USER MOD reduce.3.24.130724 H: found=0, std=0, add=948, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 949 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 18 GLN : amide:sc= -5.6! C(o=-19!,f=-20!) USER MOD Set 1.2: B 18 GLN : amide:sc= -6.93! C(o=-19!,f=-21!) USER MOD Set 1.3: C 18 GLN : amide:sc= -6.96! C(o=-19!,f=-21!) USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 27 THR OG1 : rot 85:sc= 0.0335 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=-0.071) USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=-0.0075) USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN :FLIP amide:sc= -0.0424 F(o=-1.9,f=-0.042) USER MOD Single : A 45 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0489) USER MOD Single : B 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 13 SER OG : rot 180:sc= 0 USER MOD Single : B 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : B 27 THR OG1 : rot 82:sc= 0.0499 USER MOD Single : B 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 ASN :FLIP amide:sc= -0.166 F(o=-2.2!,f=-0.17) USER MOD Single : B 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 11 CYS SG : rot 180:sc= 0 USER MOD Single : C 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 13 SER OG : rot 180:sc= 0 USER MOD Single : C 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 19 THR OG1 : rot 180:sc= 0 USER MOD Single : C 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 26 ASN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : C 27 THR OG1 : rot 85:sc= 0.0224 USER MOD Single : C 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 121 N GLU A 10 19.542 2.671 -13.065 1.00 0.00 N ATOM 122 CA GLU A 10 18.109 2.309 -13.250 1.00 0.00 C ATOM 123 C GLU A 10 17.255 3.570 -13.399 1.00 0.00 C ATOM 124 O GLU A 10 16.203 3.692 -12.804 1.00 0.00 O ATOM 125 CB GLU A 10 17.731 1.552 -11.977 1.00 0.00 C ATOM 126 CG GLU A 10 18.234 0.111 -12.072 1.00 0.00 C ATOM 127 CD GLU A 10 19.125 -0.200 -10.868 1.00 0.00 C ATOM 128 OE1 GLU A 10 20.319 0.029 -10.963 1.00 0.00 O ATOM 129 OE2 GLU A 10 18.596 -0.664 -9.870 1.00 0.00 O ATOM 0 HA GLU A 10 17.945 1.712 -14.147 1.00 0.00 H new ATOM 0 HB2 GLU A 10 18.165 2.043 -11.106 1.00 0.00 H new ATOM 0 HB3 GLU A 10 16.649 1.563 -11.842 1.00 0.00 H new ATOM 0 HG2 GLU A 10 17.390 -0.579 -12.101 1.00 0.00 H new ATOM 0 HG3 GLU A 10 18.793 -0.030 -12.997 1.00 0.00 H new ATOM 136 N CYS A 11 17.693 4.511 -14.189 1.00 0.00 N ATOM 137 CA CYS A 11 16.899 5.756 -14.372 1.00 0.00 C ATOM 138 C CYS A 11 15.436 5.413 -14.657 1.00 0.00 C ATOM 139 O CYS A 11 14.533 6.138 -14.288 1.00 0.00 O ATOM 140 CB CYS A 11 17.528 6.463 -15.573 1.00 0.00 C ATOM 141 SG CYS A 11 18.821 7.591 -15.004 1.00 0.00 S ATOM 0 H CYS A 11 18.566 4.471 -14.715 1.00 0.00 H new ATOM 0 HA CYS A 11 16.911 6.384 -13.481 1.00 0.00 H new ATOM 0 HB2 CYS A 11 17.948 5.729 -16.261 1.00 0.00 H new ATOM 0 HB3 CYS A 11 16.766 7.015 -16.123 1.00 0.00 H new ATOM 0 HG CYS A 11 19.356 8.189 -16.027 1.00 0.00 H new ATOM 146 N LYS A 12 15.196 4.311 -15.311 1.00 0.00 N ATOM 147 CA LYS A 12 13.792 3.919 -15.622 1.00 0.00 C ATOM 148 C LYS A 12 13.460 2.581 -14.960 1.00 0.00 C ATOM 149 O LYS A 12 12.325 2.157 -14.935 1.00 0.00 O ATOM 150 CB LYS A 12 13.743 3.785 -17.146 1.00 0.00 C ATOM 151 CG LYS A 12 14.487 4.956 -17.790 1.00 0.00 C ATOM 152 CD LYS A 12 14.020 6.266 -17.158 1.00 0.00 C ATOM 153 CE LYS A 12 13.667 7.270 -18.258 1.00 0.00 C ATOM 154 NZ LYS A 12 14.332 8.537 -17.847 1.00 0.00 N ATOM 0 H LYS A 12 15.911 3.664 -15.644 1.00 0.00 H new ATOM 0 HA LYS A 12 13.070 4.648 -15.253 1.00 0.00 H new ATOM 0 HB2 LYS A 12 14.195 2.842 -17.453 1.00 0.00 H new ATOM 0 HB3 LYS A 12 12.708 3.768 -17.486 1.00 0.00 H new ATOM 0 HG2 LYS A 12 15.562 4.837 -17.654 1.00 0.00 H new ATOM 0 HG3 LYS A 12 14.302 4.972 -18.864 1.00 0.00 H new ATOM 0 HD2 LYS A 12 13.152 6.086 -16.524 1.00 0.00 H new ATOM 0 HD3 LYS A 12 14.803 6.673 -16.518 1.00 0.00 H new ATOM 0 HE2 LYS A 12 14.026 6.933 -19.231 1.00 0.00 H new ATOM 0 HE3 LYS A 12 12.588 7.400 -18.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 14.137 9.276 -18.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 13.966 8.837 -16.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 15.359 8.385 -17.781 1.00 0.00 H new ATOM 168 N SER A 13 14.444 1.913 -14.426 1.00 0.00 N ATOM 169 CA SER A 13 14.187 0.598 -13.769 1.00 0.00 C ATOM 170 C SER A 13 13.614 0.810 -12.365 1.00 0.00 C ATOM 171 O SER A 13 12.826 0.027 -11.873 1.00 0.00 O ATOM 172 CB SER A 13 15.557 -0.073 -13.697 1.00 0.00 C ATOM 173 OG SER A 13 15.767 -0.844 -14.872 1.00 0.00 O ATOM 0 H SER A 13 15.417 2.220 -14.415 1.00 0.00 H new ATOM 0 HA SER A 13 13.463 -0.007 -14.315 1.00 0.00 H new ATOM 0 HB2 SER A 13 16.339 0.680 -13.599 1.00 0.00 H new ATOM 0 HB3 SER A 13 15.616 -0.711 -12.815 1.00 0.00 H new ATOM 0 HG SER A 13 16.647 -1.274 -14.828 1.00 0.00 H new ATOM 179 N ILE A 14 14.008 1.871 -11.724 1.00 0.00 N ATOM 180 CA ILE A 14 13.504 2.168 -10.354 1.00 0.00 C ATOM 181 C ILE A 14 12.113 2.780 -10.439 1.00 0.00 C ATOM 182 O ILE A 14 11.232 2.484 -9.654 1.00 0.00 O ATOM 183 CB ILE A 14 14.499 3.188 -9.807 1.00 0.00 C ATOM 184 CG1 ILE A 14 15.793 2.472 -9.433 1.00 0.00 C ATOM 185 CG2 ILE A 14 13.917 3.885 -8.572 1.00 0.00 C ATOM 186 CD1 ILE A 14 16.960 3.452 -9.539 1.00 0.00 C ATOM 0 H ILE A 14 14.667 2.556 -12.095 1.00 0.00 H new ATOM 0 HA ILE A 14 13.426 1.281 -9.725 1.00 0.00 H new ATOM 0 HB ILE A 14 14.701 3.940 -10.570 1.00 0.00 H new ATOM 0 HG12 ILE A 14 15.724 2.078 -8.419 1.00 0.00 H new ATOM 0 HG13 ILE A 14 15.956 1.621 -10.095 1.00 0.00 H new ATOM 0 HG21 ILE A 14 14.636 4.610 -8.191 1.00 0.00 H new ATOM 0 HG22 ILE A 14 12.994 4.397 -8.844 1.00 0.00 H new ATOM 0 HG23 ILE A 14 13.706 3.144 -7.801 1.00 0.00 H new ATOM 0 HD11 ILE A 14 17.887 2.944 -9.272 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.031 3.824 -10.561 1.00 0.00 H new ATOM 0 HD13 ILE A 14 16.796 4.288 -8.859 1.00 0.00 H new ATOM 198 N VAL A 15 11.907 3.622 -11.404 1.00 0.00 N ATOM 199 CA VAL A 15 10.574 4.255 -11.568 1.00 0.00 C ATOM 200 C VAL A 15 9.666 3.260 -12.282 1.00 0.00 C ATOM 201 O VAL A 15 8.453 3.330 -12.212 1.00 0.00 O ATOM 202 CB VAL A 15 10.815 5.517 -12.408 1.00 0.00 C ATOM 203 CG1 VAL A 15 9.737 6.555 -12.081 1.00 0.00 C ATOM 204 CG2 VAL A 15 12.192 6.112 -12.074 1.00 0.00 C ATOM 0 H VAL A 15 12.607 3.902 -12.091 1.00 0.00 H new ATOM 0 HA VAL A 15 10.096 4.522 -10.626 1.00 0.00 H new ATOM 0 HB VAL A 15 10.777 5.255 -13.465 1.00 0.00 H new ATOM 0 HG11 VAL A 15 9.904 7.453 -12.676 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.754 6.144 -12.313 1.00 0.00 H new ATOM 0 HG13 VAL A 15 9.784 6.807 -11.022 1.00 0.00 H new ATOM 0 HG21 VAL A 15 12.357 7.007 -12.674 1.00 0.00 H new ATOM 0 HG22 VAL A 15 12.229 6.372 -11.016 1.00 0.00 H new ATOM 0 HG23 VAL A 15 12.968 5.379 -12.295 1.00 0.00 H new ATOM 214 N LYS A 16 10.261 2.295 -12.928 1.00 0.00 N ATOM 215 CA LYS A 16 9.458 1.249 -13.605 1.00 0.00 C ATOM 216 C LYS A 16 8.873 0.367 -12.514 1.00 0.00 C ATOM 217 O LYS A 16 7.722 -0.021 -12.554 1.00 0.00 O ATOM 218 CB LYS A 16 10.453 0.477 -14.471 1.00 0.00 C ATOM 219 CG LYS A 16 9.886 -0.901 -14.799 1.00 0.00 C ATOM 220 CD LYS A 16 10.722 -1.979 -14.105 1.00 0.00 C ATOM 221 CE LYS A 16 10.940 -3.152 -15.063 1.00 0.00 C ATOM 222 NZ LYS A 16 10.820 -4.369 -14.213 1.00 0.00 N ATOM 0 H LYS A 16 11.272 2.189 -13.014 1.00 0.00 H new ATOM 0 HA LYS A 16 8.643 1.632 -14.219 1.00 0.00 H new ATOM 0 HB2 LYS A 16 10.653 1.027 -15.390 1.00 0.00 H new ATOM 0 HB3 LYS A 16 11.403 0.375 -13.947 1.00 0.00 H new ATOM 0 HG2 LYS A 16 8.848 -0.965 -14.473 1.00 0.00 H new ATOM 0 HG3 LYS A 16 9.892 -1.060 -15.877 1.00 0.00 H new ATOM 0 HD2 LYS A 16 11.682 -1.566 -13.795 1.00 0.00 H new ATOM 0 HD3 LYS A 16 10.216 -2.322 -13.203 1.00 0.00 H new ATOM 0 HE2 LYS A 16 10.198 -3.153 -15.861 1.00 0.00 H new ATOM 0 HE3 LYS A 16 11.919 -3.097 -15.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 10.958 -5.217 -14.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 11.543 -4.343 -13.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 9.875 -4.398 -13.779 1.00 0.00 H new ATOM 236 N PHE A 17 9.658 0.090 -11.507 1.00 0.00 N ATOM 237 CA PHE A 17 9.147 -0.720 -10.373 1.00 0.00 C ATOM 238 C PHE A 17 8.100 0.114 -9.633 1.00 0.00 C ATOM 239 O PHE A 17 7.155 -0.404 -9.072 1.00 0.00 O ATOM 240 CB PHE A 17 10.375 -0.994 -9.489 1.00 0.00 C ATOM 241 CG PHE A 17 9.959 -1.098 -8.037 1.00 0.00 C ATOM 242 CD1 PHE A 17 9.919 0.055 -7.243 1.00 0.00 C ATOM 243 CD2 PHE A 17 9.607 -2.337 -7.490 1.00 0.00 C ATOM 244 CE1 PHE A 17 9.528 -0.030 -5.903 1.00 0.00 C ATOM 245 CE2 PHE A 17 9.216 -2.422 -6.146 1.00 0.00 C ATOM 246 CZ PHE A 17 9.177 -1.268 -5.352 1.00 0.00 C ATOM 0 H PHE A 17 10.629 0.391 -11.424 1.00 0.00 H new ATOM 0 HA PHE A 17 8.677 -1.656 -10.675 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.860 -1.918 -9.803 1.00 0.00 H new ATOM 0 HB3 PHE A 17 11.105 -0.194 -9.610 1.00 0.00 H new ATOM 0 HD1 PHE A 17 10.190 1.011 -7.666 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.636 -3.226 -8.102 1.00 0.00 H new ATOM 0 HE1 PHE A 17 9.497 0.860 -5.293 1.00 0.00 H new ATOM 0 HE2 PHE A 17 8.945 -3.378 -5.722 1.00 0.00 H new ATOM 0 HZ PHE A 17 8.877 -1.334 -4.317 1.00 0.00 H new ATOM 256 N GLN A 18 8.266 1.410 -9.639 1.00 0.00 N ATOM 257 CA GLN A 18 7.280 2.286 -8.946 1.00 0.00 C ATOM 258 C GLN A 18 5.891 2.070 -9.546 1.00 0.00 C ATOM 259 O GLN A 18 4.909 1.954 -8.840 1.00 0.00 O ATOM 260 CB GLN A 18 7.765 3.714 -9.190 1.00 0.00 C ATOM 261 CG GLN A 18 8.904 4.034 -8.221 1.00 0.00 C ATOM 262 CD GLN A 18 9.167 5.539 -8.224 1.00 0.00 C ATOM 263 OE1 GLN A 18 8.520 6.279 -8.939 1.00 0.00 O ATOM 264 NE2 GLN A 18 10.095 6.028 -7.448 1.00 0.00 N ATOM 0 H GLN A 18 9.039 1.897 -10.092 1.00 0.00 H new ATOM 0 HA GLN A 18 7.206 2.071 -7.880 1.00 0.00 H new ATOM 0 HB2 GLN A 18 8.106 3.823 -10.219 1.00 0.00 H new ATOM 0 HB3 GLN A 18 6.945 4.418 -9.050 1.00 0.00 H new ATOM 0 HG2 GLN A 18 8.645 3.701 -7.216 1.00 0.00 H new ATOM 0 HG3 GLN A 18 9.806 3.496 -8.513 1.00 0.00 H new ATOM 0 HE21 GLN A 18 10.638 5.407 -6.848 1.00 0.00 H new ATOM 0 HE22 GLN A 18 10.278 7.031 -7.441 1.00 0.00 H new ATOM 273 N THR A 19 5.804 1.999 -10.844 1.00 0.00 N ATOM 274 CA THR A 19 4.478 1.769 -11.487 1.00 0.00 C ATOM 275 C THR A 19 3.870 0.478 -10.938 1.00 0.00 C ATOM 276 O THR A 19 2.676 0.375 -10.738 1.00 0.00 O ATOM 277 CB THR A 19 4.779 1.637 -12.981 1.00 0.00 C ATOM 278 OG1 THR A 19 4.961 2.930 -13.540 1.00 0.00 O ATOM 279 CG2 THR A 19 3.615 0.933 -13.682 1.00 0.00 C ATOM 0 H THR A 19 6.590 2.090 -11.487 1.00 0.00 H new ATOM 0 HA THR A 19 3.766 2.572 -11.294 1.00 0.00 H new ATOM 0 HB THR A 19 5.687 1.050 -13.118 1.00 0.00 H new ATOM 0 HG1 THR A 19 5.156 2.848 -14.497 1.00 0.00 H new ATOM 0 HG21 THR A 19 3.833 0.841 -14.746 1.00 0.00 H new ATOM 0 HG22 THR A 19 3.478 -0.059 -13.252 1.00 0.00 H new ATOM 0 HG23 THR A 19 2.703 1.515 -13.548 1.00 0.00 H new ATOM 287 N LYS A 20 4.688 -0.505 -10.675 1.00 0.00 N ATOM 288 CA LYS A 20 4.160 -1.779 -10.116 1.00 0.00 C ATOM 289 C LYS A 20 3.615 -1.503 -8.720 1.00 0.00 C ATOM 290 O LYS A 20 2.650 -2.096 -8.280 1.00 0.00 O ATOM 291 CB LYS A 20 5.362 -2.721 -10.059 1.00 0.00 C ATOM 292 CG LYS A 20 5.904 -2.941 -11.472 1.00 0.00 C ATOM 293 CD LYS A 20 5.793 -4.422 -11.840 1.00 0.00 C ATOM 294 CE LYS A 20 5.142 -4.558 -13.217 1.00 0.00 C ATOM 295 NZ LYS A 20 6.260 -4.391 -14.188 1.00 0.00 N ATOM 0 H LYS A 20 5.697 -0.480 -10.823 1.00 0.00 H new ATOM 0 HA LYS A 20 3.355 -2.211 -10.710 1.00 0.00 H new ATOM 0 HB2 LYS A 20 6.139 -2.299 -9.422 1.00 0.00 H new ATOM 0 HB3 LYS A 20 5.070 -3.674 -9.617 1.00 0.00 H new ATOM 0 HG2 LYS A 20 5.344 -2.336 -12.185 1.00 0.00 H new ATOM 0 HG3 LYS A 20 6.944 -2.619 -11.528 1.00 0.00 H new ATOM 0 HD2 LYS A 20 6.782 -4.881 -11.846 1.00 0.00 H new ATOM 0 HD3 LYS A 20 5.201 -4.950 -11.092 1.00 0.00 H new ATOM 0 HE2 LYS A 20 4.660 -5.529 -13.332 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.372 -3.801 -13.367 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 5.893 -4.472 -15.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.695 -3.455 -14.