 9.354 -10.866 14.744 1.00 0.00 C ATOM 1081 OD1 ASN A 71 8.237 -10.423 15.253 1.00 0.00 O flip ATOM 1082 ND2 ASN A 71 10.421 -10.655 15.319 1.00 0.00 N flip ATOM 0 H ASN A 71 9.391 -13.704 11.706 1.00 0.00 H new ATOM 0 HA ASN A 71 10.879 -13.006 14.178 1.00 0.00 H new ATOM 0 HB2 ASN A 71 9.883 -11.106 12.668 1.00 0.00 H new ATOM 0 HB3 ASN A 71 8.300 -11.737 13.078 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.293 -11.002 14.920 1.00 0.00 H new ATOM 0 HD22 ASN A 71 10.434 -10.133 16.195 1.00 0.00 H new ATOM 1089 N LEU A 72 7.773 -14.150 13.937 1.00 0.00 N ATOM 1090 CA LEU A 72 6.741 -14.917 14.664 1.00 0.00 C ATOM 1091 C LEU A 72 6.863 -16.431 14.427 1.00 0.00 C ATOM 1092 O LEU A 72 5.901 -17.176 14.600 1.00 0.00 O ATOM 1093 CB LEU A 72 5.338 -14.406 14.236 1.00 0.00 C ATOM 1094 CG LEU A 72 4.814 -13.369 15.248 1.00 0.00 C ATOM 1095 CD1 LEU A 72 5.715 -12.132 15.230 1.00 0.00 C ATOM 1096 CD2 LEU A 72 3.386 -12.962 14.878 1.00 0.00 C ATOM 0 H LEU A 72 7.501 -13.863 12.997 1.00 0.00 H new ATOM 0 HA LEU A 72 6.886 -14.759 15.733 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.394 -13.959 13.243 1.00 0.00 H new ATOM 0 HB3 LEU A 72 4.643 -15.243 14.170 1.00 0.00 H new ATOM 0 HG LEU A 72 4.819 -13.809 16.245 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.342 -11.400 15.947 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.732 -12.418 15.499 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.714 -11.695 14.231 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.019 -12.229 15.596 1.00 0.00 H new ATOM 0 HD22 LEU A 72 3.379 -12.526 13.879 1.00 0.00 H new ATOM 0 HD23 LEU A 72 2.741 -13.841 14.895 1.00 0.00 H new ATOM 1108 N ASN A 73 8.038 -16.879 14.022 1.00 0.00 N ATOM 1109 CA ASN A 73 8.268 -18.306 13.786 1.00 0.00 C ATOM 1110 C ASN A 73 8.654 -19.010 15.087 1.00 0.00 C ATOM 1111 O ASN A 73 9.765 -18.828 15.589 1.00 0.00 O ATOM 1112 CB ASN A 73 9.370 -18.494 12.747 1.00 0.00 C ATOM 1113 CG ASN A 73 9.869 -19.940 12.745 1.00 0.00 C ATOM 1114 OD1 ASN A 73 9.118 -20.859 12.421 1.00 0.00 O ATOM 1115 ND2 ASN A 73 11.100 -20.191 13.096 1.00 0.00 N ATOM 0 H ASN A 73 8.848 -16.284 13.848 1.00 0.00 H new ATOM 0 HA ASN A 73 7.344 -18.747 13.412 1.00 0.00 H new ATOM 0 HB2 ASN A 73 8.993 -18.233 11.758 1.00 0.00 H new ATOM 0 HB3 ASN A 73 10.198 -17.818 12.961 1.00 0.00 H new ATOM 0 HD21 ASN A 73 11.443 -21.152 13.102 1.00 0.00 H new ATOM 0 HD22 ASN A 73 11.720 -19.427 13.364 1.00 0.00 H new ATOM 1122 N GLY A 74 7.743 -19.814 15.623 1.00 0.00 N ATOM 1123 CA GLY A 74 8.018 -20.545 16.853 1.00 0.00 C ATOM 1124 C GLY A 74 7.948 -19.624 18.068 1.00 0.00 C ATOM 1125 O GLY A 74 8.204 -20.050 19.195 1.00 0.00 O ATOM 0 H GLY A 74 6.816 -19.975 15.229 1.00 0.00 H new ATOM 0 HA2 GLY A 74 7.299 -21.356 16.966 1.00 0.00 H new ATOM 0 HA3 GLY A 74 9.006 -21.001 16.795 1.00 0.00 H new ATOM 1129 N PHE A 75 7.602 -18.362 17.832 1.00 0.00 N ATOM 1130 CA PHE A 75 7.505 -17.389 18.918 1.00 0.00 C ATOM 1131 C PHE A 75 6.409 -17.784 19.895 1.00 0.00 C ATOM 1132 O PHE A 75 5.265 -18.003 19.500 1.00 0.00 O ATOM 1133 CB PHE A 75 7.206 -15.997 18.350 1.00 0.00 C ATOM 1134 CG PHE A 75 6.990 -15.021 19.487 1.00 0.00 C ATOM 1135 CD1 PHE A 75 8.043 -14.718 20.358 1.00 0.00 C ATOM 1136 CD2 PHE A 75 5.738 -14.420 19.667 1.00 0.00 C ATOM 1137 CE1 PHE A 75 7.844 -13.816 21.410 1.00 0.00 C ATOM 1138 CE2 PHE A 75 5.540 -13.518 20.718 1.00 0.00 C ATOM 1139 CZ PHE A 75 6.593 -13.216 21.591 1.00 0.00 C ATOM 0 H PHE A 75 7.386 -17.990 16.907 1.00 0.00 H new ATOM 0 HA PHE A 75 8.458 -17.369 19.447 1.00 0.00 H new ATOM 0 HB2 PHE A 75 8.033 -15.664 17.723 1.00 0.00 H new ATOM 0 HB3 PHE A 75 6.320 -16.034 17.716 1.00 0.00 H new ATOM 0 HD1 PHE A 75 9.009 -15.180 20.218 1.00 0.00 H new ATOM 0 HD2 PHE A 75 4.925 -14.653 18.995 1.00 0.00 H new ATOM 0 HE1 PHE A 75 8.657 -13.583 22.082 1.00 0.00 H new ATOM 0 HE2 PHE A 75 4.575 -13.054 20.856 1.00 0.00 H new ATOM 0 HZ PHE A 75 6.439 -12.521 22.403 1.00 0.00 H new ATOM 1149 N LYS A 76 6.768 -17.865 21.172 1.00 0.00 N ATOM 1150 CA LYS A 76 5.803 -18.230 22.194 1.00 0.00 C ATOM 1151 C LYS A 76 4.793 -17.106 22.374 1.00 0.00 C ATOM 1152 O LYS A 76 5.144 -16.005 22.798 1.00 0.00 O ATOM 1153 CB LYS A 76 6.521 -18.507 23.518 1.00 0.00 C ATOM 1154 CG LYS A 76 5.534 -19.113 24.529 1.00 0.00 C ATOM 1155 CD LYS A 76 6.313 -19.787 25.678 1.00 0.00 C ATOM 1156 CE LYS A 76 6.616 -21.245 25.313 1.00 0.00 C ATOM 1157 NZ LYS A 76 7.358 -21.898 26.429 1.00 0.00 N ATOM 0 H LYS A 76 7.710 -17.684 21.518 1.00 0.00 H new ATOM 0 HA LYS A 76 5.279 -19.133 21.882 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.354 -19.191 23.354 1.00 0.00 H new ATOM 0 HB3 LYS A 76 6.941 -17.583 23.915 1.00 0.00 H new ATOM 0 HG2 LYS A 76 4.882 -18.335 24.926 1.00 0.00 H new ATOM 0 HG3 LYS A 76 4.894 -19.843 24.034 1.00 0.00 H new ATOM 0 HD2 LYS A 76 7.242 -19.248 25.865 1.00 0.00 H new ATOM 0 HD3 LYS A 76 5.730 -19.746 26.598 1.00 0.00 H new ATOM 0 HE2 LYS A 76 5.688 -21.782 25.118 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.207 -21.286 24.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 7.562 -22.887 26.179 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 8.251 -21.392 26.