USER MOD reduce.3.24.130724 H: found=0, std=0, add=765, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 766 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 83 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 86 GLN : amide:sc= -1.05 X(o=-1.1,f=-0.7) USER MOD Set 2.1: A 22 ASN : amide:sc= -1.58 K(o=-2.3,f=-4.7) USER MOD Set 2.2: A 67 THR OG1 : rot 82:sc= -0.727! USER MOD Set 3.1: A 58 HIS : no HD1:sc= -3.44! C(o=-7.5!,f=-7.7!) USER MOD Set 3.2: A 62 GLN : amide:sc= -4.03! C(o=-7.5!,f=-9.8!) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= -0.0495 USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 THR OG1 : rot 118:sc= 1.2 USER MOD Single : A 19 CYS SG : rot 180:sc= -2.2 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 27 SER OG : rot -35:sc= 1.16 USER MOD Single : A 28 GLN : amide:sc= -0.0105 X(o=-0.01,f=0) USER MOD Single : A 30 THR OG1 : rot 96:sc= -0.256 USER MOD Single : A 32 GLN : amide:sc= -7! C(o=-7!,f=-6.4!) USER MOD Single : A 34 LYS NZ :NH3+ -123:sc= -0.929 (180deg=-2.5!) USER MOD Single : A 35 ASN : amide:sc= -0.0129 K(o=-0.013,f=-0.59) USER MOD Single : A 37 MET CE :methyl -128:sc= -4.12! (180deg=-7.38!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc=-0.00374 X(o=-0.0037,f=-0.049) USER MOD Single : A 54 GLN : amide:sc=-0.00252 X(o=-0.0025,f=-0.17) USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 GLN : amide:sc= -2.94! K(o=-2.9!,f=-0.25) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 THR OG1 : rot 86:sc= -1.25! USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.0959 X(o=-0.096,f=-0.043) USER MOD Single : A 89 GLN : amide:sc= -0.113 K(o=-0.11,f=-2!) USER MOD Single : A 92 GLN : amide:sc= -0.435 X(o=-0.44,f=0) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -109:sc= -4.75! (180deg=-10.6!) USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= -0.0299 USER MOD Single : A 105 ASN : amide:sc= -0.163 K(o=-0.16,f=-0.79!) USER MOD Single : A 106 ASN : amide:sc= 0.0145 X(o=0.014,f=-0.018) USER MOD Single : A 108 GLN : amide:sc= -0.123 K(o=-0.12,f=-1.1) USER MOD Single : A 111 GLN : amide:sc= -0.722 K(o=-0.72,f=-2.5!) USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -147:sc= -0.207 (180deg=-1.22!) USER MOD ----------------------------------------------------------------- ATOM 126 N ASP A 11 9.280 -17.025 -3.192 1.00 0.00 N ATOM 127 CA ASP A 11 8.547 -18.067 -2.492 1.00 0.00 C ATOM 128 C ASP A 11 7.329 -17.451 -1.801 1.00 0.00 C ATOM 129 O ASP A 11 7.347 -16.278 -1.432 1.00 0.00 O ATOM 130 CB ASP A 11 9.416 -18.726 -1.420 1.00 0.00 C ATOM 131 CG ASP A 11 10.805 -19.163 -1.890 1.00 0.00 C ATOM 132 OD1 ASP A 11 10.886 -19.660 -3.034 1.00 0.00 O ATOM 133 OD2 ASP A 11 11.754 -18.990 -1.095 1.00 0.00 O ATOM 0 HA ASP A 11 8.246 -18.817 -3.223 1.00 0.00 H new ATOM 0 HB2 ASP A 11 9.533 -18.029 -0.590 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.889 -19.598 -1.033 1.00 0.00 H new ATOM 138 N PHE A 12 6.299 -18.270 -1.648 1.00 0.00 N ATOM 139 CA PHE A 12 5.074 -17.821 -1.008 1.00 0.00 C ATOM 140 C PHE A 12 5.381 -16.945 0.209 1.00 0.00 C ATOM 141 O PHE A 12 4.932 -15.802 0.284 1.00 0.00 O ATOM 142 CB PHE A 12 4.327 -19.073 -0.544 1.00 0.00 C ATOM 143 CG PHE A 12 2.882 -18.810 -0.113 1.00 0.00 C ATOM 144 CD1 PHE A 12 2.618 -18.371 1.147 1.00 0.00 C ATOM 145 CD2 PHE A 12 1.863 -19.017 -0.989 1.00 0.00 C ATOM 146 CE1 PHE A 12 1.278 -18.127 1.547 1.00 0.00 C ATOM 147 CE2 PHE A 12 0.522 -18.774 -0.588 1.00 0.00 C ATOM 148 CZ PHE A 12 0.258 -18.334 0.671 1.00 0.00 C ATOM 0 H PHE A 12 6.287 -19.242 -1.956 1.00 0.00 H new ATOM 0 HA PHE A 12 4.483 -17.230 -1.708 1.00 0.00 H new ATOM 0 HB2 PHE A 12 4.327 -19.804 -1.352 1.00 0.00 H new ATOM 0 HB3 PHE A 12 4.869 -19.519 0.290 1.00 0.00 H new ATOM 0 HD1 PHE A 12 3.428 -18.208 1.843 1.00 0.00 H new ATOM 0 HD2 PHE A 12 2.073 -19.366 -1.989 1.00 0.00 H new ATOM 0 HE1 PHE A 12 1.068 -17.777 2.547 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -0.288 -18.939 -1.283 1.00 0.00 H new ATOM 0 HZ PHE A 12 -0.761 -18.149 0.976 1.00 0.00 H new ATOM 158 N SER A 13 6.144 -17.514 1.130 1.00 0.00 N ATOM 159 CA SER A 13 6.516 -16.799 2.340 1.00 0.00 C ATOM 160 C SER A 13 7.279 -15.523 1.979 1.00 0.00 C ATOM 161 O SER A 13 7.195 -14.523 2.691 1.00 0.00 O ATOM 162 CB SER A 13 7.361 -17.680 3.262 1.00 0.00 C ATOM 163 OG SER A 13 6.634 -18.099 4.413 1.00 0.00 O ATOM 0 H SER A 13 6.515 -18.462 1.063 1.00 0.00 H new ATOM 0 HA SER A 13 5.604 -16.531 2.874 1.00 0.00 H new ATOM 0 HB2 SER A 13 7.705 -18.556 2.712 1.00 0.00 H new ATOM 0 HB3 SER A 13 8.249 -17.131 3.574 1.00 0.00 H new ATOM 0 HG SER A 13 7.207 -18.661 4.975 1.00 0.00 H new ATOM 169 N SER A 14 8.006 -15.598 0.874 1.00 0.00 N ATOM 170 CA SER A 14 8.782 -14.461 0.410 1.00 0.00 C ATOM 171 C SER A 14 7.854 -13.402 -0.189 1.00 0.00 C ATOM 172 O SER A 14 8.052 -12.207 0.024 1.00 0.00 O ATOM 173 CB SER A 14 9.830 -14.892 -0.618 1.00 0.00 C ATOM 174 OG SER A 14 10.711 -15.884 -0.100 1.00 0.00 O ATOM 0 H SER A 14 8.074 -16.429 0.286 1.00 0.00 H new ATOM 0 HA SER A 14 9.306 -14.033 1.265 1.00 0.00 H new ATOM 0 HB2 SER A 14 9.329 -15.280 -1.505 1.00 0.00 H new ATOM 0 HB3 SER A 14 10.408 -14.023 -0.933 1.00 0.00 H new ATOM 0 HG SER A 14 11.363 -16.133 -0.787 1.00 0.00 H new ATOM 180 N ILE A 15 6.862 -13.879 -0.925 1.00 0.00 N ATOM 181 CA ILE A 15 5.903 -12.989 -1.556 1.00 0.00 C ATOM 182 C ILE A 15 4.964 -12.419 -0.490 1.00 0.00 C ATOM 183 O ILE A 15 4.616 -11.240 -0.531 1.00 0.00 O ATOM 184 CB ILE A 15 5.176 -13.705 -2.696 1.00 0.00 C ATOM 185 CG1 ILE A 15 6.172 -14.341 -3.668 1.00 0.00 C ATOM 186 CG2 ILE A 15 4.205 -12.760 -3.407 1.00 0.00 C ATOM 187 CD1 ILE A 15 5.462 -15.286 -4.640 1.00 0.00 C ATOM 0 H ILE A 15 6.701 -14.871 -1.099 1.00 0.00 H new ATOM 0 HA ILE A 15 6.414 -12.144 -2.016 1.00 0.00 H new ATOM 0 HB ILE A 15 4.583 -14.513 -2.268 1.00 0.00 H new ATOM 0 HG12 ILE A 15 6.690 -13.561 -4.226 1.00 0.00 H new ATOM 0 HG13 ILE A 15 6.930 -14.890 -3.110 1.00 0.00 H new ATOM 0 HG21 ILE A 15 3.702 -13.294 -4.213 1.00 0.00 H new ATOM 0 HG22 ILE A 15 3.464 -12.396 -2.695 1.00 0.00 H new ATOM 0 HG23 ILE A 15 4.756 -11.916 -3.821 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.192 -15.725 -5.320 1.00 0.00 H new ATOM 0 HD12 ILE A 15 4.966 -16.079 -4.080 1.00 0.00 H new ATOM 0 HD13 ILE A 15 4.721 -14.729 -5.214 1.00 0.00 H new ATOM 199 N ILE A 16 4.582 -13.283 0.439 1.00 0.00 N ATOM 200 CA ILE A 16 3.691 -12.880 1.513 1.00 0.00 C ATOM 201 C ILE A 16 4.357 -11.775 2.335 1.00 0.00 C ATOM 202 O ILE A 16 3.877 -10.642 2.363 1.00 0.00 O ATOM 203 CB ILE A 16 3.270 -14.095 2.343 1.00 0.00 C ATOM 204 CG1 ILE A 16 2.275 -14.966 1.574 1.00 0.00 C ATOM 205 CG2 ILE A 16 2.721 -13.664 3.705 1.00 0.00 C ATOM 206 CD1 ILE A 16 1.101 -15.377 2.466 1.00 0.00 C ATOM 0 H ILE A 16 4.873 -14.260 0.470 1.00 0.00 H new ATOM 0 HA ILE A 16 2.769 -12.464 1.107 1.00 0.00 H new ATOM 0 HB ILE A 16 4.154 -14.705 2.530 1.00 0.00 H new ATOM 0 HG12 ILE A 16 1.904 -14.420 0.707 1.00 0.00 H new ATOM 0 HG13 ILE A 16 2.780 -15.856 1.199 1.00 