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.974 -5.130 -14.026 1.00 0.00 H new ATOM 309 N VAL A 21 4.222 -0.576 -8.032 1.00 0.00 N ATOM 310 CA VAL A 21 3.746 -0.213 -6.671 1.00 0.00 C ATOM 311 C VAL A 21 2.505 0.671 -6.807 1.00 0.00 C ATOM 312 O VAL A 21 1.719 0.802 -5.895 1.00 0.00 O ATOM 313 CB VAL A 21 4.918 0.559 -6.046 1.00 0.00 C ATOM 314 CG1 VAL A 21 4.402 1.634 -5.082 1.00 0.00 C ATOM 315 CG2 VAL A 21 5.812 -0.414 -5.279 1.00 0.00 C ATOM 0 H VAL A 21 5.034 -0.051 -8.358 1.00 0.00 H new ATOM 0 HA VAL A 21 3.467 -1.070 -6.058 1.00 0.00 H new ATOM 0 HB VAL A 21 5.484 1.041 -6.843 1.00 0.00 H new ATOM 0 HG11 VAL A 21 5.247 2.170 -4.649 1.00 0.00 H new ATOM 0 HG12 VAL A 21 3.767 2.334 -5.624 1.00 0.00 H new ATOM 0 HG13 VAL A 21 3.825 1.163 -4.286 1.00 0.00 H new ATOM 0 HG21 VAL A 21 6.645 0.131 -4.834 1.00 0.00 H new ATOM 0 HG22 VAL A 21 5.233 -0.897 -4.492 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.197 -1.171 -5.963 1.00 0.00 H new ATOM 325 N GLU A 22 2.333 1.275 -7.950 1.00 0.00 N ATOM 326 CA GLU A 22 1.148 2.148 -8.167 1.00 0.00 C ATOM 327 C GLU A 22 -0.107 1.285 -8.314 1.00 0.00 C ATOM 328 O GLU A 22 -1.123 1.530 -7.690 1.00 0.00 O ATOM 329 CB GLU A 22 1.454 2.896 -9.466 1.00 0.00 C ATOM 330 CG GLU A 22 2.183 4.201 -9.146 1.00 0.00 C ATOM 331 CD GLU A 22 1.235 5.152 -8.413 1.00 0.00 C ATOM 332 OE1 GLU A 22 1.045 4.967 -7.223 1.00 0.00 O ATOM 333 OE2 GLU A 22 0.716 6.051 -9.055 1.00 0.00 O ATOM 0 H GLU A 22 2.966 1.200 -8.746 1.00 0.00 H new ATOM 0 HA GLU A 22 0.965 2.833 -7.339 1.00 0.00 H new ATOM 0 HB2 GLU A 22 2.068 2.275 -10.119 1.00 0.00 H new ATOM 0 HB3 GLU A 22 0.529 3.106 -10.003 1.00 0.00 H new ATOM 0 HG2 GLU A 22 3.059 3.998 -8.530 1.00 0.00 H new ATOM 0 HG3 GLU A 22 2.540 4.665 -10.065 1.00 0.00 H new ATOM 340 N GLU A 23 -0.037 0.266 -9.126 1.00 0.00 N ATOM 341 CA GLU A 23 -1.219 -0.622 -9.308 1.00 0.00 C ATOM 342 C GLU A 23 -1.394 -1.510 -8.075 1.00 0.00 C ATOM 343 O GLU A 23 -2.495 -1.866 -7.706 1.00 0.00 O ATOM 344 CB GLU A 23 -0.898 -1.467 -10.542 1.00 0.00 C ATOM 345 CG GLU A 23 -0.462 -0.551 -11.687 1.00 0.00 C ATOM 346 CD GLU A 23 -1.116 -1.012 -12.991 1.00 0.00 C ATOM 347 OE1 GLU A 23 -1.513 -2.164 -13.058 1.00 0.00 O ATOM 348 OE2 GLU A 23 -1.209 -0.204 -13.900 1.00 0.00 O ATOM 0 H GLU A 23 0.787 0.010 -9.671 1.00 0.00 H new ATOM 0 HA GLU A 23 -2.146 -0.062 -9.435 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -0.107 -2.181 -10.312 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -1.773 -2.045 -10.838 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -0.746 0.479 -11.470 1.00 0.00 H new ATOM 0 HG3 GLU A 23 0.623 -0.568 -11.787 1.00 0.00 H new ATOM 355 N LEU A 24 -0.314 -1.863 -7.432 1.00 0.00 N ATOM 356 CA LEU A 24 -0.415 -2.719 -6.214 1.00 0.00 C ATOM 357 C LEU A 24 -1.073 -1.928 -5.083 1.00 0.00 C ATOM 358 O LEU A 24 -1.955 -2.414 -4.402 1.00 0.00 O ATOM 359 CB LEU A 24 1.031 -3.067 -5.858 1.00 0.00 C ATOM 360 CG LEU A 24 1.060 -4.348 -5.023 1.00 0.00 C ATOM 361 CD1 LEU A 24 0.309 -5.458 -5.759 1.00 0.00 C ATOM 362 CD2 LEU A 24 2.511 -4.777 -4.804 1.00 0.00 C ATOM 0 H LEU A 24 0.634 -1.596 -7.697 1.00 0.00 H new ATOM 0 HA LEU A 24 -1.018 -3.612 -6.376 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.618 -3.200 -6.767 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.486 -2.248 -5.302 1.00 0.00 H new ATOM 0 HG LEU A 24 0.582 -4.164 -4.061 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.331 -6.370 -5.162 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.725 -5.154 -5.919 1.00 0.00 H new ATOM 0 HD13 LEU A 24 0.785 -5.643 -6.722 1.00 0.00 H new ATOM 0 HD21 LEU A 24 2.535 -5.690 -4.209 1.00 0.00 H new ATOM 0 HD22 LEU A 24 2.986 -4.960 -5.768 1.00 0.00 H new ATOM 0 HD23 LEU A 24 3.048 -3.988 -4.279 1.00 0.00 H new ATOM 374 N ILE A 25 -0.659 -0.706 -4.884 1.00 0.00 N ATOM 375 CA ILE A 25 -1.269 0.120 -3.805 1.00 0.00 C ATOM 376 C ILE A 25 -2.763 0.299 -4.095 1.00 0.00 C ATOM 377 O ILE A 25 -3.583 0.276 -3.202 1.00 0.00 O ATOM 378 CB ILE A 25 -0.495 1.456 -3.837 1.00 0.00 C ATOM 379 CG1 ILE A 25 0.356 1.575 -2.567 1.00 0.00 C ATOM 380 CG2 ILE A 25 -1.449 2.655 -3.908 1.00 0.00 C ATOM 381 CD1 ILE A 25 1.089 0.256 -2.313 1.00 0.00 C ATOM 0 H ILE A 25 0.075 -0.245 -5.422 1.00 0.00 H new ATOM 0 HA ILE A 25 -1.201 -0.332 -2.816 1.00 0.00 H new ATOM 0 HB ILE A 25 0.135 1.462 -4.727 1.00 0.00 H new ATOM 0 HG12 ILE A 25 1.075 2.387 -2.674 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -0.277 1.820 -1.715 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -0.871 3.579 -3.929 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -2.055 2.585 -4.812 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -2.100 2.654 -3.034 1.00 0.00 H new ATOM 0 HD11 ILE A 25 1.693 0.343 -1.410 1.00 0.00 H new ATOM 0 HD12 ILE A 25 0.362 -0.546 -2.187 1.00 0.00 H new ATOM 0 HD13 ILE A 25 1.735 0.030 -3.161 1.00 0.00 H new ATOM 393 N ASN A 26 -3.121 0.464 -5.340 1.00 0.00 N ATOM 394 CA ASN A 26 -4.563 0.625 -5.683 1.00 0.00 C ATOM 395 C ASN A 26 -5.325 -0.636 -5.274 1.00 0.00 C ATOM 396 O ASN A 26 -6.403 -0.576 -4.717 1.00 0.00 O ATOM 397 CB ASN A 26 -4.592 0.808 -7.202 1.00 0.00 C ATOM 398 CG ASN A 26 -5.838 1.600 -7.601 1.00 0.00 C ATOM 399 OD1 ASN A 26 -6.896 1.414 -7.036 1.00 0.00 O ATOM 400 ND2 ASN A 26 -5.755 2.485 -8.556 1.00 0.00 N ATOM 0 H ASN A 26 -2.479 0.494 -6.132 1.00 0.00 H new ATOM 0 HA ASN A 26 -5.029 1.467 -5.170 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -3.695 1.332 -7.532 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -4.593 -0.164 -7.695 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.579 3.021 -8.828 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -4.866 2.641 -9.031 1.00 0.00 H new ATOM 407 N THR A 27 -4.758 -1.778 -5.542 1.00 0.00 N ATOM 408 CA THR A 27 -5.423 -3.060 -5.170 1.00 0.00 C ATOM 409 C THR A 27 -5.593 -3.143 -3.652 1.00 0.00 C ATOM 410 O THR A 27 -6.553 -3.694 -3.154 1.00 0.00 O ATOM 411 CB THR A 27 -4.465 -4.146 -5.661 1.00 0.00 C ATOM 412 OG1 THR A 27 -4.569 -4.269 -7.074 1.00 0.00 O ATOM 413 CG2 THR A 27 -4.817 -5.480 -5.005 1.00 0.00 C ATOM 0 H THR A 27 -3.856 -1.880 -6.006 1.00 0.00 H new ATOM 0 HA THR A 27 -6.417 -3.158 -5.606 1.00 0.00 H new ATOM 0 HB THR A 27 -3.444 -3.872 -5.394 1.00 0.00 H new ATOM 0 HG1 THR A 27 -3.982 -3.612 -7.504 1.00 0.00 H new ATOM 0 HG21 THR A 27 -4.132 -6.251 -5.358 1.00 0.00 H new ATOM 0 HG22 THR A 27 -4.732 -5.387 -3.922 1.00 0.00 H new ATOM 0 HG23 THR A 27 -5.839 -5.756 -5.266 1.00 0.00 H new ATOM 421 N LEU A 28 -4.669 -2.591 -2.912 1.00 0.00 N ATOM 422 CA LEU A 28 -4.784 -2.630 -1.426 1.00 0.00 C ATOM 423 C LEU A 28 -5.919 -1.705 -0.983 1.00 0.00 C ATOM 424 O LEU A 28 -6.748 -2.063 -0.169 1.00 0.00 O ATOM 425 CB LEU A 28 -3.436 -2.125 -0.907 1.00 0.00 C ATOM 426 CG LEU A 28 -2.435 -3.282 -0.877 1.00 0.00 C ATOM 427 CD1 LEU A 28 -1.026 -2.749 -1.134 1.00 0.00 C ATOM 428 CD2 LEU A 28 -2.477 -3.955 0.496 1.00 0.00 C ATOM 0 H LEU A 28 -3.841 -2.116 -3.272 1.00 0.00 H new ATOM 0 HA LEU A 28 -5.008 -3.626 -1.045 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.064 -1.325 -1.547 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -3.553 -1.705 0.092 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.697 -4.005 -1.649 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -0.315 -3.575 -1.112 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -0.992 -2.267 -2.111 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -0.765 -2.025 -0.363 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -1.764 -4.780 0.519 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.216 -3.228 1.265 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -3.480 -4.337 0.683 1.00 0.00 H new ATOM 440 N GLN A 29 -5.973 -0.527 -1.535 1.00 0.00 N ATOM 441 CA GLN A 29 -7.061 0.421 -1.179 1.00 0.00 C ATOM 442 C GLN A 29 -8.385 -0.122 -1.715 1.00 0.00 C ATOM 443 O GLN A 29 -9.453 0.326 -1.349 1.00 0.00 O ATOM 444 CB GLN A 29 -6.685 1.720 -1.887 1.00 0.00 C ATOM 445 CG GLN A 29 -7.283 2.910 -1.134 1.00 0.00 C ATOM 446 CD GLN A 29 -6.256 4.044 -1.082 1.00 0.00 C ATOM 447 OE1 GLN A 29 -5.872 4.579 -2.103 1.00 0.00 O ATOM 448 NE2 GLN A 29 -5.792 4.434 0.073 1.00 0.00 N ATOM 0 H GLN A 29 -5.305 -0.178 -2.222 1.00 0.00 H new ATOM 0 HA GLN A 29 -7.175 0.566 -0.105 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.601 1.817 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.052 1.705 -2.913 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -8.192 3.250 -1.631 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.564 2.612 -0.124 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.114 3.985 0.930 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.107 5.188 0.119 1.00 0.00 H new ATOM 457 N GLN A 30 -8.308 -1.096 -2.580 1.00 0.00 N ATOM 458 CA GLN A 30 -9.543 -1.698 -3.153 1.00 0.00 C ATOM 459 C GLN A 30 -10.101 -2.725 -2.178 1.00 0.00 C ATOM 460 O GLN A 30 -11.254 -2.680 -1.796 1.00 0.00 O ATOM 461 CB GLN A 30 -9.077 -2.377 -4.441 1.00 0.00 C ATOM 462 CG GLN A 30 -8.909 -1.323 -5.533 1.00 0.00 C ATOM 463 CD GLN A 30 -9.922 -1.580 -6.648 1.00 0.00 C ATOM 464 OE1 GLN A 30 -9.841 -2.575 -7.341 1.00 0.00 O ATOM 465 NE2 GLN A 30 -10.883 -0.721 -6.850 1.00 0.00 N ATOM 0 H GLN A 30 -7.435 -1.503 -2.916 1.00 0.00 H new ATOM 0 HA GLN A 30 -10.329 -0.967 -3.340 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -8.133 -2.896 -4.272 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -9.802 -3.128 -4.753 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -9.055 -0.326 -5.117 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -7.896 -1.356 -5.933 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -10.951 0.114 -6.268 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -11.566 -0.885 -7.589 1.00 0.00 H new ATOM 474 N LYS A 31 -9.279 -3.643 -1.756 1.00 0.00 N ATOM 475 CA LYS A 31 -9.749 -4.665 -0.785 1.00 0.00 C ATOM 476 C LYS A 31 -10.025 -3.981 0.553 1.00 0.00 C ATOM 477 O LYS A 31 -10.696 -4.515 1.413 1.00 0.00 O ATOM 478 CB LYS A 31 -8.597 -5.663 -0.663 1.00 0.00 C ATOM 479 CG LYS A 31 -8.873 -6.867 -1.569 1.00 0.00 C ATOM 480 CD LYS A 31 -7.606 -7.716 -1.692 1.00 0.00 C ATOM 481 CE LYS A 31 -7.564 -8.377 -3.073 1.00 0.00 C ATOM 482 NZ LYS A 31 -6.981 -9.728 -2.838 1.00 0.00 N ATOM 0 H LYS A 31 -8.304 -3.729 -2.042 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.667 -5.163 -1.097 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.658 -5.188 -0.946 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.491 -5.989 0.372 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -9.686 -7.466 -1.158 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -9.193 -6.528 -2.554 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -6.723 -7.093 -1.549 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -7.589 -8.477 -0.912 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -8.561 -8.448 -3.507 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.954 -7.800 -3.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.921 -10.242 -3.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.029 -9.629 -2.431 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.586 -10.257 -2.178 1.00 0.00 H new ATOM 496 N LEU A 32 -9.519 -2.789 0.721 1.00 0.00 N ATOM 497 CA LEU A 32 -9.753 -2.050 1.989 1.00 0.00 C ATOM 498 C LEU A 32 -11.111 -1.350 1.929 1.00 0.00 C ATOM 499 O LEU A 32 -11.899 -1.428 2.849 1.00 0.00 O ATOM 500 CB LEU A 32 -8.625 -1.027 2.066 1.00 0.00 C ATOM 501 CG LEU A 32 -8.384 -0.647 3.525 1.00 0.00 C ATOM 502 CD1 LEU A 32 -8.119 -1.913 4.341 1.00 0.00 C ATOM 503 CD2 LEU A 32 -7.171 0.280 3.613 1.00 0.00 C ATOM 0 H LEU A 32 -8.952 -2.296 0.031 1.00 0.00 H new ATOM 0 HA LEU A 32 -9.762 -2.704 2.861 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -7.715 -1.440 1.631 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -8.882 -0.141 1.486 1.00 0.00 H new ATOM 0 HG LEU A 32 -9.262 -0.136 3.921 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -7.947 -1.645 5.383 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -8.982 -2.576 4.275 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -7.239 -2.422 3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.996 0.553 4.654 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -6.293 -0.232 3.220 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -7.358 1.181 3.028 1.00 0.00 H new ATOM 515 N GLU A 33 -11.395 -0.677 0.847 1.00 0.00 N ATOM 516 CA GLU A 33 -12.712 0.007 0.729 1.00 0.00 C ATOM 517 C GLU A 33 -13.810 -1.045 0.592 1.00 0.00 C ATOM 518 O GLU A 33 -14.978 -0.777 0.798 1.00 0.00 O ATOM 519 CB GLU A 33 -12.613 0.857 -0.539 1.00 0.00 C ATOM 520 CG GLU A 33 -14.003 1.374 -0.917 1.00 0.00 C ATOM 521 CD GLU A 33 -13.965 2.898 -1.030 1.00 0.00 C ATOM 522 OE1 GLU A 33 -14.099 3.553 -0.009 1.00 0.00 O ATOM 523 OE2 GLU A 33 -13.803 3.387 -2.136 1.00 0.00 O ATOM 0 H GLU A 33 -10.775 -0.572 0.044 1.00 0.00 H new ATOM 0 HA GLU A 33 -12.950 0.621 1.598 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -11.934 1.694 -0.376 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -12.199 0.265 -1.355 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -14.321 0.936 -1.863 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -14.732 1.072 -0.165 1.00 0.00 H new ATOM 530 N ALA A 34 -13.433 -2.250 0.270 1.00 0.00 N ATOM 531 CA ALA A 34 -14.434 -3.341 0.146 1.00 0.00 C ATOM 532 C ALA A 34 -14.564 -4.013 1.505 1.00 0.00 C ATOM 533 O ALA A 34 -15.627 -4.434 1.915 1.00 0.00 O ATOM 534 CB ALA A 34 -13.853 -4.305 -0.889 1.00 0.00 C ATOM 0 H ALA A 34 -12.468 -2.526 0.087 1.00 0.00 H new ATOM 0 HA ALA A 34 -15.422 -2.996 -0.160 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -14.539 -5.140 -1.034 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -13.713 -3.782 -1.835 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -12.893 -4.682 -0.537 1.00 0.00 H new ATOM 540 N VAL A 35 -13.474 -4.087 2.214 1.00 0.00 N ATOM 541 CA VAL A 35 -13.493 -4.694 3.566 1.00 0.00 C ATOM 542 C VAL A 35 -14.362 -3.824 4.480 1.00 0.00 C ATOM 543 O VAL A 35 -15.111 -4.317 5.294 1.00 0.00 O ATOM 544 CB VAL A 35 -12.020 -4.685 4.004 1.00 0.00 C ATOM 545 CG1 VAL A 35 -11.903 -4.447 5.510 1.00 0.00 C ATOM 546 CG2 VAL A 35 -11.375 -6.028 3.654 1.00 0.00 C ATOM 0 H VAL A 35 -12.562 -3.748 1.908 1.00 0.00 H new ATOM 0 HA VAL A 35 -13.907 -5.702 3.597 1.00 0.00 H new ATOM 0 HB VAL A 35 -11.509 -3.877 3.481 