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 6.779 -21.872 27.293 1.00 0.00 H new ATOM 1171 N ILE A 77 3.535 -17.388 22.048 1.00 0.00 N ATOM 1172 CA ILE A 77 2.480 -16.389 22.175 1.00 0.00 C ATOM 1173 C ILE A 77 1.179 -17.036 22.654 1.00 0.00 C ATOM 1174 O ILE A 77 0.756 -18.062 22.123 1.00 0.00 O ATOM 1175 CB ILE A 77 2.258 -15.700 20.810 1.00 0.00 C ATOM 1176 CG1 ILE A 77 1.484 -14.392 21.014 1.00 0.00 C ATOM 1177 CG2 ILE A 77 1.454 -16.626 19.884 1.00 0.00 C ATOM 1178 CD1 ILE A 77 1.534 -13.555 19.729 1.00 0.00 C ATOM 0 H ILE A 77 3.223 -18.293 21.696 1.00 0.00 H new ATOM 0 HA ILE A 77 2.784 -15.646 22.913 1.00 0.00 H new ATOM 0 HB ILE A 77 3.226 -15.486 20.357 1.00 0.00 H new ATOM 0 HG12 ILE A 77 0.449 -14.608 21.278 1.00 0.00 H new ATOM 0 HG13 ILE A 77 1.914 -13.829 21.843 1.00 0.00 H new ATOM 0 HG21 ILE A 77 1.300 -16.135 18.923 1.00 0.00 H new ATOM 0 HG22 ILE A 77 2.003 -17.556 19.733 1.00 0.00 H new ATOM 0 HG23 ILE A 77 0.488 -16.845 20.338 1.00 0.00 H new ATOM 0 HD11 ILE A 77 0.983 -12.626 19.878 1.00 0.00 H new ATOM 0 HD12 ILE A 77 2.571 -13.326 19.484 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.083 -14.117 18.911 1.00 0.00 H new ATOM 1190 N GLY A 78 0.549 -16.428 23.651 1.00 0.00 N ATOM 1191 CA GLY A 78 -0.703 -16.952 24.179 1.00 0.00 C ATOM 1192 C GLY A 78 -0.461 -18.224 24.980 1.00 0.00 C ATOM 1193 O GLY A 78 -1.378 -19.013 25.200 1.00 0.00 O ATOM 0 H GLY A 78 0.881 -15.578 24.107 1.00 0.00 H new ATOM 0 HA2 GLY A 78 -1.178 -16.203 24.812 1.00 0.00 H new ATOM 0 HA3 GLY A 78 -1.391 -17.158 23.359 1.00 0.00 H new ATOM 1197 N GLY A 79 0.780 -18.417 25.414 1.00 0.00 N ATOM 1198 CA GLY A 79 1.136 -19.599 26.192 1.00 0.00 C ATOM 1199 C GLY A 79 1.627 -20.724 25.284 1.00 0.00 C ATOM 1200 O GLY A 79 2.157 -21.727 25.761 1.00 0.00 O ATOM 0 H GLY A 79 1.553 -17.774 25.242 1.00 0.00 H new ATOM 0 HA2 GLY A 79 1.912 -19.344 26.913 1.00 0.00 H new ATOM 0 HA3 GLY A 79 0.271 -19.938 26.762 1.00 0.00 H new ATOM 1204 N ARG A 80 1.455 -20.549 23.971 1.00 0.00 N ATOM 1205 CA ARG A 80 1.892 -21.555 23.002 1.00 0.00 C ATOM 1206 C ARG A 80 2.578 -20.893 21.811 1.00 0.00 C ATOM 1207 O ARG A 80 2.307 -19.737 21.490 1.00 0.00 O ATOM 1208 CB ARG A 80 0.697 -22.367 22.516 1.00 0.00 C ATOM 1209 CG ARG A 80 0.056 -23.083 23.704 1.00 0.00 C ATOM 1210 CD ARG A 80 -1.015 -24.043 23.198 1.00 0.00 C ATOM 1211 NE ARG A 80 -1.697 -24.676 24.320 1.00 0.00 N ATOM 1212 CZ ARG A 80 -2.608 -25.623 24.124 1.00 0.00 C ATOM 1213 NH1 ARG A 80 -2.908 -26.001 22.912 1.00 0.00 N ATOM 1214 NH2 ARG A 80 -3.205 -26.176 25.146 1.00 0.00 N ATOM 0 H ARG A 80 1.019 -19.725 23.557 1.00 0.00 H new ATOM 0 HA ARG A 80 2.604 -22.217 23.494 1.00 0.00 H new ATOM 0 HB2 ARG A 80 -0.030 -21.713 22.035 1.00 0.00 H new ATOM 0 HB3 ARG A 80 1.016 -23.093 21.768 1.00 0.00 H new ATOM 0 HG2 ARG A 80 0.814 -23.629 24.266 1.00 0.00 H new ATOM 0 HG3 ARG A 80 -0.384 -22.356 24.386 1.00 0.00 H new ATOM 0 HD2 ARG A 80 -1.735 -23.504 22.583 1.00 0.00 H new ATOM 0 HD3 ARG A 80 -0.561 -24.804 22.563 1.00 0.00 H new ATOM 0 HE ARG A 80 -1.471 -24.387 25.272 1.00 0.00 H new ATOM 0 HH11 ARG A 80 -2.443 -25.569 22.113 1.00 0.00 H new ATOM 0 HH12 ARG A 80 -3.608 -26.728 22.763 1.00 0.00 H new ATOM 0 HH21 ARG A 80 -2.972 -25.881 26.094 1.00 0.00 H new ATOM 0 HH22 ARG A 80 -3.904 -26.903 24.996 1.00 0.00 H new ATOM 1228 N ALA A 81 3.468 -21.631 21.155 1.00 0.00 N ATOM 1229 CA ALA A 81 4.191 -21.101 19.997 1.00 0.00 C ATOM 1230 C ALA A 81 3.467 -21.447 18.702 1.00 0.00 C ATOM 1231 O ALA A 81 3.118 -22.602 18.468 1.00 0.00 O ATOM 1232 CB ALA A 81 5.606 -21.676 19.961 1.00 0.00 C ATOM 0 H ALA A 81 3.707 -22.592 21.401 1.00 0.00 H new ATOM 0 HA ALA A 81 4.239 -20.016 20.090 1.00 0.00 H new ATOM 0 HB1 ALA A 81 6.139 -21.278 19.097 1.00 0.00 H new ATOM 0 HB2 ALA A 81 6.135 -21.399 20.873 1.00 0.00 H new ATOM 0 HB3 ALA A 81 5.556 -22.762 19.887 1.00 0.00 H new ATOM 1238 N LEU A 82 3.246 -20.432 17.862 1.00 0.00 N ATOM 1239 CA LEU A 82 2.562 -20.630 16.586 1.00 0.00 C ATOM 1240 C LEU A 82 3.574 -21.027 15.501 1.00 0.00 C ATOM 1241 O LEU A 82 4.736 -20.618 15.534 1.00 0.00 O ATOM 1242 CB LEU A 82 1.811 -19.335 16.166 1.00 0.00 C ATOM 1243 CG LEU A 82 2.532 -18.095 16.733 1.00 0.00 C ATOM 1244 CD1 LEU A 82 3.979 -18.067 16.234 1.00 0.00 C ATOM 1245 CD2 LEU A 82 1.813 -16.823 16.273 1.00 0.00 C ATOM 0 H LEU A 82 3.530 -19.469 18.044 1.00 0.00 H new ATOM 0 HA LEU A 82 1.834 -21.433 16.703 1.00 0.00 H new ATOM 0 HB2 LEU A 82 1.761 -19.271 15.079 1.00 0.00 H new ATOM 0 HB3 LEU A 82 0.784 -19.366 16.531 1.00 0.00 H new ATOM 0 HG LEU A 82 2.523 -18.144 17.822 1.00 0.00 H new ATOM 0 HD11 LEU A 82 4.486 -17.190 16.636 1.00 0.00 H new ATOM 0 HD12 LEU A 82 4.495 -18.968 16.565 1.00 0.00 H new ATOM 0 HD13 LEU A 82 3.988 -18.023 15.145 1.00 0.00 H new ATOM 0 HD21 LEU A 82 2.326 -15.949 16.676 1.00 0.00 H new ATOM 0 HD22 LEU A 82 1.817 -16.776 15.184 1.00 0.00 H new ATOM 0 HD23 LEU A 82 0.784 -16.837 16.631 1.00 0.00 H new ATOM 1257 N LYS A 83 3.124 -21.825 14.535 1.00 0.00 N ATOM 1258 CA LYS A 83 3.998 -22.265 13.444 1.00 0.00 C ATOM 1259 C LYS A 83 3.692 -21.483 12.171 1.00 0.00 C ATOM 1260 O LYS A 83 2.576 -21.535 