0.00 H new ATOM 0 HG21 ILE A 16 2.429 -14.546 4.275 1.00 0.00 H new ATOM 0 HG22 ILE A 16 3.490 -13.117 4.251 1.00 0.00 H new ATOM 0 HG23 ILE A 16 1.852 -13.021 3.560 1.00 0.00 H new ATOM 0 HD11 ILE A 16 0.409 -15.995 1.894 1.00 0.00 H new ATOM 0 HD12 ILE A 16 1.473 -15.943 3.320 1.00 0.00 H new ATOM 0 HD13 ILE A 16 0.583 -14.485 2.820 1.00 0.00 H new ATOM 218 N GLN A 17 5.452 -12.142 2.985 1.00 0.00 N ATOM 219 CA GLN A 17 6.188 -11.196 3.805 1.00 0.00 C ATOM 220 C GLN A 17 6.216 -9.821 3.134 1.00 0.00 C ATOM 221 O GLN A 17 5.862 -8.818 3.752 1.00 0.00 O ATOM 222 CB GLN A 17 7.606 -11.699 4.083 1.00 0.00 C ATOM 223 CG GLN A 17 7.771 -12.089 5.554 1.00 0.00 C ATOM 224 CD GLN A 17 8.512 -10.999 6.330 1.00 0.00 C ATOM 225 OE1 GLN A 17 7.923 -10.170 7.004 1.00 0.00 O ATOM 226 NE2 GLN A 17 9.835 -11.045 6.199 1.00 0.00 N ATOM 0 H GLN A 17 5.847 -13.082 2.960 1.00 0.00 H new ATOM 0 HA GLN A 17 5.677 -11.101 4.763 1.00 0.00 H new ATOM 0 HB2 GLN A 17 7.822 -12.559 3.449 1.00 0.00 H new ATOM 0 HB3 GLN A 17 8.328 -10.924 3.825 1.00 0.00 H new ATOM 0 HG2 GLN A 17 6.791 -12.257 6.002 1.00 0.00 H new ATOM 0 HG3 GLN A 17 8.319 -13.028 5.626 1.00 0.00 H new ATOM 0 HE21 GLN A 17 10.265 -11.765 5.619 1.00 0.00 H new ATOM 0 HE22 GLN A 17 10.419 -10.360 6.678 1.00 0.00 H new ATOM 235 N THR A 18 6.640 -9.819 1.879 1.00 0.00 N ATOM 236 CA THR A 18 6.719 -8.584 1.118 1.00 0.00 C ATOM 237 C THR A 18 5.363 -7.876 1.108 1.00 0.00 C ATOM 238 O THR A 18 5.294 -6.658 1.261 1.00 0.00 O ATOM 239 CB THR A 18 7.237 -8.923 -0.281 1.00 0.00 C ATOM 240 OG1 THR A 18 8.389 -9.727 -0.040 1.00 0.00 O ATOM 241 CG2 THR A 18 7.785 -7.698 -1.016 1.00 0.00 C ATOM 0 H THR A 18 6.932 -10.653 1.370 1.00 0.00 H new ATOM 0 HA THR A 18 7.414 -7.881 1.577 1.00 0.00 H new ATOM 0 HB THR A 18 6.433 -9.368 -0.867 1.00 0.00 H new ATOM 0 HG1 THR A 18 8.248 -10.621 -0.415 1.00 0.00 H new ATOM 0 HG21 THR A 18 8.139 -7.994 -2.003 1.00 0.00 H new ATOM 0 HG22 THR A 18 6.995 -6.954 -1.122 1.00 0.00 H new ATOM 0 HG23 THR A 18 8.611 -7.272 -0.447 1.00 0.00 H new ATOM 249 N CYS A 19 4.318 -8.670 0.928 1.00 0.00 N ATOM 250 CA CYS A 19 2.967 -8.135 0.896 1.00 0.00 C ATOM 251 C CYS A 19 2.669 -7.505 2.258 1.00 0.00 C ATOM 252 O CYS A 19 2.388 -6.311 2.346 1.00 0.00 O ATOM 253 CB CYS A 19 1.942 -9.208 0.526 1.00 0.00 C ATOM 254 SG CYS A 19 1.926 -9.461 -1.286 1.00 0.00 S ATOM 0 H CYS A 19 4.379 -9.680 0.803 1.00 0.00 H new ATOM 0 HA CYS A 19 2.892 -7.373 0.120 1.00 0.00 H new ATOM 0 HB2 CYS A 19 2.185 -10.144 1.030 1.00 0.00 H new ATOM 0 HB3 CYS A 19 0.951 -8.909 0.868 1.00 0.00 H new ATOM 0 HG CYS A 19 1.054 -10.376 -1.589 1.00 0.00 H new ATOM 260 N SER A 20 2.739 -8.337 3.287 1.00 0.00 N ATOM 261 CA SER A 20 2.480 -7.877 4.641 1.00 0.00 C ATOM 262 C SER A 20 3.172 -6.533 4.878 1.00 0.00 C ATOM 263 O SER A 20 2.517 -5.538 5.184 1.00 0.00 O ATOM 264 CB SER A 20 2.949 -8.905 5.672 1.00 0.00 C ATOM 265 OG SER A 20 2.454 -8.617 6.977 1.00 0.00 O ATOM 0 H SER A 20 2.971 -9.327 3.210 1.00 0.00 H new ATOM 0 HA SER A 20 1.404 -7.750 4.759 1.00 0.00 H new ATOM 0 HB2 SER A 20 2.618 -9.899 5.370 1.00 0.00 H new ATOM 0 HB3 SER A 20 4.039 -8.925 5.694 1.00 0.00 H new ATOM 0 HG SER A 20 2.774 -9.297 7.606 1.00 0.00 H new ATOM 271 N GLY A 21 4.489 -6.548 4.729 1.00 0.00 N ATOM 272 CA GLY A 21 5.277 -5.343 4.924 1.00 0.00 C ATOM 273 C GLY A 21 4.688 -4.169 4.140 1.00 0.00 C ATOM 274 O GLY A 21 4.363 -3.133 4.717 1.00 0.00 O ATOM 0 H GLY A 21 5.029 -7.375 4.476 1.00 0.00 H new ATOM 0 HA2 GLY A 21 5.312 -5.095 5.985 1.00 0.00 H new ATOM 0 HA3 GLY A 21 6.304 -5.520 4.604 1.00 0.00 H new ATOM 278 N ASN A 22 4.567 -4.371 2.836 1.00 0.00 N ATOM 279 CA ASN A 22 4.022 -3.342 1.966 1.00 0.00 C ATOM 280 C ASN A 22 2.796 -2.715 2.632 1.00 0.00 C ATOM 281 O ASN A 22 2.760 -1.508 2.865 1.00 0.00 O ATOM 282 CB ASN A 22 3.583 -3.931 0.624 1.00 0.00 C ATOM 283 CG ASN A 22 4.793 -4.340 -0.218 1.00 0.00 C ATOM 284 OD1 ASN A 22 5.933 -4.048 0.104 1.00 0.00 O ATOM 285 ND2 ASN A 22 4.483 -5.031 -1.311 1.00 0.00 N ATOM 0 H ASN A 22 4.837 -5.232 2.361 1.00 0.00 H new ATOM 0 HA ASN A 22 4.800 -2.598 1.795 1.00 0.00 H new ATOM 0 HB2 ASN A 22 2.945 -4.798 0.795 1.00 0.00 H new ATOM 0 HB3 ASN A 22 2.987 -3.199 0.079 1.00 0.00 H new ATOM 0 HD21 ASN A 22 5.221 -5.351 -1.939 1.00 0.00 H new ATOM 0 HD22 ASN A 22 3.507 -5.241 -1.522 1.00 0.00 H new ATOM 292 N ILE A 23 1.819 -3.564 2.919 1.00 0.00 N ATOM 293 CA ILE A 23 0.594 -3.108 3.553 1.00 0.00 C ATOM 294 C ILE A 23 0.939 -2.117 4.667 1.00 0.00 C ATOM 295 O ILE A 23 0.531 -0.958 4.620 1.00 0.00 O ATOM 296 CB ILE A 23 -0.239 -4.300 4.027 1.00 0.00 C ATOM 297 CG1 ILE A 23 -0.851 -5.048 2.841 1.00 0.00 C ATOM 298 CG2 ILE A 23 -1.301 -3.860 5.037 1.00 0.00 C ATOM 299 CD1 ILE A 23 -1.654 -6.262 3.313 1.00 0.00 C ATOM 0 H ILE A 23 1.851 -4.565 2.724 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.031 -2.576 2.836 1.00 0.00 H new ATOM 0 HB ILE A 23 0.424 -4.997 4.540 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -1.498 -4.376 2.278 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -0.061 -5.371 2.164 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -1.879 -4.727 5.358 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -0.815 -3.407 5.902 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -1.966 -3.132 4.572 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -2.078 -6.776 2.450 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -0.998 -6.944 3.855 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -2.458 -5.933 3.971 1.00 0.00 H new ATOM 311 N GLN A 24 1.688 -2.610 5.642 1.00 0.00 N ATOM 312 CA GLN A 24 2.093 -1.782 6.766 1.00 0.00 C ATOM 313 C GLN A 24 2.498 -0.389 6.280 1.00 0.00 C ATOM 314 O GLN A 24 1.915 0.611 6.696 1.00 0.00 O ATOM 315 CB GLN A 24 3.229 -2.441 7.551 1.00 0.00 C ATOM 316 CG GLN A 24 2.757 -3.735 8.217 1.00 0.00 C ATOM 317 CD GLN A 24 3.940 -4.524 8.783 1.00 0.00 C ATOM 318 OE1 GLN A 24 4.991 -3.984 9.085 1.00 0.00 O ATOM 319 NE2 GLN A 24 3.711 -5.828 8.909 1.00 0.00 N ATOM 0 H GLN A 24 2.025 -3.572 5.677 1.00 0.00 H new ATOM 0 HA GLN A 24 1.243 -1.677 7.440 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.062 -2.655 6.881 1.00 0.00 H new ATOM 0 HB3 GLN A 24 3.599 -1.751 8.310 1.00 0.00 H new ATOM 0 HG2 GLN A 24 2.055 -3.501 9.017 1.00 0.00 H new ATOM 0 HG3 GLN A 24 2.221 -4.347 7.492 1.00 0.00 H new ATOM 0 HE21 GLN A 24 2.808 -6.216 8.637 1.00 0.00 H new ATOM 0 HE22 GLN A 24 4.439 -6.440 9.278 1.00 0.00 H new ATOM 328 N ARG A 25 3.494 -0.368 5.407 1.00 0.00 N ATOM 329 CA ARG A 25 3.984 0.886 4.861 1.00 0.00 C ATOM 330 C ARG A 25 2.828 1.693 4.266 1.00 0.00 C ATOM 331 O ARG A 25 2.627 2.852 4.625 1.00 0.00 O ATOM 332 CB ARG A 25 5.036 0.641 3.777 1.00 0.00 C ATOM 333 CG ARG A 25 6.446 0.635 4.373 1.00 0.00 C ATOM 334 CD ARG A 25 6.994 -0.790 4.470 1.00 0.00 C ATOM 335 NE ARG A 25 7.946 -0.890 5.600 1.00 0.00 N ATOM 336 CZ ARG A 25 8.551 -2.025 5.974 1.00 0.00 C ATOM 337 NH1 ARG A 25 8.307 -3.164 5.311 1.00 0.00 N ATOM 338 NH2 ARG A 25 9.400 -2.022 7.010 1.00 