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -10.852 -4.445 5.797 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -12.350 -3.486 5.762 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -12.424 -5.241 6.045 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -10.330 -6.022 3.965 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -11.902 -6.830 4.170 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -11.433 -6.190 2.578 1.00 0.00 H new ATOM 556 N ALA A 36 -14.268 -2.526 4.334 1.00 0.00 N ATOM 557 CA ALA A 36 -15.093 -1.618 5.178 1.00 0.00 C ATOM 558 C ALA A 36 -16.563 -1.782 4.797 1.00 0.00 C ATOM 559 O ALA A 36 -17.455 -1.568 5.596 1.00 0.00 O ATOM 560 CB ALA A 36 -14.601 -0.208 4.845 1.00 0.00 C ATOM 0 H ALA A 36 -13.655 -2.059 3.666 1.00 0.00 H new ATOM 0 HA ALA A 36 -15.003 -1.829 6.244 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -15.163 0.521 5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -13.541 -0.126 5.085 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -14.748 -0.013 3.783 1.00 0.00 H new ATOM 566 N LYS A 37 -16.818 -2.172 3.577 1.00 0.00 N ATOM 567 CA LYS A 37 -18.226 -2.362 3.134 1.00 0.00 C ATOM 568 C LYS A 37 -18.753 -3.699 3.652 1.00 0.00 C ATOM 569 O LYS A 37 -19.932 -3.862 3.900 1.00 0.00 O ATOM 570 CB LYS A 37 -18.169 -2.356 1.609 1.00 0.00 C ATOM 571 CG LYS A 37 -18.845 -1.093 1.077 1.00 0.00 C ATOM 572 CD LYS A 37 -17.980 -0.481 -0.024 1.00 0.00 C ATOM 573 CE LYS A 37 -18.750 0.650 -0.707 1.00 0.00 C ATOM 574 NZ LYS A 37 -18.176 0.731 -2.078 1.00 0.00 N ATOM 0 H LYS A 37 -16.110 -2.367 2.869 1.00 0.00 H new ATOM 0 HA LYS A 37 -18.892 -1.586 3.512 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -17.133 -2.395 1.273 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -18.666 -3.241 1.213 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -19.834 -1.333 0.687 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -18.987 -0.375 1.885 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -17.051 -0.099 0.399 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -17.709 -1.243 -0.754 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -19.819 0.438 -0.738 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -18.627 1.591 -0.171 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -18.654 1.486 -2.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -17.159 0.941 -2.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -18.314 -0.177 -2.566 1.00 0.00 H new ATOM 588 N ARG A 38 -17.886 -4.655 3.834 1.00 0.00 N ATOM 589 CA ARG A 38 -18.337 -5.968 4.359 1.00 0.00 C ATOM 590 C ARG A 38 -18.545 -5.842 5.866 1.00 0.00 C ATOM 591 O ARG A 38 -19.436 -6.435 6.438 1.00 0.00 O ATOM 592 CB ARG A 38 -17.203 -6.942 4.042 1.00 0.00 C ATOM 593 CG ARG A 38 -16.724 -6.724 2.606 1.00 0.00 C ATOM 594 CD ARG A 38 -16.857 -8.031 1.820 1.00 0.00 C ATOM 595 NE ARG A 38 -15.578 -8.161 1.067 1.00 0.00 N ATOM 596 CZ ARG A 38 -14.923 -9.291 1.078 1.00 0.00 C ATOM 597 NH1 ARG A 38 -15.457 -10.358 0.551 1.00 0.00 N ATOM 598 NH2 ARG A 38 -13.733 -9.353 1.611 1.00 0.00 N ATOM 0 H ARG A 38 -16.887 -4.582 3.642 1.00 0.00 H new ATOM 0 HA ARG A 38 -19.275 -6.308 3.920 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -16.377 -6.793 4.738 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -17.546 -7.969 4.169 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -17.312 -5.939 2.130 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -15.686 -6.390 2.604 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -17.010 -8.879 2.488 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -17.711 -8.000 1.144 1.00 0.00 H new ATOM 0 HE ARG A 38 -15.213 -7.366 0.542 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -16.385 -10.309 0.131 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.946 -11.241 0.559 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -13.313 -8.518 2.020 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.223 -10.236 1.619 1.00 0.00 H new ATOM 612 N ILE A 39 -17.732 -5.042 6.502 1.00 0.00 N ATOM 613 CA ILE A 39 -17.871 -4.833 7.967 1.00 0.00 C ATOM 614 C ILE A 39 -19.226 -4.188 8.246 1.00 0.00 C ATOM 615 O ILE A 39 -19.959 -4.611 9.115 1.00 0.00 O ATOM 616 CB ILE A 39 -16.720 -3.892 8.335 1.00 0.00 C ATOM 617 CG1 ILE A 39 -15.440 -4.714 8.544 1.00 0.00 C ATOM 618 CG2 ILE A 39 -17.057 -3.114 9.612 1.00 0.00 C ATOM 619 CD1 ILE A 39 -15.448 -5.360 9.931 1.00 0.00 C ATOM 0 H ILE A 39 -16.972 -4.521 6.063 1.00 0.00 H new ATOM 0 HA ILE A 39 -17.827 -5.755 8.546 1.00 0.00 H new ATOM 0 HB ILE A 39 -16.567 -3.179 7.525 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -15.364 -5.484 7.776 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -14.565 -4.072 8.439 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -16.230 -2.449 9.862 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -17.960 -2.525 9.452 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -17.220 -3.814 10.432 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -14.535 -5.940 10.067 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -15.502 -4.583 10.694 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -16.313 -6.017 10.021 1.00 0.00 H new ATOM 631 N GLU A 40 -19.575 -3.182 7.494 1.00 0.00 N ATOM 632 CA GLU A 40 -20.898 -2.537 7.699 1.00 0.00 C ATOM 633 C GLU A 40 -21.977 -3.563 7.375 1.00 0.00 C ATOM 634 O GLU A 40 -23.025 -3.601 7.989 1.00 0.00 O ATOM 635 CB GLU A 40 -20.944 -1.360 6.723 1.00 0.00 C ATOM 636 CG GLU A 40 -20.670 -1.852 5.301 1.00 0.00 C ATOM 637 CD GLU A 40 -21.024 -0.747 4.304 1.00 0.00 C ATOM 638 OE1 GLU A 40 -20.801 0.409 4.626 1.00 0.00 O ATOM 639 OE2 GLU A 40 -21.513 -1.075 3.235 1.00 0.00 O ATOM 0 H GLU A 40 -19.003 -2.781 6.750 1.00 0.00 H new ATOM 0 HA GLU A 40 -21.055 -2.188 8.720 1.00 0.00 H new ATOM 0 HB2 GLU A 40 -21.920 -0.877 6.768 1.00 0.00 H new ATOM 0 HB3 GLU A 40 -20.204 -0.612 7.007 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -19.621 -2.129 5.196 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -21.258 -2.746 5.094 1.00 0.00 H new ATOM 646 N ALA A 41 -21.705 -4.420 6.430 1.00 0.00 N ATOM 647 CA ALA A 41 -22.691 -5.478 6.082 1.00 0.00 C ATOM 648 C ALA A 41 -23.025 -6.255 7.351 1.00 0.00 C ATOM 649 O ALA A 41 -24.158 -6.619 7.598 1.00 0.00 O ATOM 650 CB ALA A 41 -21.977 -6.372 5.069 1.00 0.00 C ATOM 0 H ALA A 41 -20.843 -4.432 5.885 1.00 0.00 H new ATOM 0 HA ALA A 41 -23.621 -5.087 5.670 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -22.643 -7.179 4.763 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -21.698 -5.782 4.196 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -21.081 -6.794 5.524 1.00 0.00 H new ATOM 656 N LEU A 42 -22.038 -6.481 8.175 1.00 0.00 N ATOM 657 CA LEU A 42 -22.279 -7.201 9.454 1.00 0.00 C ATOM 658 C LEU A 42 -22.966 -6.249 10.430 1.00 0.00 C ATOM 659 O LEU A 42 -23.798 -6.644 11.216 1.00 0.00 O ATOM 660 CB LEU A 42 -20.889 -7.586 9.986 1.00 0.00 C ATOM 661 CG LEU A 42 -20.321 -8.835 9.282 1.00 0.00 C ATOM 662 CD1 LEU A 42 -21.436 -9.715 8.705 1.00 0.00 C ATOM 663 CD2 LEU A 42 -19.388 -8.394 8.155 1.00 0.00 C ATOM 0 H LEU A 42 -21.072 -6.196 8.015 1.00 0.00 H new ATOM 0 HA LEU A 42 -22.911 -8.080 9.325 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -20.204 -6.750 9.847 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -20.951 -7.772 11.058 1.00 0.00 H new ATOM 0 HG LEU A 42 -19.776 -9.424 10.020 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -20.997 -10.585 8.217 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -22.093 -10.044 9.510 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -22.011 -9.143 7.977 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -18.983 -9.273 7.653 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -19.944 -7.790 7.438 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -18.571 -7.804 8.569 1.00 0.00 H new ATOM 675 N GLU A 43 -22.623 -4.991 10.376 1.00 0.00 N ATOM 676 CA GLU A 43 -23.258 -4.004 11.293 1.00 0.00 C ATOM 677 C GLU A 43 -24.740 -3.875 10.961 1.00 0.00 C ATOM 678 O GLU A 43 -25.523 -3.362 11.734 1.00 0.00 O ATOM 679 CB GLU A 43 -22.523 -2.696 11.020 1.00 0.00 C ATOM 680 CG GLU A 43 -21.039 -2.900 11.303 1.00 0.00 C ATOM 681 CD GLU A 43 -20.506 -1.724 12.125 1.00 0.00 C ATOM 682 OE1 GLU A 43 -20.874 -0.599 11.822 1.00 0.00 O ATOM 683 OE2 GLU A 43 -19.742 -1.966 13.045 1.00 0.00 O ATOM 0 H GLU A 43 -21.930 -4.604 9.736 1.00 0.00 H new ATOM 0 HA GLU A 43 -23.192 -4.294 12.342 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -22.671 -2.388 9.985 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -22.922 -1.900 11.649 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -20.887 -3.834 11.844 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -20.488 -2.981 10.366 1.00 0.00 H new ATOM 690 N ASN A 44 -25.130 -4.355 9.815 1.00 0.00 N ATOM 691 CA ASN A 44 -26.565 -4.282 9.425 1.00 0.00 C ATOM 692 C ASN A 44 -27.358 -5.299 10.244 1.00 0.00 C ATOM 693 O ASN A 44 -28.538 -5.140 10.483 1.00 0.00 O ATOM 694 CB ASN A 44 -26.592 -4.643 7.939 1.00 0.00 C ATOM 695 CG ASN A 44 -26.005 -3.496 7.107 1.00 0.00 C ATOM 696 OD1 ASN A 44 -25.500 -2.447 7.705 1.00 0.00 O flip ATOM 697 ND2 ASN A 44 -26.006 -3.555 5.894 1.00 0.00 N flip ATOM 0 H ASN A 44 -24.516 -4.796 9.130 1.00 0.00 H new ATOM 0 HA ASN A 44 -27.006 -3.301 9.604 1.00 0.00 H new ATOM 0 HB2 ASN A 44 -26.021 -5.556 7.768 1.00 0.00 H new ATOM 0 HB3 ASN A 44 -27.616 -4.844 7.624 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -26.398 -4.370 5.423 1.00 0.00 H new ATOM 0 HD22 ASN A 44 -25.614 -2.789 5.346 1.00 0.00 H new ATOM 704 N LYS A 45 -26.707 -6.342 10.681 1.00 0.00 N ATOM 705 CA LYS A 45 -27.405 -7.375 11.496 1.00 0.00 C ATOM 706 C LYS A 45 -26.860 -7.357 12.925 1.00 0.00 C ATOM 707 O LYS A 45 -27.399 -7.986 13.814 1.00 0.00 O ATOM 708 CB LYS A 45 -27.084 -8.705 10.813 1.00 0.00 C ATOM 709 CG LYS A 45 -27.900 -8.832 9.526 1.00 0.00 C ATOM 710 CD LYS A 45 -27.501 -7.718 8.556 1.00 0.00 C ATOM 711 CE LYS A 45 -27.613 -8.232 7.119 1.00 0.00 C ATOM 712 NZ LYS A 45 -28.704 -7.426 6.503 1.00 0.00 N ATOM 0 H LYS A 45 -25.718 -6.523 10.508 1.00 0.00 H new ATOM 0 HA LYS A 45 -28.480 -7.204 11.558 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -26.019 -8.761 10.587 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -27.312 -9.534 11.483 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -27.728 -9.806 9.068 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -28.965 -8.769 9.750 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -28.147 -6.851 8.695 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -26.481 -7.392 8.759 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -26.675 -8.103 6.580 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -27.849 -9.296 7.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -28.955 -7.831 5.578 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -29.538 -7.438 7.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -28.382 -6.445 6.376 1.00 0.00 H new ATOM 726 N ILE A 46 -25.796 -6.634 13.154 1.00 0.00 N ATOM 727 CA ILE A 46 -25.219 -6.568 14.526 1.00 0.00 C ATOM 728 C ILE A 46 -25.585 -5.232 15.173 1.00 0.00 C ATOM 729 O ILE A 46 -25.470 -5.056 16.370 1.00 0.00 O ATOM 730 CB ILE A 46 -23.700 -6.676 14.337 1.00 0.00 C ATOM 731 CG1 ILE A 46 -23.311 -8.056 13.771 1.00 0.00 C ATOM 732 CG2 ILE A 46 -23.009 -6.478 15.685 1.00 0.00 C ATOM 733 CD1 ILE A 46 -24.320 -9.129 14.200 1.00 0.00 C ATOM 0 H ILE A 46 -25.302 -6.087 12.449 1.00 0.00 H new ATOM 0 HA ILE A 46 -25.598 -7.359 15.173 1.00 0.00 H new ATOM 0 HB ILE A 46 -23.385 -5.907 13.631 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -23.266 -8.008 12.683 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -22.315 -8.328 14.119 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -21.929 -6.554 15.555 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -23.258 -5.493 16.081 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -23.345 -7.245 16.382 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -24.023 -10.093 13.788 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -24.344 -9.191 15.288 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -25.311 -8.866 13.830 1.00 0.00 H new ATOM 886 N GLU B 10 14.799 12.433 -13.382 1.00 0.00 N ATOM 887 CA GLU B 10 13.871 12.662 -12.239 1.00 0.00 C ATOM 888 C GLU B 10 14.589 12.412 -10.908 1.00 0.00 C ATOM 889 O GLU B 10 14.065 11.763 -10.027 1.00 0.00 O ATOM 890 CB GLU B 10 12.751 11.642 -12.436 1.00 0.00 C ATOM 891 CG GLU B 10 11.769 12.152 -13.494 1.00 0.00 C ATOM 892 CD GLU B 10 11.609 11.100 -14.593 1.00 0.00 C ATOM 893 OE1 GLU B 10 12.463 11.045 -15.462 1.00 0.00 O ATOM 894 OE2 GLU B 10 10.634 10.369 -14.547 1.00 0.00 O ATOM 0 HA GLU B 10 13.499 13.686 -12.210 1.00 0.00 H new ATOM 0 HB2 GLU B 10 13.169 10.684 -12.745 1.00 0.00 H new ATOM 0 HB3 GLU B 10 12.230 11.473 -11.494 1.00 0.00 H new ATOM 0 HG2 GLU B 10 10.803 12.364 -13.036 1.00 0.00 H new ATOM 0 HG3 GLU B 10 12.132 13.087 -13.921 1.00 0.00 H new ATOM 901 N CYS B 11 15.783 12.915 -10.750 1.00 0.00 N ATOM 902 CA CYS B 11 16.513 12.694 -9.472 1.00 0.00 C ATOM 903 C CYS B 11 15.611 13.030 -8.282 1.00 0.00 C ATOM 904 O CYS B 11 15.733 12.461 -7.216 1.00 0.00 O ATOM 905 CB CYS B 11 17.712 13.639 -9.523 1.00 0.00 C ATOM 906 SG CYS B 11 19.124 12.783 -10.267 1.00 0.00 S ATOM 0 H CYS B 11 16.282 13.467 -11.448 1.00 0.00 H new ATOM 0 HA CYS B 11 16.823 11.656 -9.351 1.00 0.00 H new ATOM 0 HB2 CYS B 11 17.464 14.527 -10.104 1.00 0.00 H new ATOM 0 HB3 CYS B 11 17.966 13.976 -8.518 1.00 0.00 H new ATOM 911 N LYS B 12 14.704 13.949 -8.458 1.00 0.00 N ATOM 912 CA LYS B 12 13.792 14.318 -7.336 1.00 0.00 C ATOM 913 C LYS B 12 12.338 14.052 -7.732 1.00 0.00 C ATOM 914 O LYS B 12 11.446 14.097 -6.911 1.00 0.00 O ATOM 915 CB LYS B 12 14.022 15.814 -7.103 1.00 0.00 C ATOM 916 CG LYS B 12 15.519 16.124 -7.177 1.00 0.00 C ATOM 917 CD LYS B 12 16.288 15.156 -6.276 1.00 0.00 C ATOM 918 CE LYS B 12 17.216 15.949 -5.354 1.00 0.00 C ATOM 919 NZ LYS B 12 18.488 15.174 -5.329 1.00 0.00 N ATOM 0 H LYS B 12 14.553 14.461 -9.327 1.00 0.00 H new ATOM 0 HA LYS B 12 13.990 13.736 -6.436 1.00 0.00 H new ATOM 0 HB2 LYS B 12 13.483 16.395 -7.851 1.00 0.00 H new ATOM 0 HB3 LYS B 12 13.628 16.105 -6.129 1.00 0.00 H new ATOM 0 HG2 LYS B 12 15.869 16.035 -8.206 1.00 0.00 H new ATOM 0 HG3 LYS B 12 15.704 17.152 -6.865 1.00 0.00 H new ATOM 0 HD2 LYS B 12 15.592 14.561 -5.685 1.00 0.00 H new ATOM 0 HD3 LYS B 12 16.868 14.460 -6.882 1.00 0.00 H new ATOM 0 HE2 LYS B 12 17.377 16.959 -5.730 1.00 0.00 H new ATOM 0 HE3 LYS B 12 16.792 16.044 -4.354 1.00 0.00 H new ATOM 0 HZ1 LYS B 12 19.176 15.656 -4.716 1.00 0.00 H new ATOM 0 HZ2 LYS B 12 18.305 14.219 -4.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 12 18.872 15.106 -6.293 1.00 0.00 H new ATOM 933 N SER B 13 12.094 13.774 -8.983 1.00 0.00 N ATOM 934 CA SER B 13 10.696 13.504 -9.434 1.00 0.00 C ATOM 935 C SER B 13 10.291 12.069 -9.079 1.00 0.00 C ATOM 936 O SER B 13 9.135 11.774 -8.839 1.00 0.00 O ATOM 937 CB SER B 13 10.733 13.695 -10.951 1.00 0.00 C ATOM 938 OG SER B 13 10.439 15.051 -11.261 1.00 0.00 O ATOM 0 H SER B 13 12.802 13.722 -9.715 1.00 0.00 H new ATOM 0 HA SER B 13 9.970 14.162 -8.956 1.00 0.00 H new ATOM 0 HB2 SER B 13 11.715 13.426 -11.339 1.00 0.00 H new ATOM 0 HB3 SER B 13 10.009 13.035 -11.430 1.00 0.00 H new ATOM 0 HG SER B 13 10.464 15.177 -12.233 1.00 0.00 H new ATOM 944 N ILE B 14 11.241 11.179 -9.043 1.00 0.00 N ATOM 945 CA ILE B 14 10.946 9.756 -8.704 1.00 0.00 C ATOM 946 C ILE B 14 10.831 9.601 -7.192 1.00 0.00 C ATOM 947 O ILE B 14 9.980 8.899 -6.680 1.00 0.00 O ATOM 948 CB ILE B 14 12.158 8.984 -9.230 1.00 0.00 C ATOM 949 CG1 ILE B 14 12.076 8.896 -10.753 1.00 0.00 C ATOM 950 CG2 ILE B 14 12.187 7.571 -8.639 1.00 0.00 C ATOM 951 CD1 ILE B 14 13.486 8.743 -11.330 1.00 0.00 C ATOM 0 H ILE B 14 12.223 11.377 -9.236 1.00 0.00 H new ATOM 0 HA ILE B 14 10.010 9.400 -9.135 1.00 0.00 H new ATOM 0 HB ILE B 14 13.068 9.507 -8.936 1.00 0.00 H new ATOM 0 HG12 ILE B 14 11.457 8.048 -11.047 1.00 0.00 H new ATOM 0 HG13 ILE B 14 11.602 9.791 -11.155 1.00 0.00 H new ATOM 0 HG21 ILE B 14 13.055 7.034 -9.022 1.00 0.00 H new ATOM 0 HG22 ILE B 14 12.249 7.632 -7.552 1.00 0.00 H new ATOM 0 HG23 ILE B 14 11.278 7.040 -8.921 1.00 0.00 H new ATOM 0 HD11 ILE B 14 13.430 8.680 -12.417 1.00 0.00 H new ATOM 0 HD12 ILE B 14 14.090 9.605 -11.047 1.00 0.00 H new ATOM 0 HD13 ILE B 14 13.943 7.835 -10.937 1.00 0.00 H new ATOM 963 N VAL B 15 11.677 10.276 -6.476 1.00 0.00 N ATOM 964 CA VAL B 15 11.626 10.197 -4.995 1.00 0.00 C ATOM 965 C VAL B 15 10.522 11.138 -4.514 1.00 0.00 C ATOM 966 O VAL B 15 10.003 11.017 -3.419 1.00 0.00 O ATOM 967 CB VAL B 15 13.015 10.639 -4.510 1.00 0.00 C ATOM 968 CG1 VAL B 15 13.326 9.953 -3.178 1.00 0.00 C ATOM 969 CG2 VAL B 15 14.083 10.225 -5.536 1.00 0.00 C ATOM 0 H VAL B 15 12.405 10.882 -6.853 1.00 0.00 H new ATOM 0 HA VAL B 15 11.401 9.201 -4.613 1.00 0.00 H new ATOM 0 HB VAL B 15 13.022 11.722 -4.389 1.00 0.00 H new ATOM 0 HG11 VAL B 15 14.311 10.264 -2.830 1.00 0.00 H new ATOM 0 HG12 VAL B 15 12.575 10.234 -2.440 1.00 0.00 H new ATOM 0 HG13 VAL B 15 13.314 8.872 -3.314 1.00 0.00 H new ATOM 0 HG21 VAL B 15 15.066 10.541 -5.186 1.00 0.00 H new ATOM 0 HG22 VAL B 15 14.072 9.142 -5.656 1.00 0.00 H new ATOM 0 HG23 VAL B 15 13.870 10.698 -6.494 1.00 0.00 H new ATOM 979 N LYS B 16 10.122 12.046 -5.365 1.00 0.00 N ATOM 980 CA LYS B 16 9.013 12.964 -5.007 1.00 0.00 C ATOM 981 C LYS B 16 7.729 12.150 -5.056 1.00 0.00 C ATOM 982 O LYS B 16 6.885 12.232 -4.186 1.00 0.00 O ATOM 983 CB LYS B 16 9.020 14.049 -6.086 1.00 0.00 C ATOM 984 CG LYS B 16 7.657 14.737 -6.127 1.00 0.00 C ATOM 985 CD LYS B 16 6.967 14.428 -7.457 1.00 0.00 C ATOM 986 CE LYS B 16 6.230 15.674 -7.955 1.00 0.00 C ATOM 987 NZ LYS B 16 4.985 15.157 -8.588 1.00 0.00 N ATOM 0 H LYS B 16 10.520 12.188 -6.294 1.00 0.00 H new ATOM 0 HA LYS B 16 9.106 13.413 -4.018 1.00 0.00 H new ATOM 0 HB2 LYS B 16 9.802 14.779 -5.877 1.00 0.00 H new ATOM 0 HB3 LYS B 16 9.246 13.609 -7.057 1.00 0.00 H new ATOM 0 HG2 LYS B 16 7.040 14.394 -5.297 1.00 0.00 H new ATOM 0 HG3 LYS B 16 7.778 15.814 -6.010 1.00 0.00 H new ATOM 0 HD2 LYS B 16 7.703 14.110 -8.195 1.00 0.00 H new ATOM 0 HD3 LYS B 16 6.265 13.604 -7.331 1.00 0.00 H new ATOM 0 HE2 LYS B 16 6.003 16.353 -7.133 1.00 0.00 H new ATOM 0 HE3 LYS B 16 6.835 16.231 -8.671 1.00 0.00 H new ATOM 0 HZ1 LYS B 16 4.425 15.953 -8.954 1.00 0.00 H new ATOM 0 HZ2 LYS B 16 5.233 14.519 -9.371 1.00 0.00 H new ATOM 0 HZ3 LYS B 16 4.426 14.637 -7.881 1.00 0.00 H new ATOM 1001 N PHE B 17 7.606 11.320 -6.059 1.00 0.00 N ATOM 1002 CA PHE B 17 6.411 10.446 -6.153 1.00 0.00 C ATOM 1003 C PHE B 17 6.447 9.474 -4.972 1.00 0.00 C ATOM 1004 O PHE B 17 5.427 9.067 -4.452 1.00 0.00 O ATOM 1005 CB PHE B 17 6.562 9.710 -7.494 1.00 0.00 C ATOM 1006 CG PHE B 17 5.939 8.332 -7.406 1.00 0.00 C ATOM 1007 CD1 PHE B 17 6.699 7.258 -6.932 1.00 0.00 C ATOM 1008 CD2 PHE B 17 4.608 8.131 -7.795 1.00 0.00 C ATOM 1009 CE1 PHE B 17 6.133 5.982 -6.842 1.00 0.00 C ATOM 1010 CE2 PHE B 17 4.041 6.853 -7.705 1.00 0.00 C ATOM 1011 CZ PHE B 17 4.803 5.777 -7.230 1.00 0.00 C ATOM 0 H PHE B 17 8.284 11.213 -6.814 1.00 0.00 H new ATOM 0 HA PHE B 17 5.463 10.983 -6.115 1.00 0.00 H new ATOM 0 HB2 PHE B 17 6.084 10.284 -8.288 1.00 0.00 H new ATOM 0 HB3 PHE B 17 7.617 9.624 -7.754 1.00 0.00 H new ATOM 0 HD1 PHE B 17 7.725 7.414 -6.635 1.00 0.00 H new ATOM 0 HD2 PHE B 17 4.021 8.959 -8.163 1.00 0.00 H new ATOM 0 HE1 PHE B 17 6.722 5.155 -6.473 1.00 0.00 H new ATOM 0 HE2 PHE B 17 3.015 6.697 -8.002 1.00 0.00 H new ATOM 0 HZ PHE B 17 4.366 4.792 -7.163 1.00 0.00 H new ATOM 1021 N GLN B 18 7.629 9.109 -4.543 1.00 0.00 N ATOM 1022 CA GLN B 18 7.742 8.171 -3.391 1.00 0.00 C ATOM 1023 C GLN B 18 7.048 8.764 -2.166 1.00 0.00 C ATOM 1024 O GLN B 18 6.321 8.089 -1.467 1.00 0.00 O ATOM 1025 CB GLN B 18 9.241 8.018 -3.142 1.00 0.00 C ATOM 1026 CG GLN B 18 9.813 6.998 -4.126 1.00 0.00 C ATOM 1027 CD GLN B 18 11.197 6.557 -3.652 1.00 0.00 C ATOM 1028 OE1 GLN B 18 11.652 6.965 -2.601 1.00 0.00 O ATOM 1029 NE2 GLN B 18 11.890 5.732 -4.387 1.00 0.00 N ATOM 0 H GLN B 18 8.516 9.420 -4.940 1.00 0.00 H new ATOM 0 HA GLN B 18 7.269 7.210 -3.592 1.00 0.00 H new ATOM 0 HB2 GLN B 18 9.742 8.979 -3.263 1.00 0.00 H new ATOM 0 HB3 GLN B 18 9.420 7.692 -2.117 1.00 0.00 H new ATOM 0 HG2 GLN B 18 9.150 6.136 -4.200 1.00 0.00 H new ATOM 0 HG3 GLN B 18 9.880 7.435 -5.122 1.00 0.00 H new ATOM 0 HE21 GLN B 18 11.508 5.390 -5.269 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.814 5.429 -4.080 1.00 0.00 H new ATOM 1038 N THR B 19 7.256 10.024 -1.905 1.00 0.00 N ATOM 1039 CA THR B 19 6.584 10.649 -0.728 1.00 0.00 C ATOM 1040 C THR B 19 5.071 10.470 -0.862 1.00 0.00 C ATOM 1041 O THR B 19 4.370 10.266 0.109 1.00 0.00 O ATOM 1042 CB THR B 19 6.961 12.133 -0.785 1.00 0.00 C ATOM 1043 OG1 THR B 19 8.277 12.302 -0.279 1.00 0.00 O ATOM 1044 CG2 THR B 19 5.979 12.945 0.062 1.00 0.00 C ATOM 0 H THR B 19 7.856 10.645 -2.449 1.00 0.00 H new ATOM 0 HA THR B 19 6.887 10.201 0.218 1.00 0.00 H new ATOM 0 HB THR B 19 6.919 12.480 -1.817 1.00 0.00 H new ATOM 0 HG1 THR B 19 8.522 13.250 -0.316 1.00 0.00 H new ATOM 0 HG21 THR B 19 6.249 14.000 0.020 1.00 0.00 H new ATOM 0 HG22 THR B 19 4.969 12.813 -0.325 1.00 0.00 H new ATOM 0 HG23 THR B 19 6.019 12.601 1.095 1.00 0.00 H new ATOM 1052 N LYS B 20 4.567 10.522 -2.066 1.00 0.00 N ATOM 1053 CA LYS B 20 3.106 10.328 -2.266 1.00 0.00 C ATOM 1054 C LYS B 20 2.758 8.890 -1.895 1.00 0.00 C ATOM 1055 O LYS B 20 1.690 8.598 -1.392 1.00 0.00 O ATOM 1056 CB LYS B 20 2.867 10.579 -3.756 1.00 0.00 C ATOM 1057 CG LYS B 20 3.249 12.020 -4.099 1.00 0.00 C ATOM 1058 CD LYS B 20 2.000 12.791 -4.528 1.00 0.00 C ATOM 1059 CE LYS B 20 1.942 14.126 -3.784 1.00 0.00 C ATOM 1060 NZ LYS B 20 2.759 15.059 -4.607 1.00 0.00 N ATOM 0 H LYS B 20 5.104 10.690 -2.917 1.00 0.00 H new ATOM 0 HA LYS B 20 2.494 10.992 -1.655 1.00 0.00 H new ATOM 0 HB2 LYS B 20 3.458 9.883 -4.352 1.00 0.00 H new ATOM 0 HB3 LYS B 20 1.820 10.401 -4.002 1.00 0.00 H new ATOM 0 HG2 LYS B 20 3.707 12.501 -3.235 1.00 0.00 H new ATOM 0 HG3 LYS B 20 3.989 12.031 -4.900 1.00 0.00 H new ATOM 0 HD2 LYS B 20 2.018 12.963 -5.604 1.00 0.00 H new ATOM 0 HD3 LYS B 20 1.107 12.204 -4.314 1.00 0.00 H new ATOM 0 HE2 LYS B 20 0.916 14.480 -3.687 1.00 0.00 H new ATOM 0 HE3 LYS B 20 2.344 14.034 -2.775 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 2.768 15.998 -4.161 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 3.732 14.699 -4.676 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 2.348 15.132 -5.560 1.00 0.00 H new ATOM 1074 N VAL B 21 3.677 7.996 -2.128 1.00 0.00 N ATOM 1075 CA VAL B 21 3.451 6.568 -1.780 1.00 0.00 C ATOM 1076 C VAL B 21 3.642 6.391 -0.275 1.00 0.00 C ATOM 1077 O VAL B 21 3.176 5.442 0.317 1.00 0.00 O ATOM 1078 CB VAL B 21 4.523 5.809 -2.571 1.00 0.00 C ATOM 1079 CG1 VAL B 21 4.922 4.526 -1.839 1.00 0.00 C ATOM 1080 CG2 VAL B 21 3.970 5.448 -3.948 1.00 0.00 C ATOM 0 H VAL B 21 4.584 8.197 -2.549 1.00 0.00 H new ATOM 0 HA VAL B 21 2.450 6.210 -2.021 1.00 0.00 H new ATOM 0 HB VAL B 21 5.402 6.446 -2.673 1.00 0.00 H new ATOM 0 HG11 VAL B 21 5.684 4.000 -2.415 1.00 0.00 H new ATOM 0 HG12 VAL B 21 5.319 4.777 -0.856 1.00 0.00 H new ATOM 0 HG13 VAL B 21 4.047 3.886 -1.724 1.00 0.00 H new ATOM 0 HG21 VAL B 21 4.729 4.908 -4.515 1.00 0.00 H new ATOM 0 HG22 VAL B 21 3.087 4.819 -3.832 1.00 0.00 H new ATOM 0 HG23 VAL B 21 3.699 6.359 -4.481 1.00 0.00 H new ATOM 1090 N GLU B 22 4.324 7.314 0.343 1.00 0.00 N ATOM 1091 CA GLU B 22 4.552 7.225 1.811 1.00 0.00 C ATOM 1092 C GLU B 22 3.257 7.561 2.555 1.00 0.00 C ATOM 1093 O GLU B 22 2.832 6.848 3.443 1.00 0.00 O ATOM 1094 CB GLU B 22 5.633 8.272 2.092 1.00 0.00 C ATOM 1095 CG GLU B 22 7.013 7.621 1.984 1.00 0.00 C ATOM 1096 CD GLU B 22 7.148 6.530 3.048 1.00 0.00 C ATOM 1097 OE1 GLU B 22 6.714 5.420 2.787 1.00 0.00 O ATOM 1098 OE2 GLU B 22 7.679 6.822 4.106 1.00 0.00 O ATOM 0 H GLU B 22 4.735 8.131 -0.109 1.00 0.00 H new ATOM 0 HA GLU B 22 4.855 6.230 2.138 1.00 0.00 H new ATOM 0 HB2 GLU B 22 5.551 9.095 1.382 1.00 0.00 H new ATOM 0 HB3 GLU B 22 5.495 8.695 3.087 1.00 0.00 H new ATOM 0 HG2 GLU B 22 7.148 7.193 0.991 1.00 0.00 H new ATOM 0 HG3 GLU B 22 7.792 8.372 2.117 1.00 0.00 H new ATOM 1105 N GLU B 23 2.622 8.640 2.187 1.00 0.00 N ATOM 1106 CA GLU B 23 1.350 9.024 2.860 1.00 0.00 C ATOM 1107 C GLU B 23 0.226 8.085 2.417 1.00 0.00 C ATOM 1108 O GLU B 23 -0.677 7.781 3.171 1.00 0.00 O ATOM 1109 CB GLU B 23 1.074 10.454 2.395 1.00 0.00 C ATOM 1110 CG GLU B 23 2.320 11.314 2.620 1.00 0.00 C ATOM 1111 CD GLU B 23 1.913 12.652 3.239 1.00 0.00 C ATOM 1112 OE1 GLU B 23 0.757 13.018 3.102 1.00 0.00 O ATOM 1113 OE2 GLU B 23 2.762 13.287 3.841 1.00 0.00 O ATOM 0 H GLU B 23 2.930 9.273 1.448 1.00 0.00 H new ATOM 0 HA GLU B 23 1.413 8.958 3.946 1.00 0.00 H new ATOM 0 HB2 GLU B 23 0.802 10.458 1.339 1.00 0.00 H new ATOM 0 HB3 GLU B 23 0.229 10.869 2.944 1.00 0.00 H new ATOM 0 HG2 GLU B 23 3.019 10.795 3.276 1.00 0.00 H new ATOM 0 HG3 GLU B 23 2.835 11.481 1.674 1.00 0.00 H new ATOM 1120 N LEU B 24 0.280 7.617 1.199 1.00 0.00 N ATOM 1121 CA LEU B 24 -0.778 6.690 0.708 1.00 0.00 C ATOM 1122 C LEU B 24 -0.677 5.354 1.445 1.00 0.00 C ATOM 1123 O LEU B 24 -1.662 4.814 1.910 1.00 0.00 O ATOM 1124 CB LEU B 24 -0.489 6.510 -0.782 1.00 0.00 C ATOM 1125 CG LEU B 24 -1.774 6.108 -1.508 1.00 0.00 C ATOM 1126 CD1 LEU B 24 -2.878 7.122 -1.199 1.00 0.00 C ATOM 1127 CD2 LEU B 24 -1.517 6.079 -3.016 1.00 0.00 C ATOM 0 H LEU B 24 1.012 7.837 0.523 1.00 0.00 H new ATOM 0 HA LEU B 24 -1.784 7.075 0.878 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -0.097 7.437 -1.201 1.00 0.00 H new ATOM 0 HB3 LEU B 24 0.276 5.747 -0.925 1.00 0.00 H new ATOM 0 HG LEU B 24 -2.087 5.120 -1.171 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -3.792 6.834 -1.717 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -3.061 7.144 -0.125 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -2.568 8.111 -1.535 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -2.431 5.793 -3.535 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -1.204 7.068 -3.351 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -0.732 5.356 -3.238 1.00 0.00 H new ATOM 1139 N ILE B 25 0.508 4.820 1.566 1.00 0.00 N ATOM 1140 CA ILE B 25 0.668 3.526 2.286 1.00 0.00 C ATOM 1141 C ILE B 25 0.182 3.696 3.731 1.00 0.00 C ATOM 1142 O ILE B 25 -0.438 2.816 4.294 1.00 0.00 O ATOM 1143 CB ILE B 25 2.177 3.212 2.205 1.00 0.00 C ATOM 1144 CG1 ILE B 25 2.395 2.013 1.277 1.00 0.00 C ATOM 1145 