11.656 1.00 0.00 O ATOM 1261 CB LYS A 83 3.804 -23.762 13.191 1.00 0.00 C ATOM 1262 CG LYS A 83 4.739 -24.216 12.067 1.00 0.00 C ATOM 1263 CD LYS A 83 4.647 -25.734 11.909 1.00 0.00 C ATOM 1264 CE LYS A 83 5.459 -26.169 10.689 1.00 0.00 C ATOM 1265 NZ LYS A 83 6.897 -25.840 10.904 1.00 0.00 N ATOM 0 H LYS A 83 2.169 -22.179 14.483 1.00 0.00 H new ATOM 0 HA LYS A 83 5.033 -22.080 13.730 1.00 0.00 H new ATOM 0 HB2 LYS A 83 4.012 -24.325 14.101 1.00 0.00 H new ATOM 0 HB3 LYS A 83 2.768 -23.964 12.920 1.00 0.00 H new ATOM 0 HG2 LYS A 83 4.467 -23.725 11.133 1.00 0.00 H new ATOM 0 HG3 LYS A 83 5.765 -23.925 12.293 1.00 0.00 H new ATOM 0 HD2 LYS A 83 5.024 -26.227 12.805 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.606 -26.036 11.793 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.341 -27.240 10.524 1.00 0.00 H new ATOM 0 HE3 LYS A 83 5.090 -25.666 9.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 7.479 -26.364 10.220 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 7.043 -24.819 10.772 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 7.173 -26.107 11.870 1.00 0.00 H new ATOM 1279 N ILE A 84 4.692 -20.760 11.660 1.00 0.00 N ATOM 1280 CA ILE A 84 4.511 -19.962 10.441 1.00 0.00 C ATOM 1281 C ILE A 84 5.176 -20.653 9.252 1.00 0.00 C ATOM 1282 O ILE A 84 6.394 -20.834 9.227 1.00 0.00 O ATOM 1283 CB ILE A 84 5.124 -18.566 10.629 1.00 0.00 C ATOM 1284 CG1 ILE A 84 4.686 -17.993 11.995 1.00 0.00 C ATOM 1285 CG2 ILE A 84 4.638 -17.639 9.503 1.00 0.00 C ATOM 1286 CD1 ILE A 84 3.155 -17.972 12.098 1.00 0.00 C ATOM 0 H ILE A 84 5.627 -20.709 12.065 1.00 0.00 H new ATOM 0 HA ILE A 84 3.443 -19.865 10.247 1.00 0.00 H new ATOM 0 HB ILE A 84 6.211 -18.637 10.597 1.00 0.00 H new ATOM 0 HG12 ILE A 84 5.103 -18.597 12.801 1.00 0.00 H new ATOM 0 HG13 ILE A 84 5.079 -16.984 12.117 1.00 0.00 H new ATOM 0 HG21 ILE A 84 5.072 -16.648 9.635 1.00 0.00 H new ATOM 0 HG22 ILE A 84 4.946 -18.045 8.539 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.551 -17.566 9.535 1.00 0.00 H new ATOM 0 HD11 ILE A 84 2.861 -17.566 13.066 1.00 0.00 H new ATOM 0 HD12 ILE A 84 2.745 -17.349 11.303 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.770 -18.987 11.998 1.00 0.00 H new ATOM 1298 N ASP A 85 4.370 -21.038 8.260 1.00 0.00 N ATOM 1299 CA ASP A 85 4.896 -21.705 7.063 1.00 0.00 C ATOM 1300 C ASP A 85 4.116 -21.268 5.822 1.00 0.00 C ATOM 1301 O ASP A 85 3.006 -20.751 5.927 1.00 0.00 O ATOM 1302 CB ASP A 85 4.809 -23.233 7.224 1.00 0.00 C ATOM 1303 CG ASP A 85 5.890 -23.922 6.392 1.00 0.00 C ATOM 1304 OD1 ASP A 85 6.503 -23.250 5.579 1.00 0.00 O ATOM 1305 OD2 ASP A 85 6.091 -25.111 6.578 1.00 0.00 O ATOM 0 H ASP A 85 3.359 -20.902 8.259 1.00 0.00 H new ATOM 0 HA ASP A 85 5.941 -21.419 6.940 1.00 0.00 H new ATOM 0 HB2 ASP A 85 4.924 -23.501 8.274 1.00 0.00 H new ATOM 0 HB3 ASP A 85 3.824 -23.582 6.912 1.00 0.00 H new ATOM 1310 N HIS A 86 4.707 -21.481 4.647 1.00 0.00 N ATOM 1311 CA HIS A 86 4.059 -21.096 3.393 1.00 0.00 C ATOM 1312 C HIS A 86 3.175 -22.223 2.853 1.00 0.00 C ATOM 1313 O HIS A 86 3.602 -23.375 2.773 1.00 0.00 O ATOM 1314 CB HIS A 86 5.123 -20.750 2.349 1.00 0.00 C ATOM 1315 CG HIS A 86 5.984 -19.626 2.860 1.00 0.00 C ATOM 1316 ND1 HIS A 86 5.520 -18.323 2.955 1.00 0.00 N ATOM 1317 CD2 HIS A 86 7.281 -19.596 3.311 1.00 0.00 C ATOM 1318 CE1 HIS A 86 6.524 -17.570 3.444 1.00 0.00 C ATOM 1319 NE2 HIS A 86 7.619 -18.297 3.680 1.00 0.00 N ATOM 0 H HIS A 86 5.624 -21.914 4.537 1.00 0.00 H new ATOM 0 HA HIS A 86 3.430 -20.228 3.593 1.00 0.00 H new ATOM 0 HB2 HIS A 86 5.737 -21.625 2.137 1.00 0.00 H new ATOM 0 HB3 HIS A 86 4.647 -20.460 1.412 1.00 0.00 H new ATOM 0 HD2 HIS A 86 7.939 -20.451 3.370 1.00 0.00 H new ATOM 0 HE1 HIS A 86 6.452 -16.507 3.623 1.00 0.00 H new ATOM 0 HE2 HIS A 86 8.511 -17.971 4.051 1.00 0.00 H new ATOM 1328 N THR A 87 1.939 -21.885 2.477 1.00 0.00 N ATOM 1329 CA THR A 87 1.001 -22.878 1.933 1.00 0.00 C ATOM 1330 C THR A 87 0.230 -22.281 0.757 1.00 0.00 C ATOM 1331 O THR A 87 -0.106 -21.094 0.759 1.00 0.00 O ATOM 1332 CB THR A 87 0.021 -23.340 3.020 1.00 0.00 C ATOM 1333 OG1 THR A 87 -0.902 -24.264 2.461 1.00 0.00 O ATOM 1334 CG2 THR A 87 -0.737 -22.136 3.582 1.00 0.00 C ATOM 0 H THR A 87 1.564 -20.939 2.537 1.00 0.00 H new ATOM 0 HA THR A 87 1.570 -23.740 1.585 1.00 0.00 H new ATOM 0 HB THR A 87 0.577 -23.820 3.825 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.528 -24.561 3.154 1.00 0.00 H new ATOM 0 HG21 THR A 87 -1.431 -22.471 4.353 1.00 0.00 H new ATOM 0 HG22 THR A 87 -0.028 -21.429 4.014 1.00 0.00 H new ATOM 0 HG23 THR A 87 -1.292 -21.649 2.780 1.00 0.00 H new ATOM 1342 N PHE A 88 -0.049 -23.113 -0.254 1.00 0.00 N ATOM 1343 CA PHE A 88 -0.777 -22.655 -1.445 1.00 0.00 C ATOM 1344 C PHE A 88 -1.977 -23.555 -1.729 1.00 0.00 C ATOM 1345 O PHE A 88 -2.244 -23.905 -2.879 1.00 0.00 O ATOM 1346 CB PHE A 88 0.159 -22.655 -2.653 1.00 0.00 C ATOM 1347 CG PHE A 88 1.450 -21.959 -2.290 1.00 0.00 C ATOM 1348 CD1 PHE A 88 1.499 -20.561 -2.223 1.00 0.00 C ATOM 1349 CD2 PHE A 88 2.598 -22.713 -2.019 1.00 0.00 C ATOM 1350 CE1 PHE A 88 2.697 -19.918 -1.885 1.00 0.00 C ATOM 1351 CE2 PHE A 88 3.795 -22.069 -1.681 1.00 0.00 C ATOM 1352 CZ PHE A 88 3.844 -20.672 -1.614 1.00 0.00 C ATOM 0 H PHE A 88 0.215 -24.098 -0.272 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.138 -21.644 -1.259 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.362 -23.678 -2.970 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -0.315 -22.149 -3.494 1.00 0.00 H new ATOM 0 HD1 PHE A 88 0.614 -19.979 -2.432 1.00 0.00 H new ATOM 0 HD2 PHE A 88 2.561 -23.791 -2.071 1.00 0.00 H new ATOM 0 HE1 PHE A 88 2.735 -18.840 -1.834 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.681 -22.651 -1.472 1.00 0.00 H new ATOM 0 HZ PHE A 88 4.767 -20.176 -1.353 1.00 0.00 H new ATOM 1362 N TYR A 89 -2.695 -23.928 -0.677 1.00 0.00 N ATOM 1363 CA TYR A 89 -3.864 -24.788 -0.829 1.00 0.00 C ATOM 1364 C TYR A 89 -4.918 -24.091 -1.687 1.00 0.00 C ATOM 1365 O TYR A 89 -5.214 -22.914 -1.486 1.00 0.00 O ATOM 1366 CB TYR A 89 -4.447 -25.127 0.552 1.00 0.00 C ATOM 1367 CG TYR A 89 -5.223 -23.946 1.083 1.00 0.00 C ATOM 1368 CD1 TYR A 89 -4.554 -22.911 1.741 1.00 0.00 C ATOM 1369 CD2 TYR A 89 -6.612 -23.884 0.907 1.00 0.00 C ATOM 1370 CE1 TYR A 89 -5.273 -21.816 2.225 1.00 0.00 C ATOM 1371 CE2 TYR A 89 -7.328 -22.787 1.391 1.00 0.00 C ATOM 1372 CZ TYR A 89 -6.659 -21.753 2.051 1.00 0.00 C ATOM 1373 OH TYR A 89 -7.367 -20.670 2.531 1.00 0.00 O ATOM 0 H TYR A 89 -2.492 -23.652 0.284 1.00 0.00 H new ATOM 0 HA TYR A 89 -3.564 -25.712 -1.323 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -5.098 -25.998 0.478 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -3.644 -25.386 1.242 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -3.483 -22.958 1.875 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -7.128 -24.684 0.397 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -4.757 -21.016 2.735 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -8.398 -22.738 1.255 1.00 0.00 H new ATOM 0 HH TYR A 89 -8.032 -20.977 3.182 1.00 0.00 H new ATOM 2031 N PHE B 311 12.643 -4.417 6.590 1.00 0.00 N ATOM 2032 CA PHE B 311 11.659 -4.101 5.551 1.00 0.00 C ATOM 2033 C PHE B 311 11.100 -2.698 5.752 1.00 0.00 C ATOM 2034 O PHE B 311 11.534 -1.970 6.647 1.00 0.00 O ATOM 2035 CB PHE B 311 10.521 -5.117 5.579 1.00 0.00 C ATOM 2036 CG PHE B 311 11.040 -6.459 5.124 1.00 0.00 C ATOM 2037 CD1 PHE B 311 11.715 -7.291 6.023 1.00 0.00 C ATOM 2038 CD2 PHE B 311 10.838 -6.874 3.804 1.00 0.00 C ATOM 2039 CE1 PHE B 311 12.190 -8.537 5.605 1.00 0.00 C ATOM 2040 CE2 PHE B 311 11.315 -8.120 3.384 1.00 0.00 C ATOM 2041 CZ PHE B 311 11.989 -8.950 4.286 1.00 0.00 C ATOM 0 HA PHE B 311 12.157 -4.145 4.582 1.00 0.00 H new ATOM 0 HB2 PHE B 311 10.112 -5.195 6.586 1.00 0.00 H new ATOM 0 HB3 PHE B 311 9.709 -4.789 4.930 1.00 0.00 H new ATOM 0 HD1 PHE B 311 11.869 -6.970 7.042 1.00 0.00 H new ATOM 0 HD2 PHE B 311 10.314 -6.233 3.110 1.00 0.00 H new ATOM 0 HE1 PHE B 311 12.711 -9.179 6.300 1.00 0.00 H new ATOM 0 HE2 PHE B 311 11.163 -8.441 2.364 1.00 0.00 H new ATOM 0 HZ PHE B 311 12.355 -9.913 3.962 1.00 0.00 H new ATOM 2051 N ALA B 312 10.134 -2.316 4.911 1.00 0.00 N ATOM 2052 CA ALA B 312 9.517 -0.988 5.002 1.00 0.00 C ATOM 2053 C ALA B 312 7.997 -1.094 5.114 1.00 0.00 C ATOM 2054 O ALA B 312 7.263 -0.423 4.389 1.00 0.00 O ATOM 2055 CB ALA B 312 9.883 -0.159 3.769 1.00 0.00 C ATOM 0 H ALA B 312 9.764 -2.903 4.164 1.00 0.00 H new ATOM 0 HA ALA B 312 9.896 -0.499 5.900 1.00 0.00 H new ATOM 0 HB1 ALA B 312 9.422 0.826 3.843 1.00 0.00 H new ATOM 0 HB2 ALA B 312 10.966 -0.049 3.713 1.00 0.00 H new ATOM 0 HB3 ALA B 312 9.522 -0.662 2.872 1.00 0.00 H new ATOM 2061 N ILE B 313 7.531 -1.942 6.025 1.00 0.00 N ATOM 2062 CA ILE B 313 6.093 -2.121 6.221 1.00 0.00 C ATOM 2063 C ILE B 313 5.537 -0.988 7.081 1.00 0.00 C ATOM 2064 O ILE B 313 6.049 -0.712 8.165 1.00 0.00 O ATOM 2065 CB ILE B 313 5.823 -3.471 6.893 1.00 0.00 C ATOM 2066 CG1 ILE B 313 6.552 -4.588 6.116 1.00 0.00 C ATOM 2067 CG2 ILE B 313 4.318 -3.752 6.896 1.00 0.00 C ATOM 2068 CD1 ILE B 313 6.155 -4.560 4.629 1.00 0.00 C ATOM 0 H ILE B 313 8.119 -2.511 6.634 1.00 0.00 H new ATOM 0 HA ILE B 313 5.597 -2.102 5.250 1.00 0.00 H new ATOM 0 HB ILE B 313 6.188 -3.443 7.920 1.00 0.00 H new ATOM 0 HG12 ILE B 313 7.630 -4.462 6.213 1.00 0.00 H new ATOM 0 HG13 ILE B 313 6.305 -5.559 6.546 1.00 0.00 H new ATOM 0 HG21 ILE B 313 4.128 -4.713 7.374 1.00 0.00 H new ATOM 0 HG22 ILE B 313 3.802 -2.965 7.446 1.00 0.00 H new ATOM 0 HG23 ILE B 313 3.951 -3.779 5.870 1.00 0.00 H new ATOM 0 HD11 ILE B 313 6.679 -5.354 4.098 1.00 0.00 H new ATOM 0 HD12 ILE B 313 5.079 -4.710 4.537 1.00 0.00 H new ATOM 0 HD13 ILE B 313 6.425 -3.596 4.198 1.00 0.00 H new ATOM 2080 N MET B 314 4.485 -0.332 6.589 1.00 0.00 N ATOM 2081 CA MET B 314 3.871 0.777 7.323 1.00 0.00 C ATOM 2082 C MET B 314 2.766 0.269 8.277 1.00 0.00 C ATOM 2083 O MET B 314 1.774 -0.301 7.824 1.00 0.00 O ATOM 2084 CB MET B 314 3.282 1.791 6.335 1.00 0.00 C ATOM 2085 CG MET B 314 4.395 2.333 5.434 1.00 0.00 C ATOM 2086 SD MET B 314 5.569 3.288 6.429 1.00 0.00 S ATOM 2087 CE MET B 314 6.679 3.764 5.081 1.00 0.00 C ATOM 0 H MET B 314 4.043 -0.546 5.695 1.00 0.00 H new ATOM 0 HA MET B 314 4.643 1.259 7.923 1.00 0.00 H new ATOM 0 HB2 MET B 314 2.508 1.318 5.730 1.00 0.00 H new ATOM 0 HB3 