0.00 N ATOM 0 H ARG A 25 3.975 -1.199 5.064 1.00 0.00 H new ATOM 0 HA ARG A 25 4.442 1.446 5.676 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.841 -0.312 3.285 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.963 1.415 3.013 1.00 0.00 H new ATOM 0 HG2 ARG A 25 7.108 1.242 3.756 1.00 0.00 H new ATOM 0 HG3 ARG A 25 6.428 1.090 5.363 1.00 0.00 H new ATOM 0 HD2 ARG A 25 6.175 -1.495 4.610 1.00 0.00 H new ATOM 0 HD3 ARG A 25 7.492 -1.061 3.539 1.00 0.00 H new ATOM 0 HE ARG A 25 8.154 -0.041 6.126 1.00 0.00 H new ATOM 0 HH11 ARG A 25 7.661 -3.166 4.522 1.00 0.00 H new ATOM 0 HH12 ARG A 25 8.768 -4.028 5.596 1.00 0.00 H new ATOM 0 HH21 ARG A 25 9.586 -1.155 7.514 1.00 0.00 H new ATOM 0 HH22 ARG A 25 9.860 -2.887 7.295 1.00 0.00 H new ATOM 352 N ILE A 26 2.099 1.048 3.367 1.00 0.00 N ATOM 353 CA ILE A 26 0.969 1.692 2.720 1.00 0.00 C ATOM 354 C ILE A 26 0.140 2.435 3.769 1.00 0.00 C ATOM 355 O ILE A 26 -0.056 3.645 3.668 1.00 0.00 O ATOM 356 CB ILE A 26 0.164 0.673 1.909 1.00 0.00 C ATOM 357 CG1 ILE A 26 1.020 0.054 0.803 1.00 0.00 C ATOM 358 CG2 ILE A 26 -1.118 1.300 1.359 1.00 0.00 C ATOM 359 CD1 ILE A 26 0.315 -1.149 0.173 1.00 0.00 C ATOM 0 H ILE A 26 2.269 0.087 3.072 1.00 0.00 H new ATOM 0 HA ILE A 26 1.315 2.436 2.002 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.134 -0.136 2.576 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.227 0.801 0.037 1.00 0.00 H new ATOM 0 HG13 ILE A 26 1.981 -0.257 1.213 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -1.671 0.555 0.787 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -1.734 1.653 2.186 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.864 2.139 0.712 1.00 0.00 H new ATOM 0 HD11 ILE A 26 0.945 -1.571 -0.610 1.00 0.00 H new ATOM 0 HD12 ILE A 26 0.132 -1.904 0.937 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.634 -0.830 -0.257 1.00 0.00 H new ATOM 371 N SER A 27 -0.325 1.679 4.754 1.00 0.00 N ATOM 372 CA SER A 27 -1.128 2.251 5.821 1.00 0.00 C ATOM 373 C SER A 27 -0.310 3.288 6.593 1.00 0.00 C ATOM 374 O SER A 27 -0.818 4.354 6.936 1.00 0.00 O ATOM 375 CB SER A 27 -1.638 1.164 6.769 1.00 0.00 C ATOM 376 OG SER A 27 -0.571 0.479 7.419 1.00 0.00 O ATOM 0 H SER A 27 -0.161 0.676 4.835 1.00 0.00 H new ATOM 0 HA SER A 27 -1.993 2.740 5.374 1.00 0.00 H new ATOM 0 HB2 SER A 27 -2.290 1.613 7.518 1.00 0.00 H new ATOM 0 HB3 SER A 27 -2.241 0.449 6.209 1.00 0.00 H new ATOM 0 HG SER A 27 0.189 0.399 6.805 1.00 0.00 H new ATOM 382 N GLN A 28 0.943 2.938 6.845 1.00 0.00 N ATOM 383 CA GLN A 28 1.836 3.826 7.570 1.00 0.00 C ATOM 384 C GLN A 28 1.916 5.185 6.872 1.00 0.00 C ATOM 385 O GLN A 28 1.462 6.192 7.413 1.00 0.00 O ATOM 386 CB GLN A 28 3.226 3.203 7.719 1.00 0.00 C ATOM 387 CG GLN A 28 3.190 2.002 8.666 1.00 0.00 C ATOM 388 CD GLN A 28 4.074 2.243 9.891 1.00 0.00 C ATOM 389 OE1 GLN A 28 3.851 3.144 10.683 1.00 0.00 O ATOM 390 NE2 GLN A 28 5.089 1.390 10.002 1.00 0.00 N ATOM 0 H GLN A 28 1.361 2.052 6.560 1.00 0.00 H new ATOM 0 HA GLN A 28 1.432 3.978 8.571 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.594 2.890 6.742 1.00 0.00 H new ATOM 0 HB3 GLN A 28 3.924 3.949 8.099 1.00 0.00 H new ATOM 0 HG2 GLN A 28 2.164 1.816 8.984 1.00 0.00 H new ATOM 0 HG3 GLN A 28 3.527 1.109 8.140 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.219 0.658 9.304 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.737 1.468 10.786 1.00 0.00 H new ATOM 399 N ALA A 29 2.497 5.169 5.681 1.00 0.00 N ATOM 400 CA ALA A 29 2.643 6.388 4.904 1.00 0.00 C ATOM 401 C ALA A 29 1.309 7.138 4.885 1.00 0.00 C ATOM 402 O ALA A 29 1.281 8.364 4.982 1.00 0.00 O ATOM 403 CB ALA A 29 3.137 6.041 3.498 1.00 0.00 C ATOM 0 H ALA A 29 2.872 4.331 5.236 1.00 0.00 H new ATOM 0 HA ALA A 29 3.385 7.046 5.357 1.00 0.00 H new ATOM 0 HB1 ALA A 29 3.247 6.955 2.915 1.00 0.00 H new ATOM 0 HB2 ALA A 29 4.101 5.536 3.565 1.00 0.00 H new ATOM 0 HB3 ALA A 29 2.416 5.384 3.011 1.00 0.00 H new ATOM 409 N THR A 30 0.237 6.370 4.759 1.00 0.00 N ATOM 410 CA THR A 30 -1.097 6.946 4.726 1.00 0.00 C ATOM 411 C THR A 30 -1.404 7.655 6.047 1.00 0.00 C ATOM 412 O THR A 30 -2.125 8.652 6.068 1.00 0.00 O ATOM 413 CB THR A 30 -2.087 5.829 4.391 1.00 0.00 C ATOM 414 OG1 THR A 30 -2.063 5.759 2.968 1.00 0.00 O ATOM 415 CG2 THR A 30 -3.531 6.208 4.721 1.00 0.00 C ATOM 0 H THR A 30 0.265 5.354 4.679 1.00 0.00 H new ATOM 0 HA THR A 30 -1.178 7.712 3.955 1.00 0.00 H new ATOM 0 HB THR A 30 -1.815 4.927 4.939 1.00 0.00 H new ATOM 0 HG1 THR A 30 -1.436 5.061 2.685 1.00 0.00 H new ATOM 0 HG21 THR A 30 -4.192 5.380 4.464 1.00 0.00 H new ATOM 0 HG22 THR A 30 -3.616 6.423 5.786 1.00 0.00 H new ATOM 0 HG23 THR A 30 -3.815 7.091 4.148 1.00 0.00 H new ATOM 423 N ALA A 31 -0.843 7.112 7.117 1.00 0.00 N ATOM 424 CA ALA A 31 -1.048 7.680 8.439 1.00 0.00 C ATOM 425 C ALA A 31 -0.337 9.031 8.525 1.00 0.00 C ATOM 426 O ALA A 31 -0.867 9.980 9.102 1.00 0.00 O ATOM 427 CB ALA A 31 -0.557 6.693 9.500 1.00 0.00 C ATOM 0 H ALA A 31 -0.247 6.285 7.096 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.108 7.854 8.622 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -0.711 7.119 10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.115 5.760 9.415 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.505 6.496 9.350 1.00 0.00 H new ATOM 433 N GLN A 32 0.852 9.076 7.943 1.00 0.00 N ATOM 434 CA GLN A 32 1.641 10.296 7.946 1.00 0.00 C ATOM 435 C GLN A 32 0.917 11.400 7.172 1.00 0.00 C ATOM 436 O GLN A 32 0.753 12.510 7.675 1.00 0.00 O ATOM 437 CB GLN A 32 3.037 10.048 7.370 1.00 0.00 C ATOM 438 CG GLN A 32 4.109 10.180 8.454 1.00 0.00 C ATOM 439 CD GLN A 32 3.914 11.462 9.265 1.00 0.00 C ATOM 440 OE1 GLN A 32 3.226 11.492 10.272 1.00 0.00 O ATOM 441 NE2 GLN A 32 4.556 12.517 8.772 1.00 0.00 N ATOM 0 H GLN A 32 1.288 8.287 7.466 1.00 0.00 H new ATOM 0 HA GLN A 32 1.762 10.623 8.979 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.081 9.052 6.930 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.235 10.760 6.569 1.00 0.00 H new ATOM 0 HG2 GLN A 32 4.069 9.316 9.117 1.00 0.00 H new ATOM 0 HG3 GLN A 32 5.097 10.183 7.994 1.00 0.00 H new ATOM 0 HE21 GLN A 32 5.116 12.423 7.924 1.00 0.00 H new ATOM 0 HE22 GLN A 32 4.489 13.420 9.241 1.00 0.00 H new ATOM 450 N ILE A 33 0.503 11.055 5.961 1.00 0.00 N ATOM 451 CA ILE A 33 -0.199 12.002 5.113 1.00 0.00 C ATOM 452 C ILE A 33 -1.320 12.666 5.916 1.00 0.00 C ATOM 453 O ILE A 33 -1.637 13.834 5.698 1.00 0.00 O ATOM 454 CB ILE A 33 -0.683 11.319 3.832 1.00 0.00 C ATOM 455 CG1 ILE A 33 0.491 11.008 2.901 1.00 0.00 C ATOM 456 CG2 ILE A 33 -1.760 12.154 3.138 1.00 0.00 C ATOM 457 CD1 ILE A 33 0.316 9.640 2.237 1.00 0.00 C ATOM 0 H ILE A 33 0.641 10.133 5.548 1.00 0.00 H new ATOM 0 HA ILE A 33 0.475 12.795 4.789 1.00 0.00 H new ATOM 0 HB ILE A 33 -1.140 10.368 4.103 1.00 0.00 H new ATOM 0 HG12 ILE A 33 0.568 11.781 2.136 1.00 0.00 H new ATOM 0 HG13 ILE A 33 1.423 11.025 3.466 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.086 11.646 2.231 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -2.610 