CG2 ILE B 25 2.754 2.879 3.588 1.00 0.00 C ATOM 1146 CD1 ILE B 25 1.569 2.193 0.003 1.00 0.00 C ATOM 0 H ILE B 25 1.370 5.223 1.198 1.00 0.00 H new ATOM 0 HA ILE B 25 0.086 2.710 1.859 1.00 0.00 H new ATOM 0 HB ILE B 25 2.687 4.095 1.820 1.00 0.00 H new ATOM 0 HG12 ILE B 25 3.452 1.921 1.027 1.00 0.00 H new ATOM 0 HG13 ILE B 25 2.106 1.092 1.783 1.00 0.00 H new ATOM 0 HG21 ILE B 25 3.818 2.663 3.496 1.00 0.00 H new ATOM 0 HG22 ILE B 25 2.613 3.729 4.255 1.00 0.00 H new ATOM 0 HG23 ILE B 25 2.241 2.008 3.996 1.00 0.00 H new ATOM 0 HD11 ILE B 25 1.726 1.339 -0.656 1.00 0.00 H new ATOM 0 HD12 ILE B 25 0.512 2.263 0.261 1.00 0.00 H new ATOM 0 HD13 ILE B 25 1.879 3.106 -0.506 1.00 0.00 H new ATOM 1158 N ASN B 26 0.447 4.827 4.325 1.00 0.00 N ATOM 1159 CA ASN B 26 -0.011 5.057 5.725 1.00 0.00 C ATOM 1160 C ASN B 26 -1.539 5.005 5.774 1.00 0.00 C ATOM 1161 O ASN B 26 -2.128 4.428 6.668 1.00 0.00 O ATOM 1162 CB ASN B 26 0.493 6.456 6.080 1.00 0.00 C ATOM 1163 CG ASN B 26 0.650 6.575 7.596 1.00 0.00 C ATOM 1164 OD1 ASN B 26 -0.034 5.906 8.344 1.00 0.00 O ATOM 1165 ND2 ASN B 26 1.531 7.405 8.084 1.00 0.00 N ATOM 0 H ASN B 26 0.960 5.601 3.903 1.00 0.00 H new ATOM 0 HA ASN B 26 0.363 4.307 6.422 1.00 0.00 H new ATOM 0 HB2 ASN B 26 1.448 6.645 5.589 1.00 0.00 H new ATOM 0 HB3 ASN B 26 -0.207 7.209 5.716 1.00 0.00 H new ATOM 0 HD21 ASN B 26 1.645 7.492 9.094 1.00 0.00 H new ATOM 0 HD22 ASN B 26 2.105 7.967 7.456 1.00 0.00 H new ATOM 1172 N THR B 27 -2.179 5.598 4.809 1.00 0.00 N ATOM 1173 CA THR B 27 -3.669 5.588 4.771 1.00 0.00 C ATOM 1174 C THR B 27 -4.179 4.151 4.642 1.00 0.00 C ATOM 1175 O THR B 27 -5.214 3.801 5.172 1.00 0.00 O ATOM 1176 CB THR B 27 -4.029 6.395 3.524 1.00 0.00 C ATOM 1177 OG1 THR B 27 -3.837 7.781 3.779 1.00 0.00 O ATOM 1178 CG2 THR B 27 -5.490 6.139 3.150 1.00 0.00 C ATOM 0 H THR B 27 -1.732 6.094 4.038 1.00 0.00 H new ATOM 0 HA THR B 27 -4.114 6.006 5.674 1.00 0.00 H new ATOM 0 HB THR B 27 -3.386 6.088 2.699 1.00 0.00 H new ATOM 0 HG1 THR B 27 -2.890 8.007 3.663 1.00 0.00 H new ATOM 0 HG21 THR B 27 -5.744 6.716 2.261 1.00 0.00 H new ATOM 0 HG22 THR B 27 -5.633 5.078 2.948 1.00 0.00 H new ATOM 0 HG23 THR B 27 -6.135 6.441 3.975 1.00 0.00 H new ATOM 1186 N LEU B 28 -3.459 3.314 3.944 1.00 0.00 N ATOM 1187 CA LEU B 28 -3.906 1.901 3.791 1.00 0.00 C ATOM 1188 C LEU B 28 -3.766 1.181 5.131 1.00 0.00 C ATOM 1189 O LEU B 28 -4.652 0.474 5.568 1.00 0.00 O ATOM 1190 CB LEU B 28 -2.967 1.289 2.749 1.00 0.00 C ATOM 1191 CG LEU B 28 -3.466 1.636 1.345 1.00 0.00 C ATOM 1192 CD1 LEU B 28 -2.273 1.805 0.403 1.00 0.00 C ATOM 1193 CD2 LEU B 28 -4.361 0.507 0.831 1.00 0.00 C ATOM 0 H LEU B 28 -2.584 3.547 3.475 1.00 0.00 H new ATOM 0 HA LEU B 28 -4.948 1.821 3.481 1.00 0.00 H new ATOM 0 HB2 LEU B 28 -1.954 1.667 2.890 1.00 0.00 H new ATOM 0 HB3 LEU B 28 -2.924 0.207 2.874 1.00 0.00 H new ATOM 0 HG LEU B 28 -4.033 2.566 1.382 1.00 0.00 H new ATOM 0 HD11 LEU B 28 -2.631 2.052 -0.597 1.00 0.00 H new ATOM 0 HD12 LEU B 28 -1.632 2.608 0.768 1.00 0.00 H new ATOM 0 HD13 LEU B 28 -1.705 0.876 0.365 1.00 0.00 H new ATOM 0 HD21 LEU B 28 -4.718 0.752 -0.169 1.00 0.00 H new ATOM 0 HD22 LEU B 28 -3.791 -0.422 0.796 1.00 0.00 H new ATOM 0 HD23 LEU B 28 -5.213 0.385 1.500 1.00 0.00 H new ATOM 1205 N GLN B 29 -2.662 1.378 5.794 1.00 0.00 N ATOM 1206 CA GLN B 29 -2.458 0.734 7.116 1.00 0.00 C ATOM 1207 C GLN B 29 -3.411 1.370 8.129 1.00 0.00 C ATOM 1208 O GLN B 29 -3.625 0.860 9.210 1.00 0.00 O ATOM 1209 CB GLN B 29 -1.004 1.033 7.471 1.00 0.00 C ATOM 1210 CG GLN B 29 -0.467 -0.055 8.405 1.00 0.00 C ATOM 1211 CD GLN B 29 0.943 -0.456 7.963 1.00 0.00 C ATOM 1212 OE1 GLN B 29 1.861 0.337 8.026 1.00 0.00 O ATOM 1213 NE2 GLN B 29 1.153 -1.664 7.516 1.00 0.00 N ATOM 0 H GLN B 29 -1.889 1.961 5.473 1.00 0.00 H new ATOM 0 HA GLN B 29 -2.655 -0.338 7.111 1.00 0.00 H new ATOM 0 HB2 GLN B 29 -0.400 1.078 6.565 1.00 0.00 H new ATOM 0 HB3 GLN B 29 -0.930 2.008 7.952 1.00 0.00 H new ATOM 0 HG2 GLN B 29 -0.448 0.309 9.432 1.00 0.00 H new ATOM 0 HG3 GLN B 29 -1.126 -0.923 8.387 1.00 0.00 H new ATOM 0 HE21 GLN B 29 0.382 -2.330 7.463 1.00 0.00 H new ATOM 0 HE22 GLN B 29 2.088 -1.943 7.219 1.00 0.00 H new ATOM 1222 N GLN B 30 -3.993 2.483 7.768 1.00 0.00 N ATOM 1223 CA GLN B 30 -4.948 3.166 8.682 1.00 0.00 C ATOM 1224 C GLN B 30 -6.317 2.508 8.559 1.00 0.00 C ATOM 1225 O GLN B 30 -6.916 2.096 9.533 1.00 0.00 O ATOM 1226 CB GLN B 30 -4.997 4.612 8.185 1.00 0.00 C ATOM 1227 CG GLN B 30 -3.760 5.358 8.679 1.00 0.00 C ATOM 1228 CD GLN B 30 -4.182 6.473 9.637 1.00 0.00 C ATOM 1229 OE1 GLN B 30 -4.673 7.501 9.214 1.00 0.00 O ATOM 1230 NE2 GLN B 30 -4.009 6.315 10.920 1.00 0.00 N ATOM 0 H GLN B 30 -3.845 2.949 6.873 1.00 0.00 H new ATOM 0 HA GLN B 30 -4.652 3.110 9.729 1.00 0.00 H new ATOM 0 HB2 GLN B 30 -5.038 4.633 7.096 1.00 0.00 H new ATOM 0 HB3 GLN B 30 -5.900 5.103 8.547 1.00 0.00 H new ATOM 0 HG2 GLN B 30 -3.084 4.668 9.184 1.00 0.00 H new ATOM 0 HG3 GLN B 30 -3.214 5.778 7.834 1.00 0.00 H new ATOM 0 HE21 GLN B 30 -3.597 5.453 11.277 1.00 0.00 H new ATOM 0 HE22 GLN B 30 -4.286 7.054 11.567 1.00 0.00 H new ATOM 1239 N LYS B 31 -6.807 2.386 7.358 1.00 0.00 N ATOM 1240 CA LYS B 31 -8.131 1.732 7.161 1.00 0.00 C ATOM 1241 C LYS B 31 -7.998 0.242 7.476 1.00 0.00 C ATOM 1242 O LYS B 31 -8.972 -0.451 7.693 1.00 0.00 O ATOM 1243 CB LYS B 31 -8.472 1.949 5.686 1.00 0.00 C ATOM 1244 CG LYS B 31 -9.360 3.186 5.545 1.00 0.00 C ATOM 1245 CD LYS B 31 -9.446 3.588 4.071 1.00 0.00 C ATOM 1246 CE LYS B 31 -9.665 5.099 3.967 1.00 0.00 C ATOM 1247 NZ LYS B 31 -10.532 5.280 2.770 1.00 0.00 N ATOM 0 H LYS B 31 -6.350 2.710 6.506 1.00 0.00 H new ATOM 0 HA LYS B 31 -8.908 2.139 7.808 1.00 0.00 H new ATOM 0 HB2 LYS B 31 -7.558 2.076 5.105 1.00 0.00 H new ATOM 0 HB3 LYS B 31 -8.984 1.073 5.287 1.00 0.00 H new ATOM 0 HG2 LYS B 31 -10.356 2.978 5.935 1.00 0.00 H new ATOM 0 HG3 LYS B 31 -8.953 4.008 6.134 1.00 0.00 H new ATOM 0 HD2 LYS B 31 -8.530 3.306 3.552 1.00 0.00 H new ATOM 0 HD3 LYS B 31 -10.264 3.057 3.585 1.00 0.00 H new ATOM 0 HE2 LYS B 31 -10.144 5.491 4.864 1.00 0.00 H new ATOM 0 HE3 LYS B 31 -8.719 5.628 3.853 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 -10.727 6.292 2.632 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 -10.048 4.903 1.930 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 -11.428 4.771 2.910 1.00 0.00 H new ATOM 1261 N LEU B 32 -6.789 -0.247 7.514 1.00 0.00 N ATOM 1262 CA LEU B 32 -6.566 -1.685 7.826 1.00 0.00 C ATOM 1263 C LEU B 32 -6.599 -1.888 9.341 1.00 0.00 C ATOM 1264 O LEU B 32 -7.223 -2.801 9.844 1.00 0.00 O ATOM 1265 CB LEU B 32 -5.175 -1.994 7.276 1.00 0.00 C ATOM 1266 CG LEU B 32 -5.057 -3.489 6.984 1.00 0.00 C ATOM 1267 CD1 LEU B 32 -6.202 -3.923 6.068 1.00 0.00 C ATOM 1268 CD2 LEU B 32 -3.720 -3.762 6.292 1.00 0.00 C ATOM 0 H LEU B 32 -5.941 0.293 7.341 1.00 0.00 H new ATOM 0 HA LEU B 32 -7.327 -2.334 7.393 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -4.998 -1.421 6.366 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -4.414 -1.693 7.996 1.00 0.00 H new ATOM 0 HG LEU B 32 -5.109 -4.049 7.918 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -6.117 -4.990 5.860 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -7.155 -3.723 6.558 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -6.151 -3.366 5.133 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -3.630 -4.828 6.081 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -3.673 -3.202 5.358 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -2.903 -3.451 6.943 1.00 0.00 H new ATOM 1280 N GLU B 33 -5.936 -1.033 10.074 1.00 0.00 N ATOM 1281 CA GLU B 33 -5.935 -1.166 11.557 1.00 0.00 C ATOM 1282 C GLU B 33 -7.313 -0.794 12.097 1.00 0.00 C ATOM 1283 O GLU B 33 -7.679 -1.145 13.201 1.00 0.00 O ATOM 1284 CB GLU B 33 -4.879 -0.174 12.045 1.00 0.00 C ATOM 1285 CG GLU B 33 -4.949 -0.060 13.570 1.00 0.00 C ATOM 1286 CD GLU B 33 -3.643 -0.570 14.180 1.00 0.00 C ATOM 1287 OE1 GLU B 33 -2.735 0.228 14.338 1.00 0.00 O ATOM 1288 OE2 GLU B 33 -3.573 -1.752 14.478 1.00 0.00 O ATOM 0 H GLU B 33 -5.396 -0.249 9.708 1.00 0.00 H new ATOM 0 HA GLU B 33 -5.715 -2.180 11.891 1.00 0.00 H new ATOM 0 HB2 GLU B 33 -3.886 -0.505 11.740 1.00 0.00 H new ATOM 0 HB3 GLU B 33 -5.044 0.802 11.589 1.00 0.00 H new ATOM 0 HG2 GLU B 33 -5.118 0.977 13.860 1.00 0.00 H new ATOM 0 HG3 GLU B 33 -5.791 -0.639 13.950 1.00 0.00 H new ATOM 1295 N ALA B 34 -8.089 -0.109 11.306 1.00 0.00 N ATOM 1296 CA ALA B 34 -9.457 0.265 11.745 1.00 0.00 C ATOM 1297 C ALA B 34 -10.400 -0.848 11.311 1.00 0.00 C ATOM 1298 O ALA B 34 -11.362 -1.169 11.977 1.00 0.00 O ATOM 1299 CB ALA B 34 -9.778 1.573 11.019 1.00 0.00 C ATOM 0 H ALA B 34 -7.832 0.208 10.371 1.00 0.00 H new ATOM 0 HA ALA B 34 -9.551 0.396 12.823 1.00 0.00 H new ATOM 0 HB1 ALA B 34 -10.777 1.908 11.298 1.00 0.00 H new ATOM 0 HB2 ALA B 34 -9.049 2.333 11.300 1.00 0.00 H new ATOM 0 HB3 ALA B 34 -9.737 1.411 9.942 1.00 0.00 H new ATOM 1305 N VAL B 35 -10.095 -1.461 10.201 1.00 0.00 N ATOM 1306 CA VAL B 35 -10.929 -2.585 9.710 1.00 0.00 C ATOM 1307 C VAL B 35 -10.841 -3.730 10.720 1.00 0.00 C ATOM 1308 O VAL B 35 -11.823 -4.369 11.037 1.00 0.00 O ATOM 1309 CB VAL B 35 -10.299 -2.970 8.364 1.00 0.00 C ATOM 1310 CG1 VAL B 35 -10.397 -4.479 8.131 1.00 0.00 C ATOM 1311 CG2 VAL B 35 -11.029 -2.238 7.238 1.00 0.00 C ATOM 0 H VAL B 35 -9.297 -1.227 9.611 1.00 0.00 H new ATOM 0 HA VAL B 35 -11.984 -2.338 9.593 1.00 0.00 H new ATOM 0 HB VAL B 35 -9.247 -2.686 8.377 1.00 0.00 H new ATOM 0 HG11 VAL B 35 -9.944 -4.729 7.171 1.00 0.00 H new ATOM 0 HG12 VAL B 35 -9.872 -5.005 8.928 1.00 0.00 H new ATOM 0 HG13 VAL B 35 -11.445 -4.779 8.127 1.00 0.00 H new ATOM 0 HG21 VAL B 35 -10.585 -2.509 6.280 1.00 0.00 H new ATOM 0 HG22 VAL B 35 -12.082 -2.521 7.243 1.00 0.00 H new ATOM 0 HG23 VAL B 35 -10.942 -1.162 7.387 1.00 0.00 H new ATOM 1321 N ALA B 36 -9.666 -3.983 11.234 1.00 0.00 N ATOM 1322 CA ALA B 36 -9.514 -5.074 12.231 1.00 0.00 C ATOM 1323 C ALA B 36 -10.253 -4.693 13.513 1.00 0.00 C ATOM 1324 O ALA B 36 -10.712 -5.540 14.255 1.00 0.00 O ATOM 1325 CB ALA B 36 -8.011 -5.175 12.489 1.00 0.00 C ATOM 0 H ALA B 36 -8.809 -3.480 11.005 1.00 0.00 H new ATOM 0 HA ALA B 36 -9.925 -6.022 11.883 1.00 0.00 H new ATOM 0 HB1 ALA B 36 -7.819 -5.962 13.218 1.00 0.00 H new ATOM 0 HB2 ALA B 36 -7.497 -5.410 11.557 1.00 0.00 H new ATOM 0 HB3 ALA B 36 -7.644 -4.225 12.876 1.00 0.00 H new ATOM 1331 N LYS B 37 -10.383 -3.419 13.773 1.00 0.00 N ATOM 1332 CA LYS B 37 -11.104 -2.983 15.002 1.00 0.00 C ATOM 1333 C LYS B 37 -12.611 -3.120 14.791 1.00 0.00 C ATOM 1334 O LYS B 37 -13.359 -3.357 15.717 1.00 0.00 O ATOM 1335 CB LYS B 37 -10.714 -1.518 15.198 1.00 0.00 C ATOM 1336 CG LYS B 37 -9.849 -1.382 16.454 1.00 0.00 C ATOM 1337 CD LYS B 37 -8.696 -0.415 16.177 1.00 0.00 C ATOM 1338 CE LYS B 37 -7.959 -0.115 17.485 1.00 0.00 C ATOM 1339 NZ LYS B 37 -7.259 1.178 17.246 1.00 0.00 N ATOM 0 H LYS B 37 -10.022 -2.665 13.189 1.00 0.00 H new ATOM 0 HA LYS B 37 -10.846 -3.585 15.874 1.00 0.00 H new ATOM 0 HB2 LYS B 37 -10.168 -1.157 14.327 1.00 0.00 H new ATOM 0 HB3 LYS B 37 -11.608 -0.902 15.291 1.00 0.00 H new ATOM 0 HG2 LYS B 37 -10.452 -1.017 17.286 1.00 0.00 H new ATOM 0 HG3 LYS B 37 -9.458 -2.357 16.747 1.00 0.00 H new ATOM 0 HD2 LYS B 37 -8.009 -0.849 15.451 1.00 0.00 H new ATOM 0 HD3 LYS B 37 -9.078 0.508 15.742 1.00 0.00 H new ATOM 0 HE2 LYS B 37 -8.654 -0.039 18.321 1.00 0.00 H new ATOM 0 HE3 LYS B 37 -7.252 -0.907 17.730 1.00 0.00 H new ATOM 0 HZ1 LYS B 37 -6.731 1.450 18.100 1.00 0.00 H new ATOM 0 HZ2 LYS B 37 -6.599 1.073 16.449 1.00 0.00 H new ATOM 0 HZ3 LYS B 37 -7.958 1.915 17.022 1.00 0.00 H new ATOM 1353 N ARG B 38 -13.062 -2.991 13.576 1.00 0.00 N ATOM 1354 CA ARG B 38 -14.514 -3.139 13.312 1.00 0.00 C ATOM 1355 C ARG B 38 -14.852 -4.625 13.301 1.00 0.00 C ATOM 1356 O ARG B 38 -15.909 -5.040 13.730 1.00 0.00 O ATOM 1357 CB ARG B 38 -14.743 -2.516 11.934 1.00 0.00 C ATOM 1358 CG ARG B 38 -13.970 -1.201 11.829 1.00 0.00 C ATOM 1359 CD ARG B 38 -14.936 -0.064 11.492 1.00 0.00 C ATOM 1360 NE ARG B 38 -14.229 0.750 10.464 1.00 0.00 N ATOM 1361 CZ ARG B 38 -14.871 1.170 9.409 1.00 0.00 C ATOM 1362 NH1 ARG B 38 -15.863 2.010 9.539 1.00 0.00 N ATOM 1363 NH2 ARG B 38 -14.523 0.754 8.222 1.00 0.00 N ATOM 0 H ARG B 38 -12.488 -2.790 12.757 1.00 0.00 H new ATOM 0 HA ARG B 38 -15.139 -2.657 14.064 1.00 0.00 H new ATOM 0 HB2 ARG B 38 -14.417 -3.204 11.154 1.00 0.00 H new ATOM 0 HB3 ARG B 38 -15.807 -2.337 11.777 1.00 0.00 H new ATOM 0 HG2 ARG B 38 -13.459 -0.991 12.769 1.00 0.00 H new ATOM 0 HG3 ARG B 38 -13.202 -1.279 11.060 1.00 0.00 H new ATOM 0 HD2 ARG B 38 -15.881 -0.449 11.109 1.00 0.00 H new ATOM 0 HD3 ARG B 38 -15.169 0.531 12.375 1.00 0.00 H new ATOM 0 HE ARG B 38 -13.242 0.979 10.585 1.00 0.00 H new ATOM 0 HH11 ARG B 38 -16.136 2.338 10.466 1.00 0.00 H new ATOM 0 HH12 ARG B 38 -16.365 2.338 8.714 1.00 0.00 H new ATOM 0 HH21 ARG B 38 -13.748 0.099 8.118 1.00 0.00 H new ATOM 0 HH22 ARG B 38 -15.026 1.084 7.398 1.00 0.00 H new ATOM 1377 N ILE B 39 -13.934 -5.431 12.834 1.00 0.00 N ATOM 1378 CA ILE B 39 -14.163 -6.901 12.808 1.00 0.00 C ATOM 1379 C ILE B 39 -14.344 -7.395 14.240 1.00 0.00 C ATOM 1380 O ILE B 39 -15.266 -8.122 14.543 1.00 0.00 O ATOM 1381 CB ILE B 39 -12.894 -7.491 12.179 1.00 0.00 C ATOM 