MET B 314 2.808 2.609 6.877 1.00 0.00 H new ATOM 0 HG2 MET B 314 4.909 1.510 4.938 1.00 0.00 H new ATOM 0 HG3 MET B 314 3.970 2.962 4.652 1.00 0.00 H new ATOM 0 HE1 MET B 314 7.493 4.371 5.477 1.00 0.00 H new ATOM 0 HE2 MET B 314 7.089 2.869 4.614 1.00 0.00 H new ATOM 0 HE3 MET B 314 6.125 4.339 4.339 1.00 0.00 H new ATOM 2097 N PRO B 315 2.912 0.476 9.588 1.00 0.00 N ATOM 2098 CA PRO B 315 1.899 0.046 10.606 1.00 0.00 C ATOM 2099 C PRO B 315 0.496 0.557 10.270 1.00 0.00 C ATOM 2100 O PRO B 315 0.339 1.637 9.699 1.00 0.00 O ATOM 2101 CB PRO B 315 2.404 0.677 11.920 1.00 0.00 C ATOM 2102 CG PRO B 315 3.870 0.872 11.728 1.00 0.00 C ATOM 2103 CD PRO B 315 4.073 1.130 10.239 1.00 0.00 C ATOM 0 HA PRO B 315 1.808 -1.039 10.655 1.00 0.00 H new ATOM 0 HB2 PRO B 315 1.904 1.625 12.118 1.00 0.00 H new ATOM 0 HB3 PRO B 315 2.202 0.027 12.771 1.00 0.00 H new ATOM 0 HG2 PRO B 315 4.232 1.711 12.322 1.00 0.00 H new ATOM 0 HG3 PRO B 315 4.425 -0.009 12.050 1.00 0.00 H new ATOM 0 HD2 PRO B 315 4.101 2.198 10.021 1.00 0.00 H new ATOM 0 HD3 PRO B 315 5.015 0.708 9.888 1.00 0.00 H new ATOM 2111 N GLY B 316 -0.524 -0.228 10.624 1.00 0.00 N ATOM 2112 CA GLY B 316 -1.917 0.152 10.353 1.00 0.00 C ATOM 2113 C GLY B 316 -2.709 0.298 11.648 1.00 0.00 C ATOM 2114 O GLY B 316 -2.290 -0.184 12.698 1.00 0.00 O ATOM 0 H GLY B 316 -0.416 -1.126 11.096 1.00 0.00 H new ATOM 0 HA2 GLY B 316 -1.940 1.092 9.801 1.00 0.00 H new ATOM 0 HA3 GLY B 316 -2.386 -0.601 9.719 1.00 0.00 H new ATOM 2118 N SER B 317 -3.855 0.966 11.564 1.00 0.00 N ATOM 2119 CA SER B 317 -4.700 1.171 12.735 1.00 0.00 C ATOM 2120 C SER B 317 -5.147 -0.171 13.301 1.00 0.00 C ATOM 2121 O SER B 317 -5.251 -0.341 14.517 1.00 0.00 O ATOM 2122 CB SER B 317 -5.924 2.006 12.360 1.00 0.00 C ATOM 2123 OG SER B 317 -5.499 3.294 11.932 1.00 0.00 O ATOM 0 H SER B 317 -4.219 1.373 10.702 1.00 0.00 H new ATOM 0 HA SER B 317 -4.124 1.703 13.492 1.00 0.00 H new ATOM 0 HB2 SER B 317 -6.486 1.513 11.567 1.00 0.00 H new ATOM 0 HB3 SER B 317 -6.593 2.097 13.216 1.00 0.00 H new ATOM 0 HG SER B 317 -6.281 3.832 11.689 1.00 0.00 H new ATOM 2129 N ARG B 318 -5.413 -1.123 12.413 1.00 0.00 N ATOM 2130 CA ARG B 318 -5.848 -2.449 12.835 1.00 0.00 C ATOM 2131 C ARG B 318 -4.858 -3.039 13.838 1.00 0.00 C ATOM 2132 O ARG B 318 -5.202 -3.932 14.611 1.00 0.00 O ATOM 2133 CB ARG B 318 -5.964 -3.384 11.617 1.00 0.00 C ATOM 2134 CG ARG B 318 -6.806 -4.627 11.982 1.00 0.00 C ATOM 2135 CD ARG B 318 -8.285 -4.358 11.694 1.00 0.00 C ATOM 2136 NE ARG B 318 -9.118 -5.415 12.262 1.00 0.00 N ATOM 2137 CZ ARG B 318 -9.531 -5.365 13.526 1.00 0.00 C ATOM 2138 NH1 ARG B 318 -9.191 -4.356 14.282 1.00 0.00 N ATOM 2139 NH2 ARG B 318 -10.275 -6.320 14.012 1.00 0.00 N ATOM 0 H ARG B 318 -5.336 -1.002 11.403 1.00 0.00 H new ATOM 0 HA ARG B 318 -6.824 -2.355 13.310 1.00 0.00 H new ATOM 0 HB2 ARG B 318 -6.426 -2.854 10.784 1.00 0.00 H new ATOM 0 HB3 ARG B 318 -4.971 -3.691 11.288 1.00 0.00 H new ATOM 0 HG2 ARG B 318 -6.466 -5.489 11.408 1.00 0.00 H new ATOM 0 HG3 ARG B 318 -6.670 -4.872 13.035 1.00 0.00 H new ATOM 0 HD2 ARG B 318 -8.574 -3.394 12.114 1.00 0.00 H new ATOM 0 HD3 ARG B 318 -8.447 -4.298 10.618 1.00 0.00 H new ATOM 0 HE ARG B 318 -9.388 -6.207 11.678 1.00 0.00 H new ATOM 0 HH11 ARG B 318 -8.610 -3.608 13.903 1.00 0.00 H new ATOM 0 HH12 ARG B 318 -9.507 -4.316 15.251 1.00 0.00 H new ATOM 0 HH21 ARG B 318 -10.542 -7.109 13.423 1.00 0.00 H new ATOM 0 HH22 ARG B 318 -10.590 -6.278 14.981 1.00 0.00 H new ATOM 2153 N TRP B 319 -3.629 -2.536 13.817 1.00 0.00 N ATOM 2154 CA TRP B 319 -2.595 -3.020 14.724 1.00 0.00 C ATOM 2155 C TRP B 319 -2.973 -2.777 16.183 1.00 0.00 C ATOM 2156 O TRP B 319 -2.474 -3.439 17.091 1.00 0.00 O ATOM 2157 CB TRP B 319 -1.261 -2.332 14.419 1.00 0.00 C ATOM 2158 CG TRP B 319 -0.206 -2.856 15.340 1.00 0.00 C ATOM 2159 CD1 TRP B 319 -0.164 -4.110 15.849 1.00 0.00 C ATOM 2160 CD2 TRP B 319 0.958 -2.166 15.871 1.00 0.00 C ATOM 2161 NE1 TRP B 319 0.947 -4.230 16.656 1.00 0.00 N ATOM 2162 CE2 TRP B 319 1.669 -3.059 16.701 1.00 0.00 C ATOM 2163 CE3 TRP B 319 1.460 -0.863 15.713 1.00 0.00 C ATOM 2164 CZ2 TRP B 319 2.835 -2.681 17.354 1.00 0.00 C ATOM 2165 CZ3 TRP B 319 2.638 -0.474 16.369 1.00 0.00 C ATOM 2166 CH2 TRP B 319 3.324 -1.381 17.189 1.00 0.00 C ATOM 0 H TRP B 319 -3.325 -1.796 13.184 1.00 0.00 H new ATOM 0 HA TRP B 319 -2.497 -4.095 14.570 1.00 0.00 H new ATOM 0 HB2 TRP B 319 -0.976 -2.512 13.383 1.00 0.00 H new ATOM 0 HB3 TRP B 319 -1.360 -1.253 14.539 1.00 0.00 H new ATOM 0 HD1 TRP B 319 -0.885 -4.890 15.654 1.00 0.00 H new ATOM 0 HE1 TRP B 319 1.202 -5.081 17.157 1.00 0.00 H new ATOM 0 HE3 TRP B 319 0.937 -0.158 15.084 1.00 0.00 H new ATOM 0 HZ2 TRP B 319 3.359 -3.385 17.984 1.00 0.00 H new ATOM 0 HZ3 TRP B 319 3.018 0.529 16.242 1.00 0.00 H new ATOM 0 HH2 TRP B 319 4.229 -1.076 17.693 1.00 0.00 H new ATOM 2177 N ASP B 320 -3.843 -1.813 16.401 1.00 0.00 N ATOM 2178 CA ASP B 320 -4.284 -1.476 17.756 1.00 0.00 C ATOM 2179 C ASP B 320 -3.118 -0.926 18.585 1.00 0.00 C ATOM 2180 O ASP B 320 -3.316 -0.390 19.676 1.00 0.00 O ATOM 2181 CB ASP B 320 -4.862 -2.719 18.447 1.00 0.00 C ATOM 2182 CG ASP B 320 -5.797 -2.304 19.581 1.00 0.00 C ATOM 