12.281 3.808 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.352 13.131 2.880 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.164 9.443 1.581 1.00 0.00 H new ATOM 0 HD12 ILE A 33 0.264 8.867 3.004 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -0.604 9.634 1.653 1.00 0.00 H new ATOM 469 N LYS A 34 -1.889 11.892 6.828 1.00 0.00 N ATOM 470 CA LYS A 34 -2.968 12.390 7.665 1.00 0.00 C ATOM 471 C LYS A 34 -2.382 13.250 8.786 1.00 0.00 C ATOM 472 O LYS A 34 -3.011 14.209 9.231 1.00 0.00 O ATOM 473 CB LYS A 34 -3.835 11.233 8.166 1.00 0.00 C ATOM 474 CG LYS A 34 -4.849 10.808 7.103 1.00 0.00 C ATOM 475 CD LYS A 34 -5.626 9.568 7.552 1.00 0.00 C ATOM 476 CE LYS A 34 -5.129 8.317 6.824 1.00 0.00 C ATOM 477 NZ LYS A 34 -4.708 7.285 7.797 1.00 0.00 N ATOM 0 H LYS A 34 -1.623 10.923 7.006 1.00 0.00 H new ATOM 0 HA LYS A 34 -3.635 13.030 7.087 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -3.201 10.386 8.428 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -4.358 11.533 9.074 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.543 11.626 6.909 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -4.333 10.599 6.166 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.516 9.435 8.628 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -6.689 9.709 7.356 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.919 7.922 6.185 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -4.293 8.575 6.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -3.718 7.022 7.618 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -4.797 7.661 8.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -5.313 6.445 7.696 1.00 0.00 H new ATOM 491 N ASN A 35 -1.183 12.876 9.211 1.00 0.00 N ATOM 492 CA ASN A 35 -0.506 13.602 10.272 1.00 0.00 C ATOM 493 C ASN A 35 0.037 14.920 9.717 1.00 0.00 C ATOM 494 O ASN A 35 -0.089 15.965 10.354 1.00 0.00 O ATOM 495 CB ASN A 35 0.675 12.799 10.821 1.00 0.00 C ATOM 496 CG ASN A 35 1.041 13.257 12.234 1.00 0.00 C ATOM 497 OD1 ASN A 35 0.788 14.382 12.634 1.00 0.00 O ATOM 498 ND2 ASN A 35 1.649 12.327 12.964 1.00 0.00 N ATOM 0 H ASN A 35 -0.664 12.080 8.840 1.00 0.00 H new ATOM 0 HA ASN A 35 -1.226 13.779 11.071 1.00 0.00 H new ATOM 0 HB2 ASN A 35 0.424 11.738 10.832 1.00 0.00 H new ATOM 0 HB3 ASN A 35 1.536 12.916 10.163 1.00 0.00 H new ATOM 0 HD21 ASN A 35 1.934 12.535 13.921 1.00 0.00 H new ATOM 0 HD22 ASN A 35 1.830 11.405 12.567 1.00 0.00 H new ATOM 505 N LEU A 36 0.628 14.829 8.534 1.00 0.00 N ATOM 506 CA LEU A 36 1.190 16.001 7.886 1.00 0.00 C ATOM 507 C LEU A 36 0.054 16.884 7.365 1.00 0.00 C ATOM 508 O LEU A 36 0.235 18.086 7.173 1.00 0.00 O ATOM 509 CB LEU A 36 2.193 15.588 6.807 1.00 0.00 C ATOM 510 CG LEU A 36 3.415 14.806 7.291 1.00 0.00 C ATOM 511 CD1 LEU A 36 3.943 13.879 6.194 1.00 0.00 C ATOM 512 CD2 LEU A 36 4.499 15.751 7.813 1.00 0.00 C ATOM 0 H LEU A 36 0.729 13.961 8.008 1.00 0.00 H new ATOM 0 HA LEU A 36 1.756 16.598 8.602 1.00 0.00 H new ATOM 0 HB2 LEU A 36 1.670 14.984 6.065 1.00 0.00 H new ATOM 0 HB3 LEU A 36 2.540 16.487 6.298 1.00 0.00 H new ATOM 0 HG LEU A 36 3.108 14.175 8.125 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.812 13.335 6.564 1.00 0.00 H new ATOM 0 HD12 LEU A 36 3.165 13.170 5.911 1.00 0.00 H new ATOM 0 HD13 LEU A 36 4.229 14.471 5.324 1.00 0.00 H new ATOM 0 HD21 LEU A 36 5.357 15.169 8.151 1.00 0.00 H new ATOM 0 HD22 LEU A 36 4.809 16.425 7.015 1.00 0.00 H new ATOM 0 HD23 LEU A 36 4.104 16.333 8.646 1.00 0.00 H new ATOM 524 N MET A 37 -1.091 16.254 7.151 1.00 0.00 N ATOM 525 CA MET A 37 -2.257 16.967 6.656 1.00 0.00 C ATOM 526 C MET A 37 -2.584 18.167 7.546 1.00 0.00 C ATOM 527 O MET A 37 -2.631 19.302 7.074 1.00 0.00 O ATOM 528 CB MET A 37 -3.456 16.019 6.614 1.00 0.00 C ATOM 529 CG MET A 37 -4.178 16.105 5.268 1.00 0.00 C ATOM 530 SD MET A 37 -5.406 14.816 5.149 1.00 0.00 S ATOM 531 CE MET A 37 -4.443 13.542 4.352 1.00 0.00 C ATOM 0 H MET A 37 -1.237 15.257 7.311 1.00 0.00 H new ATOM 0 HA MET A 37 -2.038 17.332 5.653 1.00 0.00 H new ATOM 0 HB2 MET A 37 -3.121 14.996 6.786 1.00 0.00 H new ATOM 0 HB3 MET A 37 -4.148 16.267 7.418 1.00 0.00 H new ATOM 0 HG2 MET A 37 -4.652 17.081 5.162 1.00 0.00 H new ATOM 0 HG3 MET A 37 -3.459 16.010 4.454 1.00 0.00 H new ATOM 0 HE1 MET A 37 -4.975 13.180 3.472 1.00 0.00 H new ATOM 0 HE2 MET A 37 -3.478 13.950 4.050 1.00 0.00 H new ATOM 0 HE3 MET A 37 -4.286 12.716 5.046 1.00 0.00 H new ATOM 541 N SER A 38 -2.804 17.876 8.820 1.00 0.00 N ATOM 542 CA SER A 38 -3.126 18.916 9.782 1.00 0.00 C ATOM 543 C SER A 38 -2.287 20.165 9.502 1.00 0.00 C ATOM 544 O SER A 38 -2.828 21.258 9.345 1.00 0.00 O ATOM 545 CB SER A 38 -2.896 18.433 11.215 1.00 0.00 C ATOM 546 OG SER A 38 -4.108 18.385 11.962 1.00 0.00 O ATOM 0 H SER A 38 -2.765 16.934 9.208 1.00 0.00 H new ATOM 0 HA SER A 38 -4.182 19.163 9.677 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.443 17.442 11.195 1.00 0.00 H new ATOM 0 HB3 SER A 38 -2.189 19.097 11.713 1.00 0.00 H new ATOM 0 HG SER A 38 -3.920 18.070 12.871 1.00 0.00 H new ATOM 755 N ASN A 52 7.133 15.565 1.569 1.00 0.00 N ATOM 756 CA ASN A 52 6.880 14.369 2.355 1.00 0.00 C ATOM 757 C ASN A 52 5.535 13.767 1.944 1.00 0.00 C ATOM 758 O ASN A 52 5.416 12.553 1.786 1.00 0.00 O ATOM 759 CB ASN A 52 6.815 14.696 3.849 1.00 0.00 C ATOM 760 CG ASN A 52 8.006 14.091 4.595 1.00 0.00 C ATOM 761 OD1 ASN A 52 8.065 12.902 4.863 1.00 0.00 O ATOM 762 ND2 ASN A 52 8.949 14.973 4.914 1.00 0.00 N ATOM 0 HA ASN A 52 7.695 13.668 2.174 1.00 0.00 H new ATOM 0 HB2 ASN A 52 6.805 15.777 3.988 1.00 0.00 H new ATOM 0 HB3 ASN A 52 5.885 14.312 4.269 1.00 0.00 H new ATOM 0 HD21 ASN A 52 9.785 14.668 5.413 1.00 0.00 H new ATOM 0 HD22 ASN A 52 8.837 15.954 4.659 1.00 0.00 H new ATOM 769 N LEU A 53 4.556 14.645 1.782 1.00 0.00 N ATOM 770 CA LEU A 53 3.223 14.215 1.391 1.00 0.00 C ATOM 771 C LEU A 53 3.316 13.375 0.116 1.00 0.00 C ATOM 772 O LEU A 53 2.890 12.221 0.097 1.00 0.00 O ATOM 773 CB LEU A 53 2.287 15.419 1.267 1.00 0.00 C ATOM 774 CG LEU A 53 2.196 16.327 2.495 1.00 0.00 C ATOM 775 CD1 LEU A 53 1.612 17.692 2.125 1.00 0.00 C ATOM 776 CD2 LEU A 53 1.408 15.652 3.619 1.00 0.00 C ATOM 0 H LEU A 53 4.658 15.651 1.914 1.00 0.00 H new ATOM 0 HA LEU A 53 2.787 13.579 2.161 1.00 0.00 H new ATOM 0 HB2 LEU A 53 2.612 16.021 0.418 1.00 0.00 H new ATOM 0 HB3 LEU A 53 1.287 15.054 1.035 1.00 0.00 H new ATOM 0 HG LEU A 53 3.206 16.499 2.868 1.00 0.00 H new ATOM 0 HD11 LEU A 53 1.558 18.318 3.016 1.00 0.00 H new ATOM 0 HD12 LEU A 53 2.250 18.171 1.382 1.00 0.00 H new ATOM 0 HD13 LEU A 53 0.611 17.560 1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 53 1.358 16.319 4.480 1.00 0.00 H new ATOM 0 HD22 LEU A 53 0.398 15.430 3.273 1.00 0.00 H new ATOM 0 HD23 LEU A 53 1.905 14.725 3.906 1.00 0.00 H new ATOM 788 N GLN A 54 3.876 13.985 -0.918 1.00 0.00 N ATOM 789 CA GLN A 54 4.031 13.307 -2.193 1.00 0.00 C ATOM 790 C GLN A 54 4.836 12.019 -2.016 1.00 0.00 C ATOM 791 O GLN A 54 4.317 10.924 -2.228 1.00 0.00 O ATOM 792 CB GLN A 54 4.686 14.226 -3.226 