1382 CG1 ILE B 39 -12.979 -7.384 10.648 1.00 0.00 C ATOM 1383 CG2 ILE B 39 -12.741 -8.960 12.589 1.00 0.00 C ATOM 1384 CD1 ILE B 39 -13.841 -8.516 10.080 1.00 0.00 C ATOM 0 H ILE B 39 -13.031 -5.129 12.468 1.00 0.00 H new ATOM 0 HA ILE B 39 -15.051 -7.189 12.245 1.00 0.00 H new ATOM 0 HB ILE B 39 -12.027 -6.932 12.532 1.00 0.00 H new ATOM 0 HG12 ILE B 39 -13.403 -6.420 10.368 1.00 0.00 H new ATOM 0 HG13 ILE B 39 -11.978 -7.429 10.218 1.00 0.00 H new ATOM 0 HG21 ILE B 39 -11.838 -9.371 12.138 1.00 0.00 H new ATOM 0 HG22 ILE B 39 -12.669 -9.029 13.674 1.00 0.00 H new ATOM 0 HG23 ILE B 39 -13.607 -9.526 12.246 1.00 0.00 H new ATOM 0 HD11 ILE B 39 -13.891 -8.426 8.995 1.00 0.00 H new ATOM 0 HD12 ILE B 39 -13.400 -9.477 10.344 1.00 0.00 H new ATOM 0 HD13 ILE B 39 -14.846 -8.452 10.496 1.00 0.00 H new ATOM 1396 N GLU B 40 -13.483 -6.980 15.129 1.00 0.00 N ATOM 1397 CA GLU B 40 -13.626 -7.403 16.546 1.00 0.00 C ATOM 1398 C GLU B 40 -14.934 -6.834 17.079 1.00 0.00 C ATOM 1399 O GLU B 40 -15.618 -7.449 17.874 1.00 0.00 O ATOM 1400 CB GLU B 40 -12.422 -6.807 17.281 1.00 0.00 C ATOM 1401 CG GLU B 40 -12.372 -5.295 17.061 1.00 0.00 C ATOM 1402 CD GLU B 40 -11.372 -4.668 18.036 1.00 0.00 C ATOM 1403 OE1 GLU B 40 -10.321 -5.254 18.232 1.00 0.00 O ATOM 1404 OE2 GLU B 40 -11.677 -3.615 18.572 1.00 0.00 O ATOM 0 H GLU B 40 -12.690 -6.369 14.934 1.00 0.00 H new ATOM 0 HA GLU B 40 -13.650 -8.485 16.674 1.00 0.00 H new ATOM 0 HB2 GLU B 40 -12.491 -7.026 18.347 1.00 0.00 H new ATOM 0 HB3 GLU B 40 -11.501 -7.266 16.920 1.00 0.00 H new ATOM 0 HG2 GLU B 40 -12.080 -5.076 16.034 1.00 0.00 H new ATOM 0 HG3 GLU B 40 -13.361 -4.862 17.210 1.00 0.00 H new ATOM 1411 N ALA B 41 -15.301 -5.670 16.615 1.00 0.00 N ATOM 1412 CA ALA B 41 -16.585 -5.070 17.063 1.00 0.00 C ATOM 1413 C ALA B 41 -17.706 -6.068 16.778 1.00 0.00 C ATOM 1414 O ALA B 41 -18.632 -6.222 17.550 1.00 0.00 O ATOM 1415 CB ALA B 41 -16.753 -3.801 16.222 1.00 0.00 C ATOM 0 H ALA B 41 -14.768 -5.112 15.948 1.00 0.00 H new ATOM 0 HA ALA B 41 -16.606 -4.836 18.127 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -17.682 -3.302 16.497 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -15.913 -3.130 16.404 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -16.783 -4.066 15.165 1.00 0.00 H new ATOM 1421 N LEU B 42 -17.603 -6.772 15.682 1.00 0.00 N ATOM 1422 CA LEU B 42 -18.635 -7.793 15.349 1.00 0.00 C ATOM 1423 C LEU B 42 -18.401 -9.021 16.223 1.00 0.00 C ATOM 1424 O LEU B 42 -19.326 -9.667 16.663 1.00 0.00 O ATOM 1425 CB LEU B 42 -18.406 -8.152 13.870 1.00 0.00 C ATOM 1426 CG LEU B 42 -19.016 -7.103 12.916 1.00 0.00 C ATOM 1427 CD1 LEU B 42 -20.175 -6.348 13.576 1.00 0.00 C ATOM 1428 CD2 LEU B 42 -17.930 -6.111 12.504 1.00 0.00 C ATOM 0 H LEU B 42 -16.847 -6.683 15.003 1.00 0.00 H new ATOM 0 HA LEU B 42 -19.650 -7.433 15.517 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -17.336 -8.236 13.679 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -18.844 -9.128 13.662 1.00 0.00 H new ATOM 0 HG LEU B 42 -19.409 -7.622 12.042 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -20.580 -5.618 12.875 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -20.957 -7.054 13.856 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -19.814 -5.834 14.467 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -18.354 -5.367 11.830 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -17.535 -5.615 13.391 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -17.125 -6.643 11.997 1.00 0.00 H new ATOM 1440 N GLU B 43 -17.162 -9.336 16.482 1.00 0.00 N ATOM 1441 CA GLU B 43 -16.845 -10.516 17.337 1.00 0.00 C ATOM 1442 C GLU B 43 -17.361 -10.282 18.755 1.00 0.00 C ATOM 1443 O GLU B 43 -17.494 -11.201 19.539 1.00 0.00 O ATOM 1444 CB GLU B 43 -15.322 -10.606 17.318 1.00 0.00 C ATOM 1445 CG GLU B 43 -14.857 -10.723 15.869 1.00 0.00 C ATOM 1446 CD GLU B 43 -13.771 -11.794 15.759 1.00 0.00 C ATOM 1447 OE1 GLU B 43 -12.711 -11.598 16.332 1.00 0.00 O ATOM 1448 OE2 GLU B 43 -14.016 -12.793 15.103 1.00 0.00 O ATOM 0 H GLU B 43 -16.350 -8.824 16.136 1.00 0.00 H new ATOM 0 HA GLU B 43 -17.310 -11.435 16.981 1.00 0.00 H new ATOM 0 HB2 GLU B 43 -14.885 -9.723 17.785 1.00 0.00 H new ATOM 0 HB3 GLU B 43 -14.987 -11.469 17.893 1.00 0.00 H new ATOM 0 HG2 GLU B 43 -15.700 -10.979 15.227 1.00 0.00 H new ATOM 0 HG3 GLU B 43 -14.472 -9.764 15.522 1.00 0.00 H new ATOM 1455 N ASN B 44 -17.662 -9.059 19.082 1.00 0.00 N ATOM 1456 CA ASN B 44 -18.186 -8.758 20.442 1.00 0.00 C ATOM 1457 C ASN B 44 -19.623 -9.263 20.549 1.00 0.00 C ATOM 1458 O ASN B 44 -20.107 -9.582 21.616 1.00 0.00 O ATOM 1459 CB ASN B 44 -18.136 -7.233 20.557 1.00 0.00 C ATOM 1460 CG ASN B 44 -16.681 -6.758 20.659 1.00 0.00 C ATOM 1461 OD1 ASN B 44 -15.704 -7.623 20.576 1.00 0.00 O flip ATOM 1462 ND2 ASN B 44 -16.429 -5.580 20.817 1.00 0.00 N flip ATOM 0 H ASN B 44 -17.568 -8.252 18.465 1.00 0.00 H new ATOM 0 HA ASN B 44 -17.612 -9.237 21.235 1.00 0.00 H new ATOM 0 HB2 ASN B 44 -18.614 -6.779 19.689 1.00 0.00 H new ATOM 0 HB3 ASN B 44 -18.695 -6.908 21.435 1.00 0.00 H new ATOM 0 HD21 ASN B 44 -17.187 -4.901 20.882 1.00 0.00 H new ATOM 0 HD22 ASN B 44 -15.459 -5.270 20.884 1.00 0.00 H new ATOM 1469 N LYS B 45 -20.306 -9.343 19.440 1.00 0.00 N ATOM 1470 CA LYS B 45 -21.710 -9.835 19.462 1.00 0.00 C ATOM 1471 C LYS B 45 -21.792 -11.188 18.751 1.00 0.00 C ATOM 1472 O LYS B 45 -22.797 -11.866 18.803 1.00 0.00 O ATOM 1473 CB LYS B 45 -22.517 -8.778 18.706 1.00 0.00 C ATOM 1474 CG LYS B 45 -22.698 -7.544 19.592 1.00 0.00 C ATOM 1475 CD LYS B 45 -21.332 -6.930 19.897 1.00 0.00 C ATOM 1476 CE LYS B 45 -21.478 -5.416 20.061 1.00 0.00 C ATOM 1477 NZ LYS B 45 -21.317 -5.174 21.522 1.00 0.00 N ATOM 0 H LYS B 45 -19.950 -9.088 18.519 1.00 0.00 H new ATOM 0 HA LYS B 45 -22.087 -9.978 20.475 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -22.004 -8.505 17.784 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -23.489 -9.181 18.423 1.00 0.00 H new ATOM 0 HG2 LYS B 45 -23.333 -6.813 19.091 1.00 0.00 H new ATOM 0 HG3 LYS B 45 -23.200 -7.820 20.520 1.00 0.00 H new ATOM 0 HD2 LYS B 45 -20.920 -7.367 20.807 1.00 0.00 H new ATOM 0 HD3 LYS B 45 -20.633 -7.153 19.091 1.00 0.00 H new ATOM 0 HE2 LYS B 45 -20.722 -4.881 19.486 1.00 0.00 H new ATOM 0 HE3 LYS B 45 -22.450 -5.072 19.708 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 -21.404 -4.156 21.717 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 -22.054 -5.691 22.043 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 -20.380 -5.506 21.828 1.00 0.00 H new ATOM 1491 N ILE B 46 -20.734 -11.588 18.096 1.00 0.00 N ATOM 1492 CA ILE B 46 -20.747 -12.902 17.392 1.00 0.00 C ATOM 1493 C ILE B 46 -19.950 -13.924 18.205 1.00 0.00 C ATOM 1494 O ILE B 46 -20.029 -15.114 17.975 1.00 0.00 O ATOM 1495 CB ILE B 46 -20.074 -12.648 16.034 1.00 0.00 C ATOM 1496 CG1 ILE B 46 -20.912 -11.679 15.176 1.00 0.00 C ATOM 1497 CG2 ILE B 46 -19.922 -13.972 15.285 1.00 0.00 C ATOM 1498 CD1 ILE B 46 -22.402 -11.809 15.511 1.00 0.00 C ATOM 0 H ILE B 46 -19.863 -11.062 18.019 1.00 0.00 H new ATOM 0 HA ILE B 46 -21.755 -13.297 17.267 1.00 0.00 H new ATOM 0 HB ILE B 46 -19.096 -12.201 16.214 1.00 0.00 H new ATOM 0 HG12 ILE B 46 -20.583 -10.654 15.350 1.00 0.00 H new ATOM 0 HG13 ILE B 46 -20.752 -11.890 14.119 1.00 0.00 H new ATOM 0 HG21 ILE B 46 -19.445 -13.792 14.322 1.00 0.00 H new ATOM 0 HG22 ILE B 46 -19.308 -14.654 15.873 1.00 0.00 H new ATOM 0 HG23 ILE B 46 -20.905 -14.415 15.126 1.00 0.00 H new ATOM 0 HD11 ILE B 46 -22.975 -11.117 14.894 1.00 0.00 H new ATOM 0 HD12 ILE B 46 -22.732 -12.829 15.314 1.00 0.00 H new ATOM 0 HD13 ILE B 46 -22.560 -11.574 16.564 1.00 0.00 H new ATOM 1641 N CYS C 9 22.518 11.208 -6.683 1.00 0.00 N ATOM 1642 CA CYS C 9 21.030 11.206 -6.740 1.00 0.00 C ATOM 1643 C CYS C 9 20.476 9.961 -6.042 1.00 0.00 C ATOM 1644 O CYS C 9 19.555 9.328 -6.518 1.00 0.00 O ATOM 1645 CB CYS C 9 20.698 11.181 -8.232 1.00 0.00 C ATOM 1646 SG CYS C 9 20.561 12.878 -8.849 1.00 0.00 S ATOM 0 HA CYS C 9 20.592 12.069 -6.238 1.00 0.00 H new ATOM 0 HB2 CYS C 9 21.474 10.645 -8.779 1.00 0.00 H new ATOM 0 HB3 CYS C 9 19.763 10.646 -8.398 1.00 0.00 H new ATOM 1651 N GLU C 10 21.032 9.605 -4.914 1.00 0.00 N ATOM 1652 CA GLU C 10 20.536 8.403 -4.184 1.00 0.00 C ATOM 1653 C GLU C 10 20.338 7.234 -5.154 1.00 0.00 C ATOM 1654 O GLU C 10 19.341 6.541 -5.108 1.00 0.00 O ATOM 1655 CB GLU C 10 19.197 8.831 -3.585 1.00 0.00 C ATOM 1656 CG GLU C 10 19.445 9.682 -2.337 1.00 0.00 C ATOM 1657 CD GLU C 10 18.730 11.027 -2.484 1.00 0.00 C ATOM 1658 OE1 GLU C 10 19.304 11.917 -3.089 1.00 0.00 O ATOM 1659 OE2 GLU C 10 17.621 11.144 -1.988 1.00 0.00 O ATOM 0 H GLU C 10 21.807 10.095 -4.467 1.00 0.00 H new ATOM 0 HA GLU C 10 21.238 8.066 -3.421 1.00 0.00 H new ATOM 0 HB2 GLU C 10 18.624 9.399 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU C 10 18.604 7.953 -3.328 1.00 0.00 H new ATOM 0 HG2 GLU C 10 19.083 9.161 -1.451 1.00 0.00 H new ATOM 0 HG3 GLU C 10 20.515 9.840 -2.199 1.00 0.00 H new ATOM 1666 N CYS C 11 21.276 7.007 -6.031 1.00 0.00 N ATOM 1667 CA CYS C 11 21.134 5.884 -6.997 1.00 0.00 C ATOM 1668 C CYS C 11 20.691 4.612 -6.271 1.00 0.00 C ATOM 1669 O CYS C 11 20.020 3.767 -6.830 1.00 0.00 O ATOM 1670 CB CYS C 11 22.524 5.698 -7.605 1.00 0.00 C ATOM 1671 SG CYS C 11 22.682 6.730 -9.082 1.00 0.00 S ATOM 0 H CYS C 11 22.134 7.551 -6.120 1.00 0.00 H new ATOM 0 HA CYS C 11 20.383 6.092 -7.759 1.00 0.00 H new ATOM 0 HB2 CYS C 11 23.289 5.967 -6.877 1.00 0.00 H new ATOM 0 HB3 CYS C 11 22.683 4.651 -7.862 1.00 0.00 H new ATOM 0 HG CYS C 11 23.865 6.573 -9.597 1.00 0.00 H new ATOM 1676 N LYS C 12 21.062 4.468 -5.029 1.00 0.00 N ATOM 1677 CA LYS C 12 20.663 3.250 -4.268 1.00 0.00 C ATOM 1678 C LYS C 12 19.870 3.646 -3.021 1.00 0.00 C ATOM 1679 O LYS C 12 19.299 2.814 -2.350 1.00 0.00 O ATOM 1680 CB LYS C 12 21.977 2.575 -3.868 1.00 0.00 C ATOM 1681 CG LYS C 12 22.955 2.604 -5.046 1.00 0.00 C ATOM 1682 CD LYS C 12 22.270 2.044 -6.293 1.00 0.00 C ATOM 1683 CE LYS C 12 23.169 0.983 -6.931 1.00 0.00 C ATOM 1684 NZ LYS C 12 23.144 1.286 -8.389 1.00 0.00 N ATOM 0 H LYS C 12 21.624 5.141 -4.508 1.00 0.00 H new ATOM 0 HA LYS C 12 20.029 2.588 -4.858 1.00 0.00 H new ATOM 0 HB2 LYS C 12 22.412 3.086 -3.009 1.00 0.00 H new ATOM 0 HB3 LYS C 12 21.790 1.545 -3.564 1.00 0.00 H new ATOM 0 HG2 LYS C 12 23.289 3.625 -5.230 1.00 0.00 H new ATOM 0 HG3 LYS C 12 23.842 2.016 -4.810 1.00 0.00 H new ATOM 0 HD2 LYS C 12 21.306 1.609 -6.028 1.00 0.00 H new ATOM 0 HD3 LYS C 12 22.073 2.846 -7.005 1.00 0.00 H new ATOM 0 HE2 LYS C 12 24.183 1.034 -6.534 1.00 0.00 H new ATOM 0 HE3 LYS C 12 22.798 -0.022 -6.730 1.00 0.00 H new ATOM 0 HZ1 LYS C 12 23.739 0.600 -8.896 1.00 0.00 H new ATOM 0 HZ2 LYS C 12 22.167 1.223 -8.740 1.00 0.00 H new ATOM 0 HZ3 LYS C 12 23.509 2.246 -8.550 1.00 0.00 H new ATOM 1698 N SER C 13 19.833 4.910 -2.709 1.00 0.00 N ATOM 1699 CA SER C 13 19.078 5.361 -1.503 1.00 0.00 C ATOM 1700 C SER C 13 17.579 5.431 -1.812 1.00 0.00 C ATOM 1701 O SER C 13 16.743 5.215 -0.956 1.00 0.00 O ATOM 1702 CB SER C 13 19.633 6.751 -1.196 1.00 0.00 C ATOM 1703 OG SER C 13 20.730 6.631 -0.298 1.00 0.00 O ATOM 0 H SER C 13 20.293 5.653 -3.236 1.00 0.00 H new ATOM 0 HA SER C 13 19.192 4.680 -0.660 1.00 0.00 H new ATOM 0 HB2 SER C 13 19.953 7.239 -2.117 1.00 0.00 H new ATOM 0 HB3 SER C 13 18.856 7.377 -0.757 1.00 0.00 H new ATOM 0 HG SER C 13 21.090 7.521 -0.100 1.00 0.00 H new ATOM 1709 N ILE C 14 17.241 5.724 -3.033 1.00 0.00 N ATOM 1710 CA ILE C 14 15.807 5.807 -3.427 1.00 0.00 C ATOM 1711 C ILE C 14 15.259 4.403 -3.659 1.00 0.00 C ATOM 1712 O ILE C 14 14.141 4.082 -3.304 1.00 0.00 O ATOM 1713 CB ILE C 14 15.823 6.589 -4.736 1.00 0.00 C ATOM 1714 CG1 ILE C 14 16.054 8.068 -4.437 1.00 0.00 C ATOM 1715 CG2 ILE C 14 14.489 6.410 -5.468 1.00 0.00 C ATOM 1716 CD1 ILE C 14 16.754 8.725 -5.628 1.00 0.00 C ATOM 0 H ILE C 14 17.904 5.912 -3.785 1.00 0.00 H new ATOM 0 HA ILE C 14 15.183 6.279 -2.668 1.00 0.00 H new ATOM 0 HB ILE C 14 16.627 6.216 -5.371 1.00 0.00 H new ATOM 0 HG12 ILE C 14 15.103 8.564 -4.242 1.00 0.00 H new ATOM 0 HG13 ILE C 14 16.661 8.178 -3.538 1.00 0.00 H new ATOM 0 HG21 ILE C 14 14.508 6.972 -6.402 1.00 0.00 H new ATOM 0 HG22 ILE C 14 14.331 5.353 -5.683 1.00 0.00 H new ATOM 0 HG23 ILE C 14 13.677 6.778 -4.840 1.00 0.00 H new ATOM 0 HD11 ILE C 14 16.919 9.781 -5.415 1.00 0.00 H new ATOM 0 HD12 ILE C 14 17.712 8.236 -5.802 1.00 0.00 H new ATOM 0 HD13 ILE C 14 16.130 8.627 -6.516 1.00 0.00 H new ATOM 1728 N VAL C 15 16.056 3.561 -4.237 1.00 0.00 N ATOM 1729 CA VAL C 15 15.613 2.168 -4.492 1.00 0.00 C ATOM 1730 C VAL C 15 15.783 1.377 -3.199 1.00 0.00 C ATOM 1731 O VAL C 15 15.163 0.351 -2.984 1.00 0.00 O ATOM 1732 CB VAL C 15 16.523 1.643 -5.613 1.00 0.00 C ATOM 1733 CG1 VAL C 15 15.770 0.584 -6.419 1.00 0.00 C ATOM 1734 CG2 VAL C 15 16.914 2.794 -6.550 1.00 0.00 C ATOM 0 H VAL C 15 17.003 3.777 -4.547 1.00 0.00 H new ATOM 0 HA VAL C 15 14.569 2.086 -4.794 1.00 0.00 H new ATOM 0 HB VAL C 15 17.421 1.211 -5.172 1.00 0.00 H new ATOM 0 HG11 VAL C 15 16.412 0.209 -7.216 1.00 0.00 H new ATOM 0 HG12 VAL C 15 15.487 -0.239 -5.763 1.00 0.00 H new ATOM 0 HG13 VAL C 15 14.874 1.027 -6.854 1.00 0.00 H new ATOM 0 HG21 VAL C 15 17.559 2.415 -7.342 1.00 0.00 H new ATOM 0 HG22 VAL C 15 16.015 3.227 -6.990 