2183 OD1 ASP B 320 -5.832 -1.125 19.889 1.00 0.00 O ATOM 2184 OD2 ASP B 320 -6.462 -3.172 20.124 1.00 0.00 O ATOM 0 H ASP B 320 -4.263 -1.245 15.665 1.00 0.00 H new ATOM 0 HA ASP B 320 -5.055 -0.709 17.682 1.00 0.00 H new ATOM 0 HB2 ASP B 320 -5.404 -3.328 17.723 1.00 0.00 H new ATOM 0 HB3 ASP B 320 -4.053 -3.335 18.840 1.00 0.00 H new ATOM 2189 N GLY B 321 -1.902 -1.059 18.058 1.00 0.00 N ATOM 2190 CA GLY B 321 -0.716 -0.573 18.757 1.00 0.00 C ATOM 2191 C GLY B 321 -0.250 -1.567 19.825 1.00 0.00 C ATOM 2192 O GLY B 321 0.492 -1.207 20.739 1.00 0.00 O ATOM 0 H GLY B 321 -1.714 -1.496 17.156 1.00 0.00 H new ATOM 0 HA2 GLY B 321 0.087 -0.404 18.040 1.00 0.00 H new ATOM 0 HA3 GLY B 321 -0.935 0.388 19.223 1.00 0.00 H new ATOM 2196 N VAL B 322 -0.693 -2.820 19.707 1.00 0.00 N ATOM 2197 CA VAL B 322 -0.313 -3.860 20.667 1.00 0.00 C ATOM 2198 C VAL B 322 1.191 -4.101 20.623 1.00 0.00 C ATOM 2199 O VAL B 322 1.820 -3.927 19.585 1.00 0.00 O ATOM 2200 CB VAL B 322 -1.058 -5.172 20.356 1.00 0.00 C ATOM 2201 CG1 VAL B 322 -0.511 -5.790 19.061 1.00 0.00 C ATOM 2202 CG2 VAL B 322 -0.857 -6.159 21.507 1.00 0.00 C ATOM 0 H VAL B 322 -1.312 -3.139 18.961 1.00 0.00 H new ATOM 0 HA VAL B 322 -0.588 -3.522 21.666 1.00 0.00 H new ATOM 0 HB VAL B 322 -2.120 -4.958 20.235 1.00 0.00 H new ATOM 0 HG11 VAL B 322 -1.043 -6.717 18.848 1.00 0.00 H new ATOM 0 HG12 VAL B 322 -0.654 -5.092 18.236 1.00 0.00 H new ATOM 0 HG13 VAL B 322 0.552 -6.000 19.179 1.00 0.00 H new ATOM 0 HG21 VAL B 322 -1.384 -7.087 21.287 1.00 0.00 H new ATOM 0 HG22 VAL B 322 0.206 -6.366 21.628 1.00 0.00 H new ATOM 0 HG23 VAL B 322 -1.250 -5.729 22.428 1.00 0.00 H new ATOM 2212 N HIS B 323 1.759 -4.509 21.748 1.00 0.00 N ATOM 2213 CA HIS B 323 3.194 -4.774 21.814 1.00 0.00 C ATOM 2214 C HIS B 323 3.511 -6.168 21.270 1.00 0.00 C ATOM 2215 O HIS B 323 2.848 -7.146 21.616 1.00 0.00 O ATOM 2216 CB HIS B 323 3.670 -4.668 23.265 1.00 0.00 C ATOM 2217 CG HIS B 323 3.506 -3.251 23.747 1.00 0.00 C ATOM 2218 ND1 HIS B 323 3.664 -2.899 25.080 1.00 0.00 N ATOM 2219 CD2 HIS B 323 3.195 -2.085 23.089 1.00 0.00 C ATOM 2220 CE1 HIS B 323 3.452 -1.573 25.178 1.00 0.00 C ATOM 2221 NE2 HIS B 323 3.162 -1.029 23.993 1.00 0.00 N ATOM 0 H HIS B 323 1.256 -4.664 22.622 1.00 0.00 H new ATOM 0 HA HIS B 323 3.713 -4.036 21.203 1.00 0.00 H new ATOM 0 HB2 HIS B 323 3.097 -5.347 23.897 1.00 0.00 H new ATOM 0 HB3 HIS B 323 4.715 -4.969 23.339 1.00 0.00 H new ATOM 0 HD2 HIS B 323 3.005 -2.002 22.029 1.00 0.00 H new ATOM 0 HE1 HIS B 323 3.509 -1.017 26.102 1.00 0.00 H new ATOM 0 HE2 HIS B 323 2.960 -0.049 23.794 1.00 0.00 H new ATOM 2230 N ARG B 324 4.529 -6.253 20.409 1.00 0.00 N ATOM 2231 CA ARG B 324 4.930 -7.533 19.810 1.00 0.00 C ATOM 2232 C ARG B 324 6.455 -7.630 19.745 1.00 0.00 C ATOM 2233 O ARG B 324 7.140 -6.641 19.482 1.00 0.00 O ATOM 2234 CB ARG B 324 4.324 -7.684 18.384 1.00 0.00 C ATOM 2235 CG ARG B 324 4.124 -6.290 17.740 1.00 0.00 C ATOM 2236 CD ARG B 324 5.493 -5.634 17.445 1.00 0.00 C ATOM 2237 NE ARG B 324 5.876 -4.752 18.542 1.00 0.00 N ATOM 2238 CZ ARG B 324 7.006 -4.056 18.502 1.00 0.00 C ATOM 2239 NH1 ARG B 324 7.797 -4.151 17.468 1.00 0.00 N ATOM 2240 NH2 ARG B 324 7.328 -3.276 19.498 1.00 0.00 N ATOM 0 H ARG B 324 5.090 -5.455 20.111 1.00 0.00 H new ATOM 0 HA ARG B 324 4.550 -8.341 20.436 1.00 0.00 H new ATOM 0 HB2 ARG B 324 4.984 -8.289 17.762 1.00 0.00 H new ATOM 0 HB3 ARG B 324 3.370 -8.208 18.440 1.00 0.00 H new ATOM 0 HG2 ARG B 324 3.553 -6.387 16.817 1.00 0.00 H new ATOM 0 HG3 ARG B 324 3.544 -5.653 18.408 1.00 0.00 H new ATOM 0 HD2 ARG B 324 6.251 -6.405 17.307 1.00 0.00 H new ATOM 0 HD3 ARG B 324 5.440 -5.068 16.515 1.00 0.00 H new ATOM 0 HE ARG B 324 5.265 -4.668 19.354 1.00 0.00 H new ATOM 0 HH11 ARG B 324 7.547 -4.761 16.689 1.00 0.00 H new ATOM 0 HH12 ARG B 324 8.665 -3.616 17.439 1.00 0.00 H new ATOM 0 HH21 ARG B 324 6.711 -3.201 20.307 1.00 0.00 H new ATOM 0 HH22 ARG B 324 8.196 -2.741 19.467 1.00 0.00 H new ATOM 2254 N SER B 325 6.980 -8.826 19.981 1.00 0.00 N ATOM 2255 CA SER B 325 8.421 -9.040 19.932 1.00 0.00 C ATOM 2256 C SER B 325 8.734 -10.513 19.705 1.00 0.00 C ATOM 2257 O SER B 325 7.876 -11.375 19.904 1.00 0.00 O ATOM 2258 CB SER B 325 9.064 -8.569 21.237 1.00 0.00 C ATOM 2259 OG SER B 325 8.646 -9.418 22.298 1.00 0.00 O ATOM 0 H SER B 325 6.434 -9.657 20.207 1.00 0.00 H new ATOM 0 HA SER B 325 8.829 -8.464 19.102 1.00 0.00 H new ATOM 0 HB2 SER B 325 10.150 -8.586 21.148 1.00 0.00 H new ATOM 0 HB3 SER B 325 8.778 -7.538 21.446 1.00 0.00 H new ATOM 0 HG SER B 325 9.057 -9.121 23.136 1.00 0.00 H new ATOM 2286 N PHE B 328 15.206 -11.911 21.997 1.00 0.00 N ATOM 2287 CA PHE B 328 15.558 -10.993 23.073 1.00 0.00 C ATOM 2288 C PHE B 328 16.174 -9.714 22.503 1.00 0.00 C ATOM 2289 O PHE B 328 15.810 -8.610 22.899 1.00 0.00 O ATOM 2290 CB PHE B 328 16.547 -11.664 24.027 1.00 0.00 C ATOM 2291 CG PHE B 328 16.792 -10.766 25.216 1.00 0.00 C ATOM 2292 CD1 PHE B 328 15.853 -10.712 26.252 1.00 0.00 C ATOM 2293 CD2 PHE B 328 17.956 -9.989 25.282 1.00 0.00 C ATOM 2294 CE1 PHE B 328 16.078 -9.881 27.356 1.00 0.00 C ATOM 2295 CE2 PHE B 328 18.180 -9.159 26.386 1.00 0.00 C ATOM 2296 CZ PHE B 328 17.240 -9.104 27.424 