1.00 0.00 C ATOM 793 CG GLN A 54 3.659 15.175 -3.846 1.00 0.00 C ATOM 794 CD GLN A 54 3.164 14.644 -5.193 1.00 0.00 C ATOM 795 OE1 GLN A 54 2.877 13.470 -5.359 1.00 0.00 O ATOM 796 NE2 GLN A 54 3.080 15.572 -6.142 1.00 0.00 N ATOM 0 H GLN A 54 4.228 14.942 -0.898 1.00 0.00 H new ATOM 0 HA GLN A 54 3.041 13.044 -2.565 1.00 0.00 H new ATOM 0 HB2 GLN A 54 5.480 14.803 -2.753 1.00 0.00 H new ATOM 0 HB3 GLN A 54 5.151 13.626 -4.008 1.00 0.00 H new ATOM 0 HG2 GLN A 54 2.815 15.297 -3.167 1.00 0.00 H new ATOM 0 HG3 GLN A 54 4.105 16.161 -3.981 1.00 0.00 H new ATOM 0 HE21 GLN A 54 3.336 16.537 -5.935 1.00 0.00 H new ATOM 0 HE22 GLN A 54 2.759 15.318 -7.076 1.00 0.00 H new ATOM 805 N GLN A 55 6.091 12.192 -1.628 1.00 0.00 N ATOM 806 CA GLN A 55 6.973 11.056 -1.420 1.00 0.00 C ATOM 807 C GLN A 55 6.235 9.940 -0.678 1.00 0.00 C ATOM 808 O GLN A 55 6.333 8.772 -1.051 1.00 0.00 O ATOM 809 CB GLN A 55 8.236 11.475 -0.664 1.00 0.00 C ATOM 810 CG GLN A 55 9.472 11.366 -1.560 1.00 0.00 C ATOM 811 CD GLN A 55 10.328 10.160 -1.170 1.00 0.00 C ATOM 812 OE1 GLN A 55 11.432 10.286 -0.665 1.00 0.00 O ATOM 813 NE2 GLN A 55 9.760 8.986 -1.430 1.00 0.00 N ATOM 0 H GLN A 55 6.518 13.101 -1.452 1.00 0.00 H new ATOM 0 HA GLN A 55 7.281 10.676 -2.394 1.00 0.00 H new ATOM 0 HB2 GLN A 55 8.129 12.500 -0.309 1.00 0.00 H new ATOM 0 HB3 GLN A 55 8.363 10.845 0.216 1.00 0.00 H new ATOM 0 HG2 GLN A 55 9.164 11.276 -2.602 1.00 0.00 H new ATOM 0 HG3 GLN A 55 10.064 12.278 -1.481 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.833 8.951 -1.854 1.00 0.00 H new ATOM 0 HE22 GLN A 55 10.251 8.121 -1.205 1.00 0.00 H new ATOM 822 N LEU A 56 5.513 10.339 0.359 1.00 0.00 N ATOM 823 CA LEU A 56 4.759 9.387 1.156 1.00 0.00 C ATOM 824 C LEU A 56 3.745 8.670 0.263 1.00 0.00 C ATOM 825 O LEU A 56 3.569 7.457 0.366 1.00 0.00 O ATOM 826 CB LEU A 56 4.130 10.080 2.366 1.00 0.00 C ATOM 827 CG LEU A 56 5.054 10.310 3.564 1.00 0.00 C ATOM 828 CD1 LEU A 56 4.695 11.606 4.293 1.00 0.00 C ATOM 829 CD2 LEU A 56 5.045 9.102 4.503 1.00 0.00 C ATOM 0 H LEU A 56 5.434 11.309 0.665 1.00 0.00 H new ATOM 0 HA LEU A 56 5.422 8.623 1.564 1.00 0.00 H new ATOM 0 HB2 LEU A 56 3.739 11.045 2.044 1.00 0.00 H new ATOM 0 HB3 LEU A 56 3.279 9.486 2.698 1.00 0.00 H new ATOM 0 HG LEU A 56 6.073 10.422 3.193 1.00 0.00 H new ATOM 0 HD11 LEU A 56 5.367 11.745 5.140 1.00 0.00 H new ATOM 0 HD12 LEU A 56 4.795 12.448 3.608 1.00 0.00 H new ATOM 0 HD13 LEU A 56 3.667 11.549 4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 56 5.710 9.291 5.346 1.00 0.00 H new ATOM 0 HD22 LEU A 56 4.032 8.934 4.870 1.00 0.00 H new ATOM 0 HD23 LEU A 56 5.386 8.219 3.963 1.00 0.00 H new ATOM 841 N GLN A 57 3.104 9.450 -0.595 1.00 0.00 N ATOM 842 CA GLN A 57 2.112 8.905 -1.506 1.00 0.00 C ATOM 843 C GLN A 57 2.782 7.993 -2.536 1.00 0.00 C ATOM 844 O GLN A 57 2.429 6.821 -2.654 1.00 0.00 O ATOM 845 CB GLN A 57 1.325 10.023 -2.193 1.00 0.00 C ATOM 846 CG GLN A 57 0.282 10.621 -1.247 1.00 0.00 C ATOM 847 CD GLN A 57 -0.611 11.624 -1.979 1.00 0.00 C ATOM 848 OE1 GLN A 57 -1.251 11.316 -2.971 1.00 0.00 O ATOM 849 NE2 GLN A 57 -0.618 12.838 -1.437 1.00 0.00 N ATOM 0 H GLN A 57 3.252 10.456 -0.678 1.00 0.00 H new ATOM 0 HA GLN A 57 1.405 8.310 -0.928 1.00 0.00 H new ATOM 0 HB2 GLN A 57 2.010 10.803 -2.525 1.00 0.00 H new ATOM 0 HB3 GLN A 57 0.832 9.632 -3.083 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -0.330 9.824 -0.825 1.00 0.00 H new ATOM 0 HG3 GLN A 57 0.782 11.115 -0.414 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -0.059 13.029 -0.606 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -1.183 13.579 -1.853 1.00 0.00 H new ATOM 858 N HIS A 58 3.736 8.566 -3.255 1.00 0.00 N ATOM 859 CA HIS A 58 4.458 7.820 -4.271 1.00 0.00 C ATOM 860 C HIS A 58 4.884 6.463 -3.705 1.00 0.00 C ATOM 861 O HIS A 58 4.477 5.419 -4.213 1.00 0.00 O ATOM 862 CB HIS A 58 5.637 8.634 -4.809 1.00 0.00 C ATOM 863 CG HIS A 58 6.712 7.800 -5.463 1.00 0.00 C ATOM 864 ND1 HIS A 58 6.578 7.268 -6.734 1.00 0.00 N ATOM 865 CD2 HIS A 58 7.939 7.413 -5.011 1.00 0.00 C ATOM 866 CE1 HIS A 58 7.681 6.593 -7.022 1.00 0.00 C ATOM 867 NE2 HIS A 58 8.523 6.683 -5.953 1.00 0.00 N ATOM 0 H HIS A 58 4.026 9.539 -3.154 1.00 0.00 H new ATOM 0 HA HIS A 58 3.804 7.631 -5.122 1.00 0.00 H new ATOM 0 HB2 HIS A 58 5.264 9.360 -5.532 1.00 0.00 H new ATOM 0 HB3 HIS A 58 6.079 9.200 -3.989 1.00 0.00 H new ATOM 0 HD2 HIS A 58 8.364 7.659 -4.049 1.00 0.00 H new ATOM 0 HE1 HIS A 58 7.879 6.064 -7.943 1.00 0.00 H new ATOM 0 HE2 HIS A 58 9.449 6.259 -5.888 1.00 0.00 H new ATOM 875 N SER A 59 5.698 6.522 -2.661 1.00 0.00 N ATOM 876 CA SER A 59 6.183 5.312 -2.021 1.00 0.00 C ATOM 877 C SER A 59 5.047 4.296 -1.893 1.00 0.00 C ATOM 878 O SER A 59 5.196 3.139 -2.283 1.00 0.00 O ATOM 879 CB SER A 59 6.780 5.617 -0.646 1.00 0.00 C ATOM 880 OG SER A 59 8.147 5.225 -0.558 1.00 0.00 O ATOM 0 H SER A 59 6.034 7.390 -2.243 1.00 0.00 H new ATOM 0 HA SER A 59 6.972 4.889 -2.643 1.00 0.00 H new ATOM 0 HB2 SER A 59 6.695 6.685 -0.443 1.00 0.00 H new ATOM 0 HB3 SER A 59 6.205 5.100 0.122 1.00 0.00 H new ATOM 0 HG SER A 59 8.492 5.438 0.334 1.00 0.00 H new ATOM 886 N THR A 60 3.935 4.765 -1.345 1.00 0.00 N ATOM 887 CA THR A 60 2.774 3.912 -1.161 1.00 0.00 C ATOM 888 C THR A 60 2.196 3.497 -2.515 1.00 0.00 C ATOM 889 O THR A 60 1.771 2.356 -2.690 1.00 0.00 O ATOM 890 CB THR A 60 1.773 4.660 -0.277 1.00 0.00 C ATOM 891 OG1 THR A 60 2.462 4.831 0.959 1.00 0.00 O ATOM 892 CG2 THR A 60 0.560 3.802 0.089 1.00 0.00 C ATOM 0 H THR A 60 3.814 5.725 -1.023 1.00 0.00 H new ATOM 0 HA THR A 60 3.043 2.982 -0.659 1.00 0.00 H new ATOM 0 HB THR A 60 1.439 5.562 -0.790 1.00 0.00 H new ATOM 0 HG1 THR A 60 3.013 5.641 0.917 1.00 0.00 H new ATOM 0 HG21 THR A 60 -0.118 4.380 0.717 1.00 0.00 H new ATOM 0 HG22 THR A 60 0.042 3.497 -0.820 1.00 0.00 H new ATOM 0 HG23 THR A 60 0.891 2.917 0.632 1.00 0.00 H new ATOM 900 N ASN A 61 2.200 4.446 -3.440 1.00 0.00 N ATOM 901 CA ASN A 61 1.682 4.193 -4.774 1.00 0.00 C ATOM 902 C ASN A 61 2.274 2.887 -5.307 1.00 0.00 C ATOM 903 O ASN A 61 1.540 1.998 -5.736 1.00 0.00 O ATOM 904 CB ASN A 61 2.070 5.317 -5.737 1.00 0.00 C ATOM 905 CG ASN A 61 0.909 5.662 -6.673 1.00 0.00 C ATOM 906 OD1 ASN A 61 -0.052 6.313 -6.297 1.00 0.00 O ATOM 907 ND2 ASN A 61 1.051 5.191 -7.908 1.00 0.00 N ATOM 0 H ASN A 61 2.554 5.391 -3.292 1.00 0.00 H new ATOM 0 HA ASN A 61 0.596 4.133 -4.709 1.00 0.00 H new ATOM 0 HB2 ASN A 61 2.361 6.202 -5.171 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.938 5.015 -6.324 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.330 5.368 -8.607 1.00 0.00 H new ATOM 0 HD22 ASN A 61 1.881 4.653 -8.156 1.00 0.00 H new ATOM 914 N GLN A 62 3.596 2.813 -5.263 1.00 0.00 N ATOM 915 CA GLN A 62 4.295 1.630 -5.737 1.00 0.00 C ATOM 916 C GLN A 62 3.976 0.431 -4.842 1.00 0.00 C ATOM 917 O GLN A 62 3.463 -0.582 -5.315 1.00 0.00 O ATOM 918 CB GLN A 62 5.803 1.876 -5.807 1.00 0.00 C ATOM 919 CG GLN A 62 6.107 3.265 -6.373 1.00 0.00 C ATOM 920 CD GLN A 62 7.554 3.353 -6.863 1.00 0.00 C ATOM 