1.00 0.00 H new ATOM 0 HG23 VAL C 15 17.446 3.559 -5.984 1.00 0.00 H new ATOM 1744 N LYS C 16 16.586 1.891 -2.310 1.00 0.00 N ATOM 1745 CA LYS C 16 16.768 1.227 -0.998 1.00 0.00 C ATOM 1746 C LYS C 16 15.495 1.468 -0.199 1.00 0.00 C ATOM 1747 O LYS C 16 14.976 0.588 0.459 1.00 0.00 O ATOM 1748 CB LYS C 16 17.966 1.923 -0.353 1.00 0.00 C ATOM 1749 CG LYS C 16 17.947 1.679 1.152 1.00 0.00 C ATOM 1750 CD LYS C 16 17.659 2.991 1.885 1.00 0.00 C ATOM 1751 CE LYS C 16 18.570 3.100 3.110 1.00 0.00 C ATOM 1752 NZ LYS C 16 17.780 3.866 4.112 1.00 0.00 N ATOM 0 H LYS C 16 17.125 2.747 -2.440 1.00 0.00 H new ATOM 0 HA LYS C 16 16.945 0.153 -1.060 1.00 0.00 H new ATOM 0 HB2 LYS C 16 18.894 1.545 -0.782 1.00 0.00 H new ATOM 0 HB3 LYS C 16 17.933 2.993 -0.559 1.00 0.00 H new ATOM 0 HG2 LYS C 16 17.187 0.938 1.400 1.00 0.00 H new ATOM 0 HG3 LYS C 16 18.905 1.273 1.476 1.00 0.00 H new ATOM 0 HD2 LYS C 16 17.825 3.837 1.218 1.00 0.00 H new ATOM 0 HD3 LYS C 16 16.614 3.027 2.191 1.00 0.00 H new ATOM 0 HE2 LYS C 16 18.840 2.115 3.490 1.00 0.00 H new ATOM 0 HE3 LYS C 16 19.500 3.613 2.865 1.00 0.00 H new ATOM 0 HZ1 LYS C 16 18.340 3.981 4.981 1.00 0.00 H new ATOM 0 HZ2 LYS C 16 17.544 4.802 3.726 1.00 0.00 H new ATOM 0 HZ3 LYS C 16 16.904 3.350 4.331 1.00 0.00 H new ATOM 1766 N PHE C 17 14.963 2.657 -0.301 1.00 0.00 N ATOM 1767 CA PHE C 17 13.690 2.961 0.400 1.00 0.00 C ATOM 1768 C PHE C 17 12.584 2.131 -0.254 1.00 0.00 C ATOM 1769 O PHE C 17 11.634 1.722 0.383 1.00 0.00 O ATOM 1770 CB PHE C 17 13.462 4.467 0.185 1.00 0.00 C ATOM 1771 CG PHE C 17 11.979 4.773 0.127 1.00 0.00 C ATOM 1772 CD1 PHE C 17 11.307 4.710 -1.099 1.00 0.00 C ATOM 1773 CD2 PHE C 17 11.279 5.116 1.291 1.00 0.00 C ATOM 1774 CE1 PHE C 17 9.936 4.988 -1.165 1.00 0.00 C ATOM 1775 CE2 PHE C 17 9.907 5.396 1.225 1.00 0.00 C ATOM 1776 CZ PHE C 17 9.236 5.330 -0.004 1.00 0.00 C ATOM 0 H PHE C 17 15.358 3.428 -0.840 1.00 0.00 H new ATOM 0 HA PHE C 17 13.704 2.724 1.464 1.00 0.00 H new ATOM 0 HB2 PHE C 17 13.925 5.031 0.995 1.00 0.00 H new ATOM 0 HB3 PHE C 17 13.942 4.786 -0.740 1.00 0.00 H new ATOM 0 HD1 PHE C 17 11.847 4.446 -1.996 1.00 0.00 H new ATOM 0 HD2 PHE C 17 11.796 5.165 2.238 1.00 0.00 H new ATOM 0 HE1 PHE C 17 9.420 4.938 -2.112 1.00 0.00 H new ATOM 0 HE2 PHE C 17 9.367 5.663 2.121 1.00 0.00 H new ATOM 0 HZ PHE C 17 8.178 5.543 -0.054 1.00 0.00 H new ATOM 1786 N GLN C 18 12.715 1.878 -1.530 1.00 0.00 N ATOM 1787 CA GLN C 18 11.683 1.068 -2.237 1.00 0.00 C ATOM 1788 C GLN C 18 11.569 -0.308 -1.586 1.00 0.00 C ATOM 1789 O GLN C 18 10.487 -0.803 -1.346 1.00 0.00 O ATOM 1790 CB GLN C 18 12.179 0.948 -3.676 1.00 0.00 C ATOM 1791 CG GLN C 18 11.841 2.231 -4.433 1.00 0.00 C ATOM 1792 CD GLN C 18 11.992 1.993 -5.935 1.00 0.00 C ATOM 1793 OE1 GLN C 18 12.300 0.898 -6.361 1.00 0.00 O ATOM 1794 NE2 GLN C 18 11.787 2.980 -6.759 1.00 0.00 N ATOM 0 H GLN C 18 13.491 2.197 -2.111 1.00 0.00 H new ATOM 0 HA GLN C 18 10.695 1.526 -2.193 1.00 0.00 H new ATOM 0 HB2 GLN C 18 13.255 0.777 -3.689 1.00 0.00 H new ATOM 0 HB3 GLN C 18 11.714 0.091 -4.163 1.00 0.00 H new ATOM 0 HG2 GLN C 18 10.822 2.543 -4.204 1.00 0.00 H new ATOM 0 HG3 GLN C 18 12.500 3.038 -4.114 1.00 0.00 H new ATOM 0 HE21 GLN C 18 11.528 3.899 -6.400 1.00 0.00 H new ATOM 0 HE22 GLN C 18 11.885 2.834 -7.764 1.00 0.00 H new ATOM 1803 N THR C 19 12.676 -0.923 -1.288 1.00 0.00 N ATOM 1804 CA THR C 19 12.622 -2.263 -0.634 1.00 0.00 C ATOM 1805 C THR C 19 11.800 -2.154 0.652 1.00 0.00 C ATOM 1806 O THR C 19 11.069 -3.056 1.014 1.00 0.00 O ATOM 1807 CB THR C 19 14.077 -2.617 -0.323 1.00 0.00 C ATOM 1808 OG1 THR C 19 14.709 -3.085 -1.506 1.00 0.00 O ATOM 1809 CG2 THR C 19 14.121 -3.708 0.747 1.00 0.00 C ATOM 0 H THR C 19 13.613 -0.561 -1.466 1.00 0.00 H new ATOM 0 HA THR C 19 12.157 -3.025 -1.259 1.00 0.00 H new ATOM 0 HB THR C 19 14.598 -1.732 0.043 1.00 0.00 H new ATOM 0 HG1 THR C 19 15.642 -3.311 -1.311 1.00 0.00 H new ATOM 0 HG21 THR C 19 15.158 -3.959 0.968 1.00 0.00 H new ATOM 0 HG22 THR C 19 13.634 -3.348 1.653 1.00 0.00 H new ATOM 0 HG23 THR C 19 13.602 -4.595 0.384 1.00 0.00 H new ATOM 1817 N LYS C 20 11.898 -1.042 1.329 1.00 0.00 N ATOM 1818 CA LYS C 20 11.105 -0.856 2.575 1.00 0.00 C ATOM 1819 C LYS C 20 9.626 -0.802 2.205 1.00 0.00 C ATOM 1820 O LYS C 20 8.767 -1.258 2.933 1.00 0.00 O ATOM 1821 CB LYS C 20 11.568 0.483 3.148 1.00 0.00 C ATOM 1822 CG LYS C 20 13.066 0.420 3.449 1.00 0.00 C ATOM 1823 CD LYS C 20 13.289 0.552 4.957 1.00 0.00 C ATOM 1824 CE LYS C 20 14.190 -0.586 5.441 1.00 0.00 C ATOM 1825 NZ LYS C 20 15.578 -0.082 5.252 1.00 0.00 N ATOM 0 H LYS C 20 12.493 -0.255 1.072 1.00 0.00 H new ATOM 0 HA LYS C 20 11.242 -1.661 3.297 1.00 0.00 H new ATOM 0 HB2 LYS C 20 11.363 1.285 2.438 1.00 0.00 H new ATOM 0 HB3 LYS C 20 11.013 0.712 4.058 1.00 0.00 H new ATOM 0 HG2 LYS C 20 13.481 -0.522 3.090 1.00 0.00 H new ATOM 0 HG3 LYS C 20 13.588 1.219 2.922 1.00 0.00 H new ATOM 0 HD2 LYS C 20 13.747 1.515 5.185 1.00 0.00 H new ATOM 0 HD3 LYS C 20 12.334 0.522 5.481 1.00 0.00 H new ATOM 0 HE2 LYS C 20 13.996 -0.826 6.486 1.00 0.00 H new ATOM 0 HE3 LYS C 20 14.019 -1.497 4.867 1.00 0.00 H new ATOM 0 HZ1 LYS C 20 16.256 -0.807 5.562 1.00 0.00 H new ATOM 0 HZ2 LYS C 20 15.736 0.132 4.247 1.00 0.00 H new ATOM 0 HZ3 LYS C 20 15.713 0.782 5.815 1.00 0.00 H new ATOM 1839 N VAL C 21 9.337 -0.260 1.055 1.00 0.00 N ATOM 1840 CA VAL C 21 7.926 -0.178 0.587 1.00 0.00 C ATOM 1841 C VAL C 21 7.497 -1.551 0.066 1.00 0.00 C ATOM 1842 O VAL C 21 6.326 -1.849 -0.051 1.00 0.00 O ATOM 1843 CB VAL C 21 7.957 0.858 -0.545 1.00 0.00 C ATOM 1844 CG1 VAL C 21 6.892 0.534 -1.598 1.00 0.00 C ATOM 1845 CG2 VAL C 21 7.684 2.247 0.032 1.00 0.00 C ATOM 0 H VAL C 21 10.025 0.133 0.413 1.00 0.00 H new ATOM 0 HA VAL C 21 7.222 0.106 1.369 1.00 0.00 H new ATOM 0 HB VAL C 21 8.940 0.834 -1.015 1.00 0.00 H new ATOM 0 HG11 VAL C 21 6.928 1.279 -2.393 1.00 0.00 H new ATOM 0 HG12 VAL C 21 7.083 -0.454 -2.017 1.00 0.00 H new ATOM 0 HG13 VAL C 21 5.906 0.546 -1.134 1.00 0.00 H new ATOM 0 HG21 VAL C 21 7.705 2.985 -0.770 1.00 0.00 H new ATOM 0 HG22 VAL C 21 6.704 2.257 0.508 1.00 0.00 H new ATOM 0 HG23 VAL C 21 8.448 2.491 0.770 1.00 0.00 H new ATOM 1855 N GLU C 22 8.448 -2.382 -0.248 1.00 0.00 N ATOM 1856 CA GLU C 22 8.120 -3.739 -0.760 1.00 0.00 C ATOM 1857 C GLU C 22 7.624 -4.615 0.391 1.00 0.00 C ATOM 1858 O GLU C 22 6.609 -5.278 0.297 1.00 0.00 O ATOM 1859 CB GLU C 22 9.442 -4.264 -1.323 1.00 0.00 C ATOM 1860 CG GLU C 22 9.554 -3.885 -2.801 1.00 0.00 C ATOM 1861 CD GLU C 22 8.480 -4.623 -3.603 1.00 0.00 C ATOM 1862 OE1 GLU C 22 7.382 -4.104 -3.704 1.00 0.00 O ATOM 1863 OE2 GLU C 22 8.776 -5.696 -4.104 1.00 0.00 O ATOM 0 H GLU C 22 9.445 -2.178 -0.172 1.00 0.00 H new ATOM 0 HA GLU C 22 7.333 -3.735 -1.514 1.00 0.00 H new ATOM 0 HB2 GLU C 22 10.279 -3.845 -0.765 1.00 0.00 H new ATOM 0 HB3 GLU C 22 9.493 -5.347 -1.209 1.00 0.00 H new ATOM 0 HG2 GLU C 22 9.436 -2.808 -2.921 1.00 0.00 H new ATOM 0 HG3 GLU C 22 10.544 -4.141 -3.178 1.00 0.00 H new ATOM 1870 N GLU C 23 8.329 -4.608 1.488 1.00 0.00 N ATOM 1871 CA GLU C 23 7.897 -5.425 2.654 1.00 0.00 C ATOM 1872 C GLU C 23 6.679 -4.778 3.315 1.00 0.00 C ATOM 1873 O GLU C 23 5.808 -5.451 3.830 1.00 0.00 O ATOM 1874 CB GLU C 23 9.095 -5.422 3.603 1.00 0.00 C ATOM 1875 CG GLU C 23 10.348 -5.855 2.837 1.00 0.00 C ATOM 1876 CD GLU C 23 11.142 -6.859 3.674 1.00 0.00 C ATOM 1877 OE1 GLU C 23 11.035 -6.807 4.888 1.00 0.00 O ATOM 1878 OE2 GLU C 23 11.844 -7.666 3.085 1.00 0.00 O ATOM 0 H GLU C 23 9.185 -4.072 1.627 1.00 0.00 H new ATOM 0 HA GLU C 23 7.608 -6.438 2.374 1.00 0.00 H new ATOM 0 HB2 GLU C 23 9.238 -4.427 4.024 1.00 0.00 H new ATOM 0 HB3 GLU C 23 8.914 -6.098 4.438 1.00 0.00 H new ATOM 0 HG2 GLU C 23 10.067 -6.303 1.884 1.00 0.00 H new ATOM 0 HG3 GLU C 23 10.966 -4.986 2.611 1.00 0.00 H new ATOM 1885 N LEU C 24 6.607 -3.473 3.293 1.00 0.00 N ATOM 1886 CA LEU C 24 5.440 -2.780 3.911 1.00 0.00 C ATOM 1887 C LEU C 24 4.174 -3.094 3.114 1.00 0.00 C ATOM 1888 O LEU C 24 3.149 -3.442 3.666 1.00 0.00 O ATOM 1889 CB LEU C 24 5.772 -1.288 3.832 1.00 0.00 C ATOM 1890 CG LEU C 24 5.015 -0.535 4.928 1.00 0.00 C ATOM 1891 CD1 LEU C 24 5.319 -1.170 6.285 1.00 0.00 C ATOM 1892 CD2 LEU C 24 5.457 0.930 4.942 1.00 0.00 C ATOM 0 H LEU C 24 7.305 -2.858 2.874 1.00 0.00 H new ATOM 0 HA LEU C 24 5.262 -3.097 4.939 1.00 0.00 H new ATOM 0 HB2 LEU C 24 6.845 -1.137 3.948 1.00 0.00 H new ATOM 0 HB3 LEU C 24 5.499 -0.896 2.852 1.00 0.00 H new ATOM 0 HG LEU C 24 3.944 -0.589 4.731 1.00 0.00 H new ATOM 0 HD11 LEU C 24 4.780 -0.634 7.066 1.00 0.00 H new ATOM 0 HD12 LEU C 24 5.004 -2.213 6.277 1.00 0.00 H new ATOM 0 HD13 LEU C 24 6.390 -1.116 6.480 1.00 0.00 H new ATOM 0 HD21 LEU C 24 4.917 1.465 5.723 1.00 0.00 H new ATOM 0 HD22 LEU C 24 6.528 0.985 5.138 1.00 0.00 H new ATOM 0 HD23 LEU C 24 5.241 1.384 3.975 1.00 0.00 H new ATOM 1904 N ILE C 25 4.240 -2.985 1.815 1.00 0.00 N ATOM 1905 CA ILE C 25 3.043 -3.290 0.984 1.00 0.00 C ATOM 1906 C ILE C 25 2.615 -4.742 1.228 1.00 0.00 C ATOM 1907 O ILE C 25 1.444 -5.050 1.288 1.00 0.00 O ATOM 1908 CB ILE C 25 3.494 -3.043 -0.470 1.00 0.00 C ATOM 1909 CG1 ILE C 25 2.808 -1.778 -1.002 1.00 0.00 C ATOM 1910 CG2 ILE C 25 3.125 -4.227 -1.376 1.00 0.00 C ATOM 1911 CD1 ILE C 25 2.881 -0.664 0.046 1.00 0.00 C ATOM 0 H ILE C 25 5.069 -2.699 1.295 1.00 0.00 H new ATOM 0 HA ILE C 25 2.177 -2.673 1.223 1.00 0.00 H new ATOM 0 HB ILE C 25 4.578 -2.925 -0.477 1.00 0.00 H new ATOM 0 HG12 ILE C 25 3.290 -1.453 -1.924 1.00 0.00 H new ATOM 0 HG13 ILE C 25 1.767 -1.993 -1.245 1.00 0.00 H new ATOM 0 HG21 ILE C 25 3.456 -4.023 -2.394 1.00 0.00 H new ATOM 0 HG22 ILE C 25 3.612 -5.131 -1.010 1.00 0.00 H new ATOM 0 HG23 ILE C 25 2.044 -4.369 -1.367 1.00 0.00 H new ATOM 0 HD11 ILE C 25 2.392 0.231 -0.339 1.00 0.00 H new ATOM 0 HD12 ILE C 25 2.379 -0.988 0.957 1.00 0.00 H new ATOM 0 HD13 ILE C 25 3.925 -0.440 0.267 1.00 0.00 H new ATOM 1923 N ASN C 26 3.557 -5.634 1.383 1.00 0.00 N ATOM 1924 CA ASN C 26 3.190 -7.056 1.639 1.00 0.00 C ATOM 1925 C ASN C 26 2.425 -7.150 2.959 1.00 0.00 C ATOM 1926 O ASN C 26 1.439 -7.849 3.073 1.00 0.00 O ATOM 1927 CB ASN C 26 4.517 -7.806 1.734 1.00 0.00 C ATOM 1928 CG ASN C 26 4.307 -9.272 1.343 1.00 0.00 C ATOM 1929 OD1 ASN C 26 3.278 -9.848 1.633 1.00 0.00 O ATOM 1930 ND2 ASN C 26 5.247 -9.901 0.692 1.00 0.00 N ATOM 0 H ASN C 26 4.558 -5.441 1.344 1.00 0.00 H new ATOM 0 HA ASN C 26 2.553 -7.472 0.858 1.00 0.00 H new ATOM 0 HB2 ASN C 26 5.254 -7.346 1.076 1.00 0.00 H new ATOM 0 HB3 ASN C 26 4.911 -7.742 2.748 1.00 0.00 H new ATOM 0 HD21 ASN C 26 5.118 -10.877 0.426 1.00 0.00 H new ATOM 0 HD22 ASN C 26 6.111 -9.416 0.449 1.00 0.00 H new ATOM 1937 N THR C 27 2.874 -6.436 3.951 1.00 0.00 N ATOM 1938 CA THR C 27 2.183 -6.461 5.270 1.00 0.00 C ATOM 1939 C THR C 27 0.760 -5.922 5.121 1.00 0.00 C ATOM 1940 O THR C 27 -0.153 -6.361 5.790 1.00 0.00 O ATOM 1941 CB THR C 27 3.015 -5.539 6.163 1.00 0.00 C ATOM 1942 OG1 THR C 27 4.211 -6.202 6.554 1.00 0.00 O ATOM 1943 CG2 THR C 27 2.208 -5.162 7.407 1.00 0.00 C ATOM 0 H THR C 27 3.695 -5.832 3.905 1.00 0.00 H new ATOM 0 HA THR C 27 2.103 -7.467 5.683 1.00 0.00 H new ATOM 0 HB THR C 27 3.268 -4.635 5.609 1.00 0.00 H new ATOM 0 HG1 THR C 27 4.893 -6.082 5.861 1.00 0.00 H new ATOM 0 HG21 THR C 27 2.803 -4.505 8.041 1.00 0.00 H new ATOM 0 HG22 THR C 27 1.295 -4.647 7.106 1.00 0.00 H new ATOM 0 HG23 THR C 27 1.950 -6.065 7.961 1.00 0.00 H new ATOM 1951 N LEU C 28 0.563 -4.977 4.242 1.00 0.00 N ATOM 1952 CA LEU C 28 -0.807 -4.420 4.049 1.00 0.00 C ATOM 1953 C LEU C 28 -1.685 -5.466 3.370 1.00 0.00 C ATOM 1954 O LEU C 28 -2.822 -5.677 3.740 1.00 0.00 O ATOM 1955 CB LEU C 28 -0.626 -3.198 3.148 1.00 0.00 C ATOM 1956 CG LEU C 28 -0.224 -1.996 4.000 1.00 0.00 C ATOM 1957 CD1 LEU C 28 0.674 -1.064 3.183 1.00 0.00 C ATOM 1958 CD2 LEU C 28 -1.481 -1.240 4.436 1.00 0.00 C ATOM 0 H LEU C 28 1.287 -4.568 3.652 1.00 0.00 H new ATOM 0 HA LEU C 28 -1.286 -4.150 4.990 1.00 0.00 H new ATOM 0 HB2 LEU C 28 0.138 -3.397 2.396 1.00 0.00 H new ATOM 0 HB3 LEU C 28 -1.552 -2.986 2.614 1.00 0.00 H new ATOM 0 HG LEU C 28 0.319 -2.341 4.880 1.00 0.00 H new ATOM 0 HD11 LEU C 28 0.960 -0.207 3.793 1.00 0.00 H new ATOM 0 HD12 LEU C 28 1.569 -1.602 2.871 1.00 0.00 H new ATOM 0 HD13 LEU C 28 0.134 -0.718 2.302 1.00 0.00 H new ATOM 0 HD21 LEU C 28 -1.197 -0.381 5.044 1.00 0.00 H new ATOM 0 HD22 LEU C 28 -2.023 -0.897 3.555 1.00 0.00 H new ATOM 0 HD23 LEU C 28 -2.120 -1.903 5.020 1.00 0.00 H new ATOM 1970 N GLN C 29 -1.154 -6.136 2.389 1.00 0.00 N ATOM 1971 CA GLN C 29 -1.938 -7.188 1.695 1.00 0.00 C ATOM 1972 C GLN C 29 -2.089 -8.386 2.633 1.00 0.00 C ATOM 1973 O GLN C 29 -2.887 -9.276 2.408 1.00 0.00 O ATOM 1974 CB GLN C 29 -1.098 -7.549 0.472 1.00 0.00 C ATOM 1975 CG GLN C 29 -2.007 -8.073 -0.639 1.00 0.00 C ATOM 1976 CD GLN C 29 -1.503 -7.561 -1.989 1.00 0.00 C ATOM 1977 OE1 GLN C 29 -0.414 -7.895 -2.409 1.00 0.00 O ATOM 1978 NE2 GLN C 29 -2.256 -6.760 -2.691 1.00 0.00 N ATOM 0 H GLN C 29 -0.206 -5.999 2.037 1.00 0.00 H new ATOM 0 HA GLN C 29 -2.940 -6.870 1.408 1.00 0.00 H new ATOM 0 HB2 GLN C 29 -0.549 -6.674 0.124 1.00 0.00 H new ATOM 0 HB3 GLN C 29 -0.358 -8.304 0.737 1.00 0.00 H new ATOM 0 HG2 GLN C 29 -2.018 -9.163 -0.632 1.00 0.00 H new ATOM 0 HG3 GLN C 29 -3.032 -7.743 -0.472 1.00 0.00 H new ATOM 0 