1.00 0.00 C ATOM 0 HA PHE B 328 14.652 -10.732 23.619 1.00 0.00 H new ATOM 0 HB2 PHE B 328 16.153 -12.625 24.359 1.00 0.00 H new ATOM 0 HB3 PHE B 328 17.486 -11.866 23.511 1.00 0.00 H new ATOM 0 HD1 PHE B 328 14.956 -11.311 26.200 1.00 0.00 H new ATOM 0 HD2 PHE B 328 18.680 -10.031 24.481 1.00 0.00 H new ATOM 0 HE1 PHE B 328 15.354 -9.840 28.156 1.00 0.00 H new ATOM 0 HE2 PHE B 328 19.078 -8.561 26.438 1.00 0.00 H new ATOM 0 HZ PHE B 328 17.412 -8.463 28.276 1.00 0.00 H new ATOM 2306 N GLU B 329 17.107 -9.874 21.569 1.00 0.00 N ATOM 2307 CA GLU B 329 17.773 -8.729 20.943 1.00 0.00 C ATOM 2308 C GLU B 329 16.760 -7.847 20.207 1.00 0.00 C ATOM 2309 O GLU B 329 17.028 -6.677 19.915 1.00 0.00 O ATOM 2310 CB GLU B 329 18.843 -9.212 19.963 1.00 0.00 C ATOM 2311 CG GLU B 329 20.001 -9.840 20.741 1.00 0.00 C ATOM 2312 CD GLU B 329 20.989 -10.485 19.774 1.00 0.00 C ATOM 2313 OE1 GLU B 329 20.688 -10.531 18.593 1.00 0.00 O ATOM 2314 OE2 GLU B 329 22.032 -10.924 20.230 1.00 0.00 O ATOM 0 H GLU B 329 17.421 -10.782 21.227 1.00 0.00 H new ATOM 0 HA GLU B 329 18.244 -8.139 21.729 1.00 0.00 H new ATOM 0 HB2 GLU B 329 18.417 -9.940 19.273 1.00 0.00 H new ATOM 0 HB3 GLU B 329 19.205 -8.377 19.362 1.00 0.00 H new ATOM 0 HG2 GLU B 329 20.506 -9.079 21.336 1.00 0.00 H new ATOM 0 HG3 GLU B 329 19.620 -10.587 21.437 1.00 0.00 H new ATOM 2321 N GLU B 330 15.602 -8.418 19.899 1.00 0.00 N ATOM 2322 CA GLU B 330 14.562 -7.683 19.185 1.00 0.00 C ATOM 2323 C GLU B 330 14.339 -6.316 19.827 1.00 0.00 C ATOM 2324 O GLU B 330 14.068 -5.335 19.135 1.00 0.00 O ATOM 2325 CB GLU B 330 13.250 -8.475 19.207 1.00 0.00 C ATOM 2326 CG GLU B 330 12.236 -7.824 18.259 1.00 0.00 C ATOM 2327 CD GLU B 330 12.702 -7.972 16.814 1.00 0.00 C ATOM 2328 OE1 GLU B 330 13.558 -8.807 16.573 1.00 0.00 O ATOM 2329 OE2 GLU B 330 12.198 -7.249 15.970 1.00 0.00 O ATOM 0 H GLU B 330 15.359 -9.381 20.130 1.00 0.00 H new ATOM 0 HA GLU B 330 14.886 -7.544 18.153 1.00 0.00 H new ATOM 0 HB2 GLU B 330 13.432 -9.507 18.907 1.00 0.00 H new ATOM 0 HB3 GLU B 330 12.849 -8.504 20.220 1.00 0.00 H new ATOM 0 HG2 GLU B 330 11.258 -8.290 18.384 1.00 0.00 H new ATOM 0 HG3 GLU B 330 12.120 -6.769 18.506 1.00 0.00 H new ATOM 2336 N LYS B 331 14.454 -6.258 21.151 1.00 0.00 N ATOM 2337 CA LYS B 331 14.260 -5.001 21.869 1.00 0.00 C ATOM 2338 C LYS B 331 15.228 -3.942 21.350 1.00 0.00 C ATOM 2339 O LYS B 331 14.884 -2.766 21.247 1.00 0.00 O ATOM 2340 CB LYS B 331 14.483 -5.223 23.377 1.00 0.00 C ATOM 2341 CG LYS B 331 15.967 -5.505 23.657 1.00 0.00 C ATOM 2342 CD LYS B 331 16.167 -5.819 25.141 1.00 0.00 C ATOM 2343 CE LYS B 331 17.650 -6.071 25.413 1.00 0.00 C ATOM 2344 NZ LYS B 331 17.848 -6.353 26.863 1.00 0.00 N ATOM 0 H LYS B 331 14.678 -7.057 21.744 1.00 0.00 H new ATOM 0 HA LYS B 331 13.240 -4.654 21.704 1.00 0.00 H new ATOM 0 HB2 LYS B 331 14.161 -4.343 23.933 1.00 0.00 H new ATOM 0 HB3 LYS B 331 13.875 -6.059 23.723 1.00 0.00 H new ATOM 0 HG2 LYS B 331 16.307 -6.344 23.050 1.00 0.00 H new ATOM 0 HG3 LYS B 331 16.570 -4.642 23.375 1.00 0.00 H new ATOM 0 HD2 LYS B 331 15.810 -4.989 25.751 1.00 0.00 H new ATOM 0 HD3 LYS B 331 15.581 -6.695 25.421 1.00 0.00 H new ATOM 0 HE2 LYS B 331 18.002 -6.913 24.816 1.00 0.00 H new ATOM 0 HE3 LYS B 331 18.238 -5.202 25.117 1.00 0.00 H new ATOM 0 HZ1 LYS B 331 18.698 -5.857 27.200 1.00 0.00 H new ATOM 0 HZ2 LYS B 331 17.019 -6.022 27.397 1.00 0.00 H new ATOM 0 HZ3 LYS B 331 17.966 -7.377 27.005 1.00 0.00 H new ATOM 2358 N TRP B 332 16.445 -4.371 21.030 1.00 0.00 N ATOM 2359 CA TRP B 332 17.457 -3.455 20.526 1.00 0.00 C ATOM 2360 C TRP B 332 17.044 -2.905 19.169 1.00 0.00 C ATOM 2361 O TRP B 332 17.148 -1.704 18.914 1.00 0.00 O ATOM 2362 CB TRP B 332 18.801 -4.174 20.404 1.00 0.00 C ATOM 2363 CG TRP B 332 19.851 -3.196 19.985 1.00 0.00 C ATOM 2364 CD1 TRP B 332 20.585 -2.438 20.831 1.00 0.00 C ATOM 2365 CD2 TRP B 332 20.300 -2.859 18.637 1.00 0.00 C ATOM 2366 NE1 TRP B 332 21.454 -1.657 20.090 1.00 0.00 N ATOM 2367 CE2 TRP B 332 21.316 -1.880 18.734 1.00 0.00 C ATOM 2368 CE3 TRP B 332 19.926 -3.303 17.354 1.00 0.00 C ATOM 2369 CZ2 TRP B 332 21.942 -1.361 17.600 1.00 0.00 C ATOM 2370 CZ3 TRP B 332 20.553 -2.782 16.211 1.00 0.00 C ATOM 2371 CH2 TRP B 332 21.559 -1.813 16.333 1.00 0.00 C ATOM 0 H TRP B 332 16.751 -5.341 21.111 1.00 0.00 H new ATOM 0 HA TRP B 332 17.556 -2.627 21.228 1.00 0.00 H new ATOM 0 HB2 TRP B 332 19.071 -4.628 21.358 1.00 0.00 H new ATOM 0 HB3 TRP B 332 18.729 -4.982 19.675 1.00 0.00 H new ATOM 0 HD1 TRP B 332 20.506 -2.442 21.908 1.00 0.00 H new ATOM 0 HE1 TRP B 332 22.117 -0.996 20.496 1.00 0.00 H new ATOM 0 HE3 TRP B 332 19.152 -4.049 17.249 1.00 0.00 H new ATOM 0 HZ2 TRP B 332 22.717 -0.615 17.700 1.00 0.00 H new ATOM 0 HZ3 TRP B 332 20.259 -3.130 15.232 1.00 0.00 H new ATOM 0 HH2 TRP B 332 22.038 -1.416 15.450 1.00 0.00 H new ATOM 2382 N PHE B 333 16.576 -3.794 18.298 1.00 0.00 N ATOM 2383 CA PHE B 333 16.154 -3.386 16.963 1.00 0.00 C ATOM 2384 C PHE B 333 15.038 -2.341 17.059 1.00 0.00 C ATOM 2385 O PHE B 333 15.062 -1.323 16.366 1.00 0.00 O ATOM 2386 CB PHE B 333 15.660 -4.620 16.161 1.00 0.00 C ATOM 2387 CG PHE B 333 16.233 -4.589 14.754 1.00 0.00 C ATOM 2388 CD1 