921 OE1 GLN A 62 8.340 4.171 -6.413 1.00 0.00 O ATOM 922 NE2 GLN A 62 7.860 2.469 -7.807 1.00 0.00 N ATOM 0 H GLN A 62 4.202 3.552 -4.907 1.00 0.00 H new ATOM 0 HA GLN A 62 3.949 1.407 -6.746 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.237 1.782 -4.811 1.00 0.00 H new ATOM 0 HB3 GLN A 62 6.271 1.115 -6.431 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.427 3.483 -7.196 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.932 4.020 -5.607 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.154 1.812 -8.139 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.801 2.447 -8.200 1.00 0.00 H new ATOM 931 N LEU A 63 4.293 0.585 -3.565 1.00 0.00 N ATOM 932 CA LEU A 63 4.047 -0.472 -2.599 1.00 0.00 C ATOM 933 C LEU A 63 2.716 -1.154 -2.925 1.00 0.00 C ATOM 934 O LEU A 63 2.635 -2.381 -2.957 1.00 0.00 O ATOM 935 CB LEU A 63 4.124 0.075 -1.173 1.00 0.00 C ATOM 936 CG LEU A 63 5.530 0.237 -0.592 1.00 0.00 C ATOM 937 CD1 LEU A 63 5.509 1.120 0.657 1.00 0.00 C ATOM 938 CD2 LEU A 63 6.171 -1.125 -0.320 1.00 0.00 C ATOM 0 H LEU A 63 4.718 1.427 -3.177 1.00 0.00 H new ATOM 0 HA LEU A 63 4.822 -1.235 -2.664 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.629 1.046 -1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.556 -0.588 -0.520 1.00 0.00 H new ATOM 0 HG LEU A 63 6.149 0.742 -1.333 1.00 0.00 H new ATOM 0 HD11 LEU A 63 6.521 1.219 1.050 1.00 0.00 H new ATOM 0 HD12 LEU A 63 5.122 2.106 0.399 1.00 0.00 H new ATOM 0 HD13 LEU A 63 4.869 0.665 1.413 1.00 0.00 H new ATOM 0 HD21 LEU A 63 7.170 -0.981 0.092 1.00 0.00 H new ATOM 0 HD22 LEU A 63 5.560 -1.679 0.393 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.241 -1.687 -1.251 1.00 0.00 H new ATOM 950 N ALA A 64 1.706 -0.329 -3.158 1.00 0.00 N ATOM 951 CA ALA A 64 0.383 -0.837 -3.480 1.00 0.00 C ATOM 952 C ALA A 64 0.457 -1.659 -4.768 1.00 0.00 C ATOM 953 O ALA A 64 0.271 -2.874 -4.745 1.00 0.00 O ATOM 954 CB ALA A 64 -0.600 0.331 -3.588 1.00 0.00 C ATOM 0 H ALA A 64 1.777 0.688 -3.130 1.00 0.00 H new ATOM 0 HA ALA A 64 0.021 -1.495 -2.690 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.592 -0.050 -3.830 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -0.637 0.864 -2.638 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -0.271 1.012 -4.373 1.00 0.00 H new ATOM 960 N LYS A 65 0.728 -0.962 -5.862 1.00 0.00 N ATOM 961 CA LYS A 65 0.829 -1.612 -7.158 1.00 0.00 C ATOM 962 C LYS A 65 1.631 -2.907 -7.013 1.00 0.00 C ATOM 963 O LYS A 65 1.281 -3.927 -7.604 1.00 0.00 O ATOM 964 CB LYS A 65 1.401 -0.647 -8.198 1.00 0.00 C ATOM 965 CG LYS A 65 2.889 -0.913 -8.433 1.00 0.00 C ATOM 966 CD LYS A 65 3.514 0.189 -9.291 1.00 0.00 C ATOM 967 CE LYS A 65 2.449 0.910 -10.119 1.00 0.00 C ATOM 968 NZ LYS A 65 3.079 1.876 -11.046 1.00 0.00 N ATOM 0 H LYS A 65 0.881 0.046 -5.878 1.00 0.00 H new ATOM 0 HA LYS A 65 -0.160 -1.889 -7.524 1.00 0.00 H new ATOM 0 HB2 LYS A 65 0.856 -0.753 -9.136 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.260 0.380 -7.862 1.00 0.00 H new ATOM 0 HG2 LYS A 65 3.407 -0.972 -7.476 1.00 0.00 H new ATOM 0 HG3 LYS A 65 3.017 -1.878 -8.924 1.00 0.00 H new ATOM 0 HD2 LYS A 65 4.029 0.905 -8.651 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.264 -0.243 -9.954 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.865 0.183 -10.684 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.756 1.430 -9.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.342 2.357 -11.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 3.617 2.580 -10.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.722 1.371 -11.689 1.00 0.00 H new ATOM 982 N GLU A 66 2.691 -2.823 -6.223 1.00 0.00 N ATOM 983 CA GLU A 66 3.546 -3.975 -5.993 1.00 0.00 C ATOM 984 C GLU A 66 2.733 -5.131 -5.406 1.00 0.00 C ATOM 985 O GLU A 66 2.833 -6.265 -5.872 1.00 0.00 O ATOM 986 CB GLU A 66 4.721 -3.613 -5.083 1.00 0.00 C ATOM 987 CG GLU A 66 5.700 -2.679 -5.797 1.00 0.00 C ATOM 988 CD GLU A 66 6.807 -2.216 -4.847 1.00 0.00 C ATOM 989 OE1 GLU A 66 7.438 -3.104 -4.235 1.00 0.00 O ATOM 990 OE2 GLU A 66 6.997 -0.984 -4.755 1.00 0.00 O ATOM 0 H GLU A 66 2.977 -1.975 -5.734 1.00 0.00 H new ATOM 0 HA GLU A 66 3.956 -4.295 -6.951 1.00 0.00 H new ATOM 0 HB2 GLU A 66 4.350 -3.133 -4.177 1.00 0.00 H new ATOM 0 HB3 GLU A 66 5.239 -4.521 -4.773 1.00 0.00 H new ATOM 0 HG2 GLU A 66 6.140 -3.192 -6.652 1.00 0.00 H new ATOM 0 HG3 GLU A 66 5.164 -1.813 -6.186 1.00 0.00 H new ATOM 997 N THR A 67 1.946 -4.803 -4.392 1.00 0.00 N ATOM 998 CA THR A 67 1.116 -5.799 -3.736 1.00 0.00 C ATOM 999 C THR A 67 0.321 -6.596 -4.772 1.00 0.00 C ATOM 1000 O THR A 67 0.396 -7.824 -4.807 1.00 0.00 O ATOM 1001 CB THR A 67 0.233 -5.080 -2.715 1.00 0.00 C ATOM 1002 OG1 THR A 67 1.056 -4.026 -2.224 1.00 0.00 O ATOM 1003 CG2 THR A 67 -0.051 -5.937 -1.479 1.00 0.00 C ATOM 0 H THR A 67 1.866 -3.861 -4.009 1.00 0.00 H new ATOM 0 HA THR A 67 1.723 -6.532 -3.204 1.00 0.00 H new ATOM 0 HB THR A 67 -0.709 -4.798 -3.186 1.00 0.00 H new ATOM 0 HG1 THR A 67 1.029 -3.271 -2.849 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.682 -5.379 -0.787 1.00 0.00 H new ATOM 0 HG22 THR A 67 -0.563 -6.851 -1.780 1.00 0.00 H new ATOM 0 HG23 THR A 67 0.889 -6.192 -0.989 1.00 0.00 H new ATOM 1011 N ASN A 68 -0.422 -5.867 -5.591 1.00 0.00 N ATOM 1012 CA ASN A 68 -1.230 -6.491 -6.625 1.00 0.00 C ATOM 1013 C ASN A 68 -0.393 -7.545 -7.353 1.00 0.00 C ATOM 1014 O ASN A 68 -0.817 -8.691 -7.494 1.00 0.00 O ATOM 1015 CB ASN A 68 -1.695 -5.461 -7.657 1.00 0.00 C ATOM 1016 CG ASN A 68 -2.724 -6.069 -8.612 1.00 0.00 C ATOM 1017 OD1 ASN A 68 -3.875 -6.288 -8.269 1.00 0.00 O ATOM 1018 ND2 ASN A 68 -2.248 -6.329 -9.826 1.00 0.00 N ATOM 0 H ASN A 68 -0.482 -4.849 -5.560 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.100 -6.941 -6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -2.130 -4.601 -7.148 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -0.838 -5.096 -8.224 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -2.857 -6.736 -10.536 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -1.274 -6.121 -10.047 1.00 0.00 H new ATOM 1025 N GLU A 69 0.780 -7.119 -7.797 1.00 0.00 N ATOM 1026 CA GLU A 69 1.680 -8.012 -8.508 1.00 0.00 C ATOM 1027 C GLU A 69 2.042 -9.211 -7.628 1.00 0.00 C ATOM 1028 O GLU A 69 1.950 -10.356 -8.066 1.00 0.00 O ATOM 1029 CB GLU A 69 2.937 -7.271 -8.968 1.00 0.00 C ATOM 1030 CG GLU A 69 2.741 -6.673 -10.363 1.00 0.00 C ATOM 1031 CD GLU A 69 3.937 -6.983 -11.265 1.00 0.00 C ATOM 1032 OE1 GLU A 69 4.058 -8.161 -11.663 1.00 0.00 O ATOM 1033 OE2 GLU A 69 4.704 -6.033 -11.537 1.00 0.00 O ATOM 0 H GLU A 69 1.128 -6.168 -7.678 1.00 0.00 H new ATOM 0 HA GLU A 69 1.168 -8.380 -9.398 1.00 0.00 H new ATOM 0 HB2 GLU A 69 3.176 -6.478 -8.259 1.00 0.00 H new ATOM 0 HB3 GLU A 69 3.784 -7.956 -8.978 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.831 -7.073 -10.810 1.00 0.00 H new ATOM 0 HG3 GLU A 69 2.610 -5.594 -10.285 1.00 0.00 H new ATOM 1040 N LEU A 70 2.446 -8.905 -6.404 1.00 0.00 N ATOM 1041 CA LEU A 70 2.822 -9.944 -5.459 1.00 0.00 C ATOM 