HE21 GLN C 29 -3.171 -6.480 -2.338 1.00 0.00 H new ATOM 0 HE22 GLN C 29 -1.930 -6.414 -3.593 1.00 0.00 H new ATOM 1987 N GLN C 30 -1.330 -8.398 3.696 1.00 0.00 N ATOM 1988 CA GLN C 30 -1.418 -9.512 4.675 1.00 0.00 C ATOM 1989 C GLN C 30 -2.590 -9.258 5.618 1.00 0.00 C ATOM 1990 O GLN C 30 -3.461 -10.088 5.788 1.00 0.00 O ATOM 1991 CB GLN C 30 -0.097 -9.465 5.442 1.00 0.00 C ATOM 1992 CG GLN C 30 1.001 -10.105 4.598 1.00 0.00 C ATOM 1993 CD GLN C 30 1.486 -11.388 5.276 1.00 0.00 C ATOM 1994 OE1 GLN C 30 2.153 -11.338 6.290 1.00 0.00 O ATOM 1995 NE2 GLN C 30 1.175 -12.543 4.757 1.00 0.00 N ATOM 0 H GLN C 30 -0.648 -7.676 3.927 1.00 0.00 H new ATOM 0 HA GLN C 30 -1.577 -10.482 4.203 1.00 0.00 H new ATOM 0 HB2 GLN C 30 0.164 -8.433 5.676 1.00 0.00 H new ATOM 0 HB3 GLN C 30 -0.196 -9.992 6.391 1.00 0.00 H new ATOM 0 HG2 GLN C 30 0.623 -10.329 3.600 1.00 0.00 H new ATOM 0 HG3 GLN C 30 1.832 -9.410 4.475 1.00 0.00 H new ATOM 0 HE21 GLN C 30 0.615 -12.585 3.906 1.00 0.00 H new ATOM 0 HE22 GLN C 30 1.492 -13.404 5.202 1.00 0.00 H new ATOM 2004 N LYS C 31 -2.624 -8.100 6.217 1.00 0.00 N ATOM 2005 CA LYS C 31 -3.748 -7.775 7.135 1.00 0.00 C ATOM 2006 C LYS C 31 -5.031 -7.638 6.319 1.00 0.00 C ATOM 2007 O LYS C 31 -6.126 -7.686 6.841 1.00 0.00 O ATOM 2008 CB LYS C 31 -3.367 -6.441 7.780 1.00 0.00 C ATOM 2009 CG LYS C 31 -2.707 -6.702 9.137 1.00 0.00 C ATOM 2010 CD LYS C 31 -2.040 -5.420 9.642 1.00 0.00 C ATOM 2011 CE LYS C 31 -0.877 -5.785 10.567 1.00 0.00 C ATOM 2012 NZ LYS C 31 -0.897 -4.752 11.641 1.00 0.00 N ATOM 0 H LYS C 31 -1.923 -7.367 6.110 1.00 0.00 H new ATOM 0 HA LYS C 31 -3.918 -8.543 7.890 1.00 0.00 H new ATOM 0 HB2 LYS C 31 -2.685 -5.892 7.131 1.00 0.00 H new ATOM 0 HB3 LYS C 31 -4.254 -5.820 7.908 1.00 0.00 H new ATOM 0 HG2 LYS C 31 -3.453 -7.043 9.855 1.00 0.00 H new ATOM 0 HG3 LYS C 31 -1.967 -7.497 9.045 1.00 0.00 H new ATOM 0 HD2 LYS C 31 -1.679 -4.829 8.801 1.00 0.00 H new ATOM 0 HD3 LYS C 31 -2.765 -4.805 10.176 1.00 0.00 H new ATOM 0 HE2 LYS C 31 -1.001 -6.786 10.980 1.00 0.00 H new ATOM 0 HE3 LYS C 31 0.071 -5.777 10.030 1.00 0.00 H new ATOM 0 HZ1 LYS C 31 -0.126 -4.937 12.315 1.00 0.00 H new ATOM 0 HZ2 LYS C 31 -0.770 -3.810 11.219 1.00 0.00 H new ATOM 0 HZ3 LYS C 31 -1.809 -4.788 12.140 1.00 0.00 H new ATOM 2026 N LEU C 32 -4.895 -7.479 5.030 1.00 0.00 N ATOM 2027 CA LEU C 32 -6.094 -7.347 4.156 1.00 0.00 C ATOM 2028 C LEU C 32 -6.644 -8.734 3.821 1.00 0.00 C ATOM 2029 O LEU C 32 -7.834 -8.975 3.890 1.00 0.00 O ATOM 2030 CB LEU C 32 -5.583 -6.657 2.895 1.00 0.00 C ATOM 2031 CG LEU C 32 -6.734 -5.919 2.217 1.00 0.00 C ATOM 2032 CD1 LEU C 32 -7.381 -4.957 3.216 1.00 0.00 C ATOM 2033 CD2 LEU C 32 -6.194 -5.130 1.024 1.00 0.00 C ATOM 0 H LEU C 32 -4.000 -7.435 4.543 1.00 0.00 H new ATOM 0 HA LEU C 32 -6.900 -6.786 4.630 1.00 0.00 H new ATOM 0 HB2 LEU C 32 -4.787 -5.957 3.148 1.00 0.00 H new ATOM 0 HB3 LEU C 32 -5.156 -7.392 2.213 1.00 0.00 H new ATOM 0 HG LEU C 32 -7.478 -6.637 1.873 1.00 0.00 H new ATOM 0 HD11 LEU C 32 -8.203 -4.429 2.733 1.00 0.00 H new ATOM 0 HD12 LEU C 32 -7.762 -5.520 4.068 1.00 0.00 H new ATOM 0 HD13 LEU C 32 -6.639 -4.236 3.559 1.00 0.00 H new ATOM 0 HD21 LEU C 32 -7.013 -4.601 0.537 1.00 0.00 H new ATOM 0 HD22 LEU C 32 -5.452 -4.410 1.370 1.00 0.00 H new ATOM 0 HD23 LEU C 32 -5.731 -5.815 0.314 1.00 0.00 H new ATOM 2045 N GLU C 33 -5.786 -9.652 3.469 1.00 0.00 N ATOM 2046 CA GLU C 33 -6.264 -11.024 3.145 1.00 0.00 C ATOM 2047 C GLU C 33 -6.734 -11.704 4.428 1.00 0.00 C ATOM 2048 O GLU C 33 -7.478 -12.664 4.406 1.00 0.00 O ATOM 2049 CB GLU C 33 -5.048 -11.742 2.559 1.00 0.00 C ATOM 2050 CG GLU C 33 -5.350 -13.236 2.422 1.00 0.00 C ATOM 2051 CD GLU C 33 -5.342 -13.626 0.943 1.00 0.00 C ATOM 2052 OE1 GLU C 33 -6.382 -13.516 0.316 1.00 0.00 O ATOM 2053 OE2 GLU C 33 -4.295 -14.030 0.462 1.00 0.00 O ATOM 0 H GLU C 33 -4.779 -9.511 3.392 1.00 0.00 H new ATOM 0 HA GLU C 33 -7.101 -11.031 2.446 1.00 0.00 H new ATOM 0 HB2 GLU C 33 -4.799 -11.320 1.585 1.00 0.00 H new ATOM 0 HB3 GLU C 33 -4.181 -11.594 3.202 1.00 0.00 H new ATOM 0 HG2 GLU C 33 -4.607 -13.819 2.967 1.00 0.00 H new ATOM 0 HG3 GLU C 33 -6.320 -13.463 2.864 1.00 0.00 H new ATOM 2060 N ALA C 34 -6.324 -11.184 5.550 1.00 0.00 N ATOM 2061 CA ALA C 34 -6.758 -11.760 6.848 1.00 0.00 C ATOM 2062 C ALA C 34 -8.043 -11.058 7.261 1.00 0.00 C ATOM 2063 O ALA C 34 -8.944 -11.645 7.826 1.00 0.00 O ATOM 2064 CB ALA C 34 -5.623 -11.445 7.822 1.00 0.00 C ATOM 0 H ALA C 34 -5.702 -10.379 5.622 1.00 0.00 H new ATOM 0 HA ALA C 34 -6.951 -12.832 6.813 1.00 0.00 H new ATOM 0 HB1 ALA C 34 -5.869 -11.840 8.808 1.00 0.00 H new ATOM 0 HB2 ALA C 34 -4.701 -11.905 7.467 1.00 0.00 H new ATOM 0 HB3 ALA C 34 -5.488 -10.365 7.887 1.00 0.00 H new ATOM 2070 N VAL C 35 -8.131 -9.796 6.946 1.00 0.00 N ATOM 2071 CA VAL C 35 -9.353 -9.021 7.274 1.00 0.00 C ATOM 2072 C VAL C 35 -10.534 -9.622 6.507 1.00 0.00 C ATOM 2073 O VAL C 35 -11.628 -9.730 7.020 1.00 0.00 O ATOM 2074 CB VAL C 35 -9.034 -7.594 6.804 1.00 0.00 C ATOM 2075 CG1 VAL C 35 -10.291 -6.905 6.272 1.00 0.00 C ATOM 2076 CG2 VAL C 35 -8.479 -6.786 7.978 1.00 0.00 C ATOM 0 H VAL C 35 -7.400 -9.266 6.471 1.00 0.00 H new ATOM 0 HA VAL C 35 -9.620 -9.036 8.331 1.00 0.00 H new ATOM 0 HB VAL C 35 -8.297 -7.649 6.002 1.00 0.00 H new ATOM 0 HG11 VAL C 35 -10.042 -5.896 5.945 1.00 0.00 H new ATOM 0 HG12 VAL C 35 -10.688 -7.472 5.430 1.00 0.00 H new ATOM 0 HG13 VAL C 35 -11.041 -6.856 7.062 1.00 0.00 H new ATOM 0 HG21 VAL C 35 -8.252 -5.773 7.647 1.00 0.00 H new ATOM 0 HG22 VAL C 35 -9.220 -6.749 8.777 1.00 0.00 H new ATOM 0 HG23 VAL C 35 -7.570 -7.259 8.348 1.00 0.00 H new ATOM 2086 N ALA C 36 -10.314 -10.026 5.283 1.00 0.00 N ATOM 2087 CA ALA C 36 -11.421 -10.635 4.495 1.00 0.00 C ATOM 2088 C ALA C 36 -11.757 -12.003 5.084 1.00 0.00 C ATOM 2089 O ALA C 36 -12.866 -12.487 4.972 1.00 0.00 O ATOM 2090 CB ALA C 36 -10.874 -10.779 3.076 1.00 0.00 C ATOM 0 H ALA C 36 -9.419 -9.960 4.798 1.00 0.00 H new ATOM 0 HA ALA C 36 -12.331 -10.035 4.509 1.00 0.00 H new ATOM 0 HB1 ALA C 36 -11.636 -11.222 2.435 1.00 0.00 H new ATOM 0 HB2 ALA C 36 -10.602 -9.797 2.690 1.00 0.00 H new ATOM 0 HB3 ALA C 36 -9.993 -11.421 3.089 1.00 0.00 H new ATOM 2096 N LYS C 37 -10.802 -12.624 5.723 1.00 0.00 N ATOM 2097 CA LYS C 37 -11.062 -13.959 6.334 1.00 0.00 C ATOM 2098 C LYS C 37 -11.824 -13.779 7.643 1.00 0.00 C ATOM 2099 O LYS C 37 -12.585 -14.632 8.055 1.00 0.00 O ATOM 2100 CB LYS C 37 -9.682 -14.563 6.591 1.00 0.00 C ATOM 2101 CG LYS C 37 -9.472 -15.768 5.673 1.00 0.00 C ATOM 2102 CD LYS C 37 -8.060 -15.724 5.087 1.00 0.00 C ATOM 2103 CE LYS C 37 -7.773 -17.031 4.345 1.00 0.00 C ATOM 2104 NZ LYS C 37 -6.290 -17.174 4.379 1.00 0.00 N ATOM 0 H LYS C 37 -9.855 -12.265 5.848 1.00 0.00 H new ATOM 0 HA LYS C 37 -11.664 -14.603 5.692 1.00 0.00 H new ATOM 0 HB2 LYS C 37 -8.908 -13.817 6.412 1.00 0.00 H new ATOM 0 HB3 LYS C 37 -9.595 -14.868 7.634 1.00 0.00 H new ATOM 0 HG2 LYS C 37 -9.617 -16.693 6.231 1.00 0.00 H new ATOM 0 HG3 LYS C 37 -10.210 -15.761 4.871 1.00 0.00 H new ATOM 0 HD2 LYS C 37 -7.964 -14.878 4.406 1.00 0.00 H new ATOM 0 HD3 LYS C 37 -7.329 -15.577 5.882 1.00 0.00 H new ATOM 0 HE2 LYS C 37 -8.263 -17.876 4.829 1.00 0.00 H new ATOM 0 HE3 LYS C 37 -8.143 -16.993 3.320 1.00 0.00 H new ATOM 0 HZ1 LYS C 37 -6.014 -18.049 3.889 1.00 0.00 H new ATOM 0 HZ2 LYS C 37 -5.852 -16.359 3.905 1.00 0.00 H new ATOM 0 HZ3 LYS C 37 -5.968 -17.214 5.367 1.00 0.00 H new ATOM 2118 N ARG C 38 -11.638 -12.666 8.292 1.00 0.00 N ATOM 2119 CA ARG C 38 -12.366 -12.420 9.559 1.00 0.00 C ATOM 2120 C ARG C 38 -13.786 -11.975 9.221 1.00 0.00 C ATOM 2121 O ARG C 38 -14.734 -12.308 9.899 1.00 0.00 O ATOM 2122 CB ARG C 38 -11.586 -11.306 10.253 1.00 0.00 C ATOM 2123 CG ARG C 38 -10.087 -11.615 10.190 1.00 0.00 C ATOM 2124 CD ARG C 38 -9.521 -11.708 11.607 1.00 0.00 C ATOM 2125 NE ARG C 38 -8.268 -10.905 11.574 1.00 0.00 N ATOM 2126 CZ ARG C 38 -8.045 -10.005 12.491 1.00 0.00 C ATOM 2127 NH1 ARG C 38 -7.964 -10.361 13.744 1.00 0.00 N ATOM 2128 NH2 ARG C 38 -7.904 -8.751 12.156 1.00 0.00 N ATOM 0 H ARG C 38 -11.012 -11.917 7.997 1.00 0.00 H new ATOM 0 HA ARG C 38 -12.440 -13.300 10.199 1.00 0.00 H new ATOM 0 HB2 ARG C 38 -11.791 -10.350 9.772 1.00 0.00 H new ATOM 0 HB3 ARG C 38 -11.906 -11.216 11.291 1.00 0.00 H new ATOM 0 HG2 ARG C 38 -9.921 -12.552 9.659 1.00 0.00 H new ATOM 0 HG3 ARG C 38 -9.568 -10.836 9.631 1.00 0.00 H new ATOM 0 HD2 ARG C 38 -10.224 -11.312 12.340 1.00 0.00 H new ATOM 0 HD3 ARG C 38 -9.320 -12.743 11.885 1.00 0.00 H new ATOM 0 HE ARG C 38 -7.583 -11.059 10.834 1.00 0.00 H new ATOM 0 HH11 ARG C 38 -8.075 -11.341 14.004 1.00 0.00 H new ATOM 0 HH12 ARG C 38 -7.790 -9.659 14.463 1.00 0.00 H new ATOM 0 HH21 ARG C 38 -7.968 -8.475 11.176 1.00 0.00 H new ATOM 0 HH22 ARG C 38 -7.730 -8.048 12.874 1.00 0.00 H new ATOM 2142 N ILE C 39 -13.933 -11.246 8.151 1.00 0.00 N ATOM 2143 CA ILE C 39 -15.288 -10.796 7.733 1.00 0.00 C ATOM 2144 C ILE C 39 -16.140 -12.025 7.424 1.00 0.00 C ATOM 2145 O ILE C 39 -17.266 -12.139 7.863 1.00 0.00 O ATOM 2146 CB ILE C 39 -15.051 -9.952 6.477 1.00 0.00 C ATOM 2147 CG1 ILE C 39 -14.630 -8.532 6.890 1.00 0.00 C ATOM 2148 CG2 ILE C 39 -16.330 -9.896 5.637 1.00 0.00 C ATOM 2149 CD1 ILE C 39 -15.860 -7.706 7.280 1.00 0.00 C ATOM 0 H ILE C 39 -13.170 -10.942 7.546 1.00 0.00 H new ATOM 0 HA ILE C 39 -15.812 -10.222 8.498 1.00 0.00 H new ATOM 0 HB ILE C 39 -14.259 -10.404 5.880 1.00 0.00 H new ATOM 0 HG12 ILE C 39 -13.935 -8.581 7.728 1.00 0.00 H new ATOM 0 HG13 ILE C 39 -14.104 -8.047 6.068 1.00 0.00 H new ATOM 0 HG21 ILE C 39 -16.154 -9.294 4.746 1.00 0.00 H new ATOM 0 HG22 ILE C 39 -16.616 -10.906 5.342 1.00 0.00 H new ATOM 0 HG23 ILE C 39 -17.132 -9.448 6.224 1.00 0.00 H new ATOM 0 HD11 ILE C 39 -15.548 -6.703 7.570 1.00 0.00 H new ATOM 0 HD12 ILE C 39 -16.540 -7.643 6.431 1.00 0.00 H new ATOM 0 HD13 ILE C 39 -16.369 -8.184 8.117 1.00 0.00 H new ATOM 2161 N GLU C 40 -15.599 -12.958 6.691 1.00 0.00 N ATOM 2162 CA GLU C 40 -16.373 -14.189 6.385 1.00 0.00 C ATOM 2163 C GLU C 40 -16.642 -14.927 7.692 1.00 0.00 C ATOM 2164 O GLU C 40 -17.678 -15.535 7.877 1.00 0.00 O ATOM 2165 CB GLU C 40 -15.482 -15.014 5.456 1.00 0.00 C ATOM 2166 CG GLU C 40 -14.150 -15.307 6.145 1.00 0.00 C ATOM 2167 CD GLU C 40 -13.382 -16.359 5.342 1.00 0.00 C ATOM 2168 OE1 GLU C 40 -13.154 -16.128 4.166 1.00 0.00 O ATOM 2169 OE2 GLU C 40 -13.035 -17.377 5.918 1.00 0.00 O ATOM 0 H GLU C 40 -14.660 -12.921 6.294 1.00 0.00 H new ATOM 0 HA GLU C 40 -17.334 -13.987 5.913 1.00 0.00 H new ATOM 0 HB2 GLU C 40 -15.980 -15.948 5.194 1.00 0.00 H new ATOM 0 HB3 GLU C 40 -15.310 -14.472 4.526 1.00 0.00 H new ATOM 0 HG2 GLU C 40 -13.561 -14.393 6.225 1.00 0.00 H new ATOM 0 HG3 GLU C 40 -14.324 -15.664 7.160 1.00 0.00 H new ATOM 2176 N ALA C 41 -15.720 -14.851 8.615 1.00 0.00 N ATOM 2177 CA ALA C 41 -15.935 -15.521 9.927 1.00 0.00 C ATOM 2178 C ALA C 41 -17.232 -14.990 10.531 1.00 0.00 C ATOM 2179 O ALA C 41 -18.000 -15.717 11.128 1.00 0.00 O ATOM 2180 CB ALA C 41 -14.733 -15.129 10.786 1.00 0.00 C ATOM 0 H ALA C 41 -14.833 -14.357 8.517 1.00 0.00 H new ATOM 0 HA ALA C 41 -16.018 -16.605 9.848 1.00 0.00 H new ATOM 0 HB1 ALA C 41 -14.824 -15.588 11.770 1.00 0.00 H new ATOM 0 HB2 ALA C 41 -13.816 -15.474 10.308 1.00 0.00 H new ATOM 0 HB3 ALA C 41 -14.700 -14.045 10.893 1.00 0.00 H new ATOM 2186 N LEU C 42 -17.493 -13.725 10.347 1.00 0.00 N ATOM 2187 CA LEU C 42 -18.755 -13.142 10.874 1.00 0.00 C ATOM 2188 C LEU C 42 -19.903 -13.585 9.972 1.00 0.00 C ATOM 2189 O LEU C 42 -21.008 -13.802 10.418 1.00 0.00 O ATOM 2190 CB LEU C 42 -18.577 -11.616 10.798 1.00 0.00 C ATOM 2191 CG LEU C 42 -17.772 -11.068 11.995 1.00 0.00 C ATOM 2192 CD1 LEU C 42 -17.892 -11.982 13.220 1.00 0.00 C ATOM 2193 CD2 LEU C 42 -16.302 -10.945 11.598 1.00 0.00 C ATOM 0 H LEU C 42 -16.885 -13.071 9.854 1.00 0.00 H new ATOM 0 HA LEU C 42 -18.972 -13.459 11.894 1.00 0.00 H new ATOM 0 HB2 LEU C 42 -18.069 -11.356 9.870 1.00 0.00 H new ATOM 0 HB3 LEU C 42 -19.556 -11.138 10.770 1.00 0.00 H new ATOM 0 HG LEU C 42 -18.178 -10.092 12.260 1.00 0.00 H new ATOM 0 HD11 LEU C 42 -17.312 -11.565 14.043 1.00 0.00 H new ATOM 0 HD12 LEU C 42 -18.938 -12.059 13.515 1.00 0.00 H new ATOM 0 HD13 LEU C 42 -17.511 -12.973 12.973 1.00 0.00 H new ATOM 0 HD21 LEU C 42 -15.729 -10.558 12.440 1.00 0.00 H new ATOM 0 HD22 LEU C 42 -15.918 -11.926 11.317 1.00 0.00 H new ATOM 0 HD23 LEU C 42 -16.209 -10.263 10.752 1.00 0.00 H new ATOM 2205 N GLU C 43 -19.638 -13.733 8.702 1.00 0.00 N ATOM 2206 CA GLU C 43 -20.703 -14.176 7.760 1.00 0.00 C ATOM 2207 C GLU C 43 -21.095 -15.617 8.069 1.00 0.00 C ATOM 2208 O GLU C 43 -22.135 -16.095 7.662 1.00 0.00 O ATOM 2209 CB GLU C 43 -20.061 -14.074 6.380 1.00 0.00 C ATOM 2210 CG GLU C 43 -19.609 -12.635 6.154 1.00 0.00 C ATOM 2211 CD GLU C 43 -20.025 -12.181 4.754 1.00 0.00 C ATOM 2212 OE1 GLU C 43 -19.479 -12.706 3.797 1.00 0.00 O ATOM 2213 OE2 GLU C 43 -20.883 -11.319 4.662 1.00 0.00 O ATOM 0 H GLU C 43 -18.726 -13.565 8.276 1.00 0.00 H new ATOM 0 HA GLU C 43 -21.611 -13.577 7.832 1.00 0.00 H new ATOM 0 HB2 GLU C 43 -19.211 -14.752 6.308 1.00 0.00 H new ATOM 0 HB3 GLU C 43 -20.772 -14.372 5.610 1.00 0.00 H new ATOM 0 HG2 GLU C 43 -20.052 -11.982 6.906 1.00 0.00 H new ATOM 0 HG3 GLU C 43 -18.527 -12.561 6.265 1.00 0.00 H new