PHE B 333 16.126 -3.426 13.981 1.00 0.00 C ATOM 2389 CD2 PHE B 333 16.878 -5.716 14.233 1.00 0.00 C ATOM 2390 CE1 PHE B 333 16.661 -3.391 12.687 1.00 0.00 C ATOM 2391 CE2 PHE B 333 17.411 -5.683 12.939 1.00 0.00 C ATOM 2392 CZ PHE B 333 17.303 -4.520 12.166 1.00 0.00 C ATOM 0 H PHE B 333 16.480 -4.791 18.490 1.00 0.00 H new ATOM 0 HA PHE B 333 17.005 -2.945 16.444 1.00 0.00 H new ATOM 0 HB2 PHE B 333 15.963 -5.537 16.666 1.00 0.00 H new ATOM 0 HB3 PHE B 333 14.571 -4.624 16.119 1.00 0.00 H new ATOM 0 HD1 PHE B 333 15.630 -2.555 14.383 1.00 0.00 H new ATOM 0 HD2 PHE B 333 16.965 -6.612 14.830 1.00 0.00 H new ATOM 0 HE1 PHE B 333 16.578 -2.494 12.092 1.00 0.00 H new ATOM 0 HE2 PHE B 333 17.906 -6.555 12.537 1.00 0.00 H new ATOM 0 HZ PHE B 333 17.715 -4.495 11.168 1.00 0.00 H new ATOM 2402 N ALA B 334 14.060 -2.609 17.919 1.00 0.00 N ATOM 2403 CA ALA B 334 12.942 -1.692 18.100 1.00 0.00 C ATOM 2404 C ALA B 334 13.433 -0.353 18.637 1.00 0.00 C ATOM 2405 O ALA B 334 12.948 0.702 18.235 1.00 0.00 O ATOM 2406 CB ALA B 334 11.922 -2.289 19.071 1.00 0.00 C ATOM 0 H ALA B 334 14.019 -3.448 18.498 1.00 0.00 H new ATOM 0 HA ALA B 334 12.468 -1.534 17.131 1.00 0.00 H new ATOM 0 HB1 ALA B 334 11.091 -1.595 19.198 1.00 0.00 H new ATOM 0 HB2 ALA B 334 11.549 -3.232 18.672 1.00 0.00 H new ATOM 0 HB3 ALA B 334 12.398 -2.466 20.035 1.00 0.00 H new ATOM 2412 N LYS B 335 14.398 -0.402 19.549 1.00 0.00 N ATOM 2413 CA LYS B 335 14.936 0.816 20.141 1.00 0.00 C ATOM 2414 C LYS B 335 15.485 1.732 19.052 1.00 0.00 C ATOM 2415 O LYS B 335 15.251 2.940 19.073 1.00 0.00 O ATOM 2416 CB LYS B 335 16.058 0.474 21.141 1.00 0.00 C ATOM 2417 CG LYS B 335 16.566 1.759 21.839 1.00 0.00 C ATOM 2418 CD LYS B 335 15.529 2.245 22.867 1.00 0.00 C ATOM 2419 CE LYS B 335 16.173 3.254 23.819 1.00 0.00 C ATOM 2420 NZ LYS B 335 16.632 4.444 23.047 1.00 0.00 N ATOM 0 H LYS B 335 14.820 -1.265 19.892 1.00 0.00 H new ATOM 0 HA LYS B 335 14.131 1.328 20.669 1.00 0.00 H new ATOM 0 HB2 LYS B 335 15.688 -0.231 21.886 1.00 0.00 H new ATOM 0 HB3 LYS B 335 16.881 -0.015 20.621 1.00 0.00 H new ATOM 0 HG2 LYS B 335 17.517 1.562 22.335 1.00 0.00 H new ATOM 0 HG3 LYS B 335 16.748 2.537 21.098 1.00 0.00 H new ATOM 0 HD2 LYS B 335 14.683 2.704 22.355 1.00 0.00 H new ATOM 0 HD3 LYS B 335 15.138 1.398 23.431 1.00 0.00 H new ATOM 0 HE2 LYS B 335 15.457 3.557 24.583 1.00 0.00 H new ATOM 0 HE3 LYS B 335 17.016 2.795 24.336 1.00 0.00 H new ATOM 0 HZ1 LYS B 335 16.849 5.221 23.703 1.00 0.00 H new ATOM 0 HZ2 LYS B 335 17.486 4.199 22.506 1.00 0.00 H new ATOM 0 HZ3 LYS B 335 15.882 4.744 22.392 1.00 0.00 H new ATOM 2434 N GLN B 336 16.217 1.153 18.109 1.00 0.00 N ATOM 2435 CA GLN B 336 16.794 1.928 17.020 1.00 0.00 C ATOM 2436 C GLN B 336 15.696 2.542 16.159 1.00 0.00 C ATOM 2437 O GLN B 336 15.824 3.670 15.683 1.00 0.00 O ATOM 2438 CB GLN B 336 17.687 1.033 16.155 1.00 0.00 C ATOM 2439 CG GLN B 336 18.940 0.639 16.943 1.00 0.00 C ATOM 2440 CD GLN B 336 19.822 1.863 17.166 1.00 0.00 C ATOM 2441 OE1 GLN B 336 20.004 2.673 16.258 1.00 0.00 O ATOM 2442 NE2 GLN B 336 20.388 2.046 18.330 1.00 0.00 N ATOM 0 H GLN B 336 16.424 0.155 18.076 1.00 0.00 H new ATOM 0 HA GLN B 336 17.394 2.731 17.449 1.00 0.00 H new ATOM 0 HB2 GLN B 336 17.140 0.140 15.853 1.00 0.00 H new ATOM 0 HB3 GLN B 336 17.970 1.558 15.242 1.00 0.00 H new ATOM 0 HG2 GLN B 336 18.655 0.206 17.902 1.00 0.00 H new ATOM 0 HG3 GLN B 336 19.496 -0.126 16.400 1.00 0.00 H new ATOM 0 HE21 GLN B 336 20.236 1.374 19.082 1.00 0.00 H new ATOM 0 HE22 GLN B 336 20.981 2.861 18.486 1.00 0.00 H new ATOM 2451 N ASN B 337 14.615 1.789 15.956 1.00 0.00 N ATOM 2452 CA ASN B 337 13.500 2.271 15.141 1.00 0.00 C ATOM 2453 C ASN B 337 12.488 3.031 15.997 1.00 0.00 C ATOM 2454 O ASN B 337 11.507 3.569 15.483 1.00 0.00 O ATOM 2455 CB ASN B 337 12.809 1.090 14.461 1.00 0.00 C ATOM 2456 CG ASN B 337 13.782 0.387 13.525 1.00 0.00 C ATOM 2457 OD1 ASN B 337 14.600 1.037 12.876 1.00 0.00 O ATOM 2458 ND2 ASN B 337 13.741 -0.913 13.414 1.00 0.00 N ATOM 0 H ASN B 337 14.488 0.853 16.340 1.00 0.00 H new ATOM 0 HA ASN B 337 13.896 2.950 14.386 1.00 0.00 H new ATOM 0 HB2 ASN B 337 12.444 0.390 15.212 1.00 0.00 H new ATOM 0 HB3 ASN B 337 11.941 1.439 13.902 1.00 0.00 H new ATOM 0 HD21 ASN B 337 14.388 -1.392 12.788 1.00 0.00 H new ATOM 0 HD22 ASN B 337 13.062 -1.450 13.953 1.00 0.00 H new ATOM 2465 N GLU B 338 12.731 3.073 17.310 1.00 0.00 N ATOM 2466 CA GLU B 338 11.832 3.774 18.240 1.00 0.00 C ATOM 2467 C GLU B 338 12.592 4.813 19.047 1.00 0.00 C ATOM 2468 O GLU B 338 12.283 5.056 20.214 1.00 0.00 O ATOM 2469 CB GLU B 338 11.177 2.776 19.186 1.00 0.00 C ATOM 2470 CG GLU B 338 10.308 1.814 18.382 1.00 0.00 C ATOM 2471 CD GLU B 338 9.047 2.525 17.905 1.00 0.00 C ATOM 2472 OE1 GLU B 338 8.805 3.630 18.361 1.00 0.00 O ATOM 2473 OE2 GLU B 338 8.339 1.953 17.091 1.00 0.00 O ATOM 0 H GLU B 338 13.537 2.633 17.754 1.00 0.00 H new ATOM 0 HA GLU B 338 11.064 4.279 17.654 1.00 0.00 H new ATOM 0 HB2 GLU B 338 11.940 2.223 19.735 1.00 0.00 H new ATOM 0 HB3 GLU B 338 10.571 3.301 19.924 1.00 0.00 H new ATOM 0 HG2 GLU B 338 10.867 1.434 17.527 1.00 0.00 H new ATOM 0 HG3 GLU B 338 10.040 0.954 18.995 1.00 0.00 H new