1042 C LEU A 70 1.646 -10.905 -5.270 1.00 0.00 C ATOM 1043 O LEU A 70 1.811 -12.120 -5.371 1.00 0.00 O ATOM 1044 CB LEU A 70 3.325 -9.324 -4.154 1.00 0.00 C ATOM 1045 CG LEU A 70 4.727 -8.711 -4.200 1.00 0.00 C ATOM 1046 CD1 LEU A 70 5.013 -7.904 -2.932 1.00 0.00 C ATOM 1047 CD2 LEU A 70 5.787 -9.786 -4.447 1.00 0.00 C ATOM 0 H LEU A 70 2.521 -7.953 -6.045 1.00 0.00 H new ATOM 0 HA LEU A 70 3.654 -10.530 -5.848 1.00 0.00 H new ATOM 0 HB2 LEU A 70 2.621 -8.550 -3.848 1.00 0.00 H new ATOM 0 HB3 LEU A 70 3.311 -10.092 -3.381 1.00 0.00 H new ATOM 0 HG LEU A 70 4.770 -8.018 -5.040 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.015 -7.479 -2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 70 4.283 -7.100 -2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 70 4.945 -8.557 -2.062 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.774 -9.324 -4.475 1.00 0.00 H new ATOM 0 HD22 LEU A 70 5.753 -10.522 -3.643 1.00 0.00 H new ATOM 0 HD23 LEU A 70 5.590 -10.279 -5.399 1.00 0.00 H new ATOM 1059 N LEU A 71 0.486 -10.325 -4.999 1.00 0.00 N ATOM 1060 CA LEU A 71 -0.716 -11.115 -4.795 1.00 0.00 C ATOM 1061 C LEU A 71 -0.889 -12.084 -5.966 1.00 0.00 C ATOM 1062 O LEU A 71 -1.296 -13.229 -5.774 1.00 0.00 O ATOM 1063 CB LEU A 71 -1.924 -10.203 -4.568 1.00 0.00 C ATOM 1064 CG LEU A 71 -2.046 -9.587 -3.173 1.00 0.00 C ATOM 1065 CD1 LEU A 71 -3.280 -8.686 -3.078 1.00 0.00 C ATOM 1066 CD2 LEU A 71 -2.042 -10.670 -2.093 1.00 0.00 C ATOM 0 H LEU A 71 0.353 -9.317 -4.916 1.00 0.00 H new ATOM 0 HA LEU A 71 -0.627 -11.719 -3.892 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -1.886 -9.395 -5.298 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -2.829 -10.775 -4.772 1.00 0.00 H new ATOM 0 HG LEU A 71 -1.173 -8.957 -3.000 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -3.344 -8.261 -2.076 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -3.201 -7.882 -3.809 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -4.176 -9.273 -3.280 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -2.130 -10.205 -1.111 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -2.883 -11.345 -2.251 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -1.110 -11.233 -2.146 1.00 0.00 H new ATOM 1078 N LYS A 72 -0.570 -11.591 -7.154 1.00 0.00 N ATOM 1079 CA LYS A 72 -0.685 -12.399 -8.355 1.00 0.00 C ATOM 1080 C LYS A 72 0.237 -13.615 -8.237 1.00 0.00 C ATOM 1081 O LYS A 72 -0.168 -14.737 -8.535 1.00 0.00 O ATOM 1082 CB LYS A 72 -0.425 -11.549 -9.600 1.00 0.00 C ATOM 1083 CG LYS A 72 -1.730 -10.969 -10.151 1.00 0.00 C ATOM 1084 CD LYS A 72 -1.467 -9.696 -10.957 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.281 -10.016 -12.442 1.00 0.00 C ATOM 1086 NZ LYS A 72 -2.253 -9.257 -13.261 1.00 0.00 N ATOM 0 H LYS A 72 -0.232 -10.641 -7.310 1.00 0.00 H new ATOM 0 HA LYS A 72 -1.701 -12.778 -8.463 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.262 -10.739 -9.355 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.059 -12.157 -10.365 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -2.223 -11.708 -10.783 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -2.410 -10.749 -9.328 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -2.300 -9.004 -10.832 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.577 -9.197 -10.575 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.265 -9.768 -12.749 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.412 -11.085 -12.609 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.113 -9.485 -14.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.220 -9.514 -12.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -2.109 -8.237 -13.115 1.00 0.00 H new ATOM 1100 N GLU A 73 1.460 -13.349 -7.802 1.00 0.00 N ATOM 1101 CA GLU A 73 2.443 -14.407 -7.641 1.00 0.00 C ATOM 1102 C GLU A 73 1.945 -15.445 -6.634 1.00 0.00 C ATOM 1103 O GLU A 73 1.942 -16.641 -6.920 1.00 0.00 O ATOM 1104 CB GLU A 73 3.798 -13.837 -7.217 1.00 0.00 C ATOM 1105 CG GLU A 73 4.100 -12.533 -7.958 1.00 0.00 C ATOM 1106 CD GLU A 73 5.601 -12.235 -7.954 1.00 0.00 C ATOM 1107 OE1 GLU A 73 6.209 -12.400 -6.874 1.00 0.00 O ATOM 1108 OE2 GLU A 73 6.106 -11.849 -9.030 1.00 0.00 O ATOM 0 H GLU A 73 1.792 -12.417 -7.556 1.00 0.00 H new ATOM 0 HA GLU A 73 2.579 -14.900 -8.604 1.00 0.00 H new ATOM 0 HB2 GLU A 73 3.801 -13.658 -6.142 1.00 0.00 H new ATOM 0 HB3 GLU A 73 4.583 -14.565 -7.421 1.00 0.00 H new ATOM 0 HG2 GLU A 73 3.742 -12.603 -8.985 1.00 0.00 H new ATOM 0 HG3 GLU A 73 3.561 -11.710 -7.488 1.00 0.00 H new ATOM 1115 N LEU A 74 1.537 -14.950 -5.475 1.00 0.00 N ATOM 1116 CA LEU A 74 1.038 -15.820 -4.423 1.00 0.00 C ATOM 1117 C LEU A 74 0.142 -16.896 -5.040 1.00 0.00 C ATOM 1118 O LEU A 74 0.451 -18.084 -4.964 1.00 0.00 O ATOM 1119 CB LEU A 74 0.350 -14.999 -3.330 1.00 0.00 C ATOM 1120 CG LEU A 74 1.111 -14.870 -2.009 1.00 0.00 C ATOM 1121 CD1 LEU A 74 0.470 -13.813 -1.108 1.00 0.00 C ATOM 1122 CD2 LEU A 74 1.228 -16.226 -1.309 1.00 0.00 C ATOM 0 H LEU A 74 1.542 -13.957 -5.241 1.00 0.00 H new ATOM 0 HA LEU A 74 1.863 -16.335 -3.931 1.00 0.00 H new ATOM 0 HB2 LEU A 74 0.164 -13.998 -3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -0.622 -15.447 -3.124 1.00 0.00 H new ATOM 0 HG LEU A 74 2.124 -14.533 -2.230 1.00 0.00 H new ATOM 0 HD11 LEU A 74 1.030 -13.741 -0.176 1.00 0.00 H new ATOM 0 HD12 LEU A 74 0.482 -12.848 -1.614 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -0.560 -14.096 -0.891 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.773 -16.106 -0.373 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.231 -16.616 -1.101 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.763 -16.923 -1.954 1.00 0.00 H new ATOM 1134 N GLY A 75 -0.950 -16.441 -5.637 1.00 0.00 N ATOM 1135 CA GLY A 75 -1.893 -17.350 -6.266 1.00 0.00 C ATOM 1136 C GLY A 75 -1.226 -18.134 -7.398 1.00 0.00 C ATOM 1137 O GLY A 75 -1.627 -19.257 -7.701 1.00 0.00 O ATOM 0 H GLY A 75 -1.203 -15.455 -5.698 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.288 -18.042 -5.522 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -2.740 -16.787 -6.658 1.00 0.00 H new ATOM 1141 N SER A 76 -0.219 -17.511 -7.993 1.00 0.00 N ATOM 1142 CA SER A 76 0.507 -18.136 -9.085 1.00 0.00 C ATOM 1143 C SER A 76 1.229 -19.389 -8.585 1.00 0.00 C ATOM 1144 O SER A 76 1.230 -20.420 -9.256 1.00 0.00 O ATOM 1145 CB SER A 76 1.507 -17.162 -9.711 1.00 0.00 C ATOM 1146 OG SER A 76 1.548 -17.278 -11.131 1.00 0.00 O ATOM 0 H SER A 76 0.111 -16.580 -7.739 1.00 0.00 H new ATOM 0 HA SER A 76 -0.212 -18.421 -9.854 1.00 0.00 H new ATOM 0 HB2 SER A 76 1.238 -16.141 -9.438 1.00 0.00 H new ATOM 0 HB3 SER A 76 2.500 -17.350 -9.303 1.00 0.00 H new ATOM 0 HG SER A 76 2.197 -16.639 -11.493 1.00 0.00 H new ATOM 1152 N LEU A 77 1.826 -19.259 -7.409 1.00 0.00 N ATOM 1153 CA LEU A 77 2.550 -20.367 -6.811 1.00 0.00 C ATOM 1154 C LEU A 77 1.687 -21.629 -6.875 1.00 0.00 C ATOM 1155 O LEU A 77 0.460 -21.545 -6.897 1.00 0.00 O ATOM 1156 CB LEU A 77 3.008 -20.007 -5.396 1.00 0.00 C ATOM 1157 CG LEU A 77 3.847 -18.734 -5.267 1.00 0.00 C ATOM 1158 CD1 LEU A 77 4.109 -18.398 -3.797 1.00 0.00 C ATOM 1159 CD2 LEU A 77 5.145 -18.848 -6.069 1.00 0.00 C ATOM 0 H LEU A 77 1.823 -18.403 -6.855 1.00 0.00 H new ATOM 0 HA LEU A 77 3.461 -20.574 -7.373 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.125 -19.902 -4.765 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.586 -20.841 -4.999 1.00 0.00 H new ATOM 0 HG LEU A 77 3.279 -17.906 -5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 77 4.707 -17.489 -3.733 1.00 0.00 H new ATOM 0 HD12 LEU A 77 3.160 -18.245 -3.284 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.647 -19.221 -3.326 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.722 -17.930 -5.960 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.729 -19.690 -5.698 1.00 0.00 H new ATOM 0 HD23 LEU A 77 4.910 -19.006 -7.122 1.00 0.00 H new ATOM 1171 N PRO A 78 2.380 -22.799 -6.905 1.00 0.00 N ATOM 1172 CA PRO A 78 1.690 -24.076 -6.967 1.00 0.00 C ATOM 1173 C PRO A 78 1.077 -24.434 -5.612 1.00 0.00 C ATOM 1174 O PRO A 78 1.351 -23.776 -4.609 1.00 0.00 O ATOM 1175 CB PRO A 78 2.744 -25.071 -7.423 1.00 0.00 C ATOM 1176 CG PRO A 78 4.086 -24.410 -7.153 1.00 0.00 C ATOM 1177 CD PRO A 78 3.833 -22.936 -6.882 1.00 0.00 C ATOM 0 HA PRO A 78 0.846 -24.065 -7.657 1.00 0.00 H new ATOM 0 HB2 PRO A 78 2.655 -26.011 -6.878 1.00 0.00 H new ATOM 0 HB3 PRO A 78 2.629 -25.304 -8.482 1.00 0.00 H new ATOM 0 HG2 PRO A 78 4.576 -24.877 -6.299 1.00 0.00 H new ATOM 0 HG3 PRO A 78 4.751 -24.532 -8.008 1.00 0.00 H new ATOM 0 HD2 PRO A 78 4.244 -22.634 -5.919 1.00 0.00 H new ATOM 0 HD3 PRO A 78 4.302 -22.308 -7.639 1.00 0.00 H new ATOM 1185 N LEU A 79 0.259 -25.476 -5.625 1.00 0.00 N ATOM 1186 CA LEU A 79 -0.395 -25.929 -4.409 1.00 0.00 C ATOM 1187 C LEU A 79 0.281 -27.211 -3.919 1.00 0.00 C ATOM 1188 O LEU A 79 0.767 -28.007 -4.721 1.00 0.00 O ATOM 1189 CB LEU A 79 -1.902 -26.076 -4.634 1.00 0.00 C ATOM 1190 CG LEU A 79 -2.626 -24.833 -5.154 1.00 0.00 C ATOM 1191 CD1 LEU A 79 -3.784 -24.447 -4.232 1.00 0.00 C ATOM 1192 CD2 LEU A 79 -1.648 -23.674 -5.362 1.00 0.00 C ATOM 0 H LEU A 79 0.034 -26.020 -6.458 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.285 -25.187 -3.618 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -2.066 -26.890 -5.340 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -2.363 -26.373 -3.692 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.055 -25.071 -6.128 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -4.282 -23.560 -4.625 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -4.497 -25.270 -4.179 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -3.400 -24.235 -3.234 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -2.189 -22.803 -5.732 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.169 -23.428 -4.414 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -0.889 -23.965 -6.088 1.00 0.00 H new ATOM 1204 N PRO A 80 0.291 -27.376 -2.569 1.00 0.00 N ATOM 1205 CA PRO A 80 0.899 -28.547 -1.962 1.00 0.00 C ATOM 1206 C PRO A 80 0.011 -29.781 -2.140 1.00 0.00 C ATOM 1207 O PRO A 80 -1.153 -29.662 -2.518 1.00 0.00 O ATOM 1208 CB PRO A 80 1.108 -28.172 -0.504 1.00 0.00 C ATOM 1209 CG PRO A 80 0.191 -26.988 -0.243 1.00 0.00 C ATOM 1210 CD PRO A 80 -0.275 -26.454 -1.588 1.00 0.00 C ATOM 0 HA PRO A 80 1.846 -28.818 -2.429 1.00 0.00 H new ATOM 0 HB2 PRO A 80 0.864 -29.007 0.153 1.00 0.00 H new ATOM 0 HB3 PRO A 80 2.149 -27.910 -0.313 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -0.662 -27.292 0.363 1.00 0.00 H new ATOM 0 HG3 PRO A 80 0.717 -26.213 0.314 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -1.363 -26.430 -1.649 1.00 0.00 H new ATOM 0 HD3 PRO A 80 0.076 -25.435 -1.753 1.00 0.00 H new ATOM 1218 N LEU A 81 0.596 -30.936 -1.861 1.00 0.00 N ATOM 1219 CA LEU A 81 -0.127 -32.190 -1.986 1.00 0.00 C ATOM 1220 C LEU A 81 -1.169 -32.287 -0.869 1.00 0.00 C ATOM 1221 O LEU A 81 -2.231 -32.877 -1.056 1.00 0.00 O ATOM 1222 CB LEU A 81 0.847 -33.369 -2.022 1.00 0.00 C ATOM 1223 CG LEU A 81 1.562 -33.608 -3.353 1.00 0.00 C ATOM 1224 CD1 LEU A 81 0.905 -34.748 -4.132 1.00 0.00 C ATOM 1225 CD2 LEU A 81 1.635 -32.319 -4.175 1.00 0.00 C ATOM 0 H LEU A 81 1.562 -31.030 -1.549 1.00 0.00 H new ATOM 0 HA LEU A 81 -0.668 -32.225 -2.931 1.00 0.00 H new ATOM 0 HB2 LEU A 81 1.601 -33.215 -1.250 1.00 0.00 H new ATOM 0 HB3 LEU A 81 0.300 -34.274 -1.758 1.00 0.00 H new ATOM 0 HG LEU A 81 2.587 -33.913 -3.140 1.00 0.00 H new ATOM 0 HD11 LEU A 81 1.433 -34.897 -5.074 1.00 0.00 H new ATOM 0 HD12 LEU A 81 0.949 -35.664 -3.543 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -0.136 -34.497 -4.335 1.00 0.00 H new ATOM 0 HD21 LEU A 81 2.148 -32.516 -5.116 1.00 0.00 H new ATOM 0 HD22 LEU A 81 0.626 -31.960 -4.380 1.00 0.00 H new ATOM 0 HD23 LEU A 81 2.183 -31.561 -3.615 1.00 0.00 H new ATOM 1237 N SER A 82 -0.827 -31.698 0.268 1.00 0.00 N ATOM 1238 CA SER A 82 -1.719 -31.710 1.414 1.00 0.00 C ATOM 1239 C SER A 82 -2.729 -30.566 1.304 1.00 0.00 C ATOM 1240 O SER A 82 -2.406 -29.496 0.791 1.00 0.00 O ATOM 1241 CB SER A 82 -0.935 -31.602 2.724 1.00 0.00 C ATOM 1242 OG SER A 82 -1.053 -32.781 3.515 1.00 0.00 O ATOM 0 H SER A 82 0.056 -31.210 0.419 1.00 0.00 H new ATOM 0 HA SER A 82 -2.255 -32.659 1.420 1.00 0.00 H new ATOM 0 HB2 SER A 82 0.116 -31.417 2.503 1.00 0.00 H new ATOM 0 HB3 SER A 82 -1.296 -30.746 3.293 1.00 0.00 H new ATOM 0 HG SER A 82 -0.537 -32.673 4.341 1.00 0.00 H new ATOM 1248 N THR A 83 -3.931 -30.830 1.795 1.00 0.00 N ATOM 1249 CA THR A 83 -4.990 -29.836 1.758 1.00 0.00 C ATOM 1250 C THR A 83 -4.838 -28.852 2.920 1.00 0.00 C ATOM 1251 O THR A 83 -4.963 -27.642 2.734 1.00 0.00 O ATOM 1252 CB THR A 83 -6.330 -30.573 1.758 1.00 0.00 C ATOM 1253 OG1 THR A 83 -6.195 -31.540 0.720 1.00 0.00 O ATOM 1254 CG2 THR A 83 -7.486 -29.685 1.290 1.00 0.00 C ATOM 0 H THR A 83 -4.195 -31.718 2.221 1.00 0.00 H new ATOM 0 HA THR A 83 -4.935 -29.232 0.852 1.00 0.00 H new ATOM 0 HB THR A 83 -6.539 -30.945 2.761 1.00 0.00 H new ATOM 0 HG1 THR A 83 -7.020 -32.064 0.652 1.00 0.00 H new ATOM 0 HG21 THR A 83 -8.414 -30.256 1.309 1.00 0.00 H new ATOM 0 HG22 THR A 83 -7.576 -28.825 1.954 1.00 0.00 H new ATOM 0 HG23 THR A 83 -7.292 -29.341 0.274 1.00 0.00 H new ATOM 1262 N SER A 84 -4.569 -29.407 4.092 1.00 0.00 N ATOM 1263 CA SER A 84 -4.399 -28.593 5.284 1.00 0.00 C ATOM 1264 C SER A 84 -3.562 -27.355 4.957 1.00 0.00 C ATOM 1265 O SER A 84 -3.778 -26.287 5.528 1.00 0.00 O ATOM 1266 CB SER A 84 -3.742 -29.395 6.409 1.00 0.00 C ATOM 1267 OG SER A 84 -4.027 -28.847 7.693 1.00 0.00 O ATOM 0 H SER A 84 -4.464 -30.410 4.242 1.00 0.00 H new ATOM 0 HA SER A 84 -5.385 -28.278 5.626 1.00 0.00 H new ATOM 0 HB2 SER A 84 -4.091 -30.427 6.370 1.00 0.00 H new ATOM 0 HB3 SER A 84 -2.663 -29.417 6.256 1.00 0.00 H new ATOM 0 HG SER A 84 -3.591 -29.388 8.384 1.00 0.00 H new ATOM 1273 N GLU A 85 -2.626 -27.538 4.038 1.00 0.00 N ATOM 1274 CA GLU A 85 -1.756 -26.449 3.628 1.00 0.00 C ATOM 1275 C GLU A 85 -2.442 -25.596 2.558 1.00 0.00 C ATOM 1276 O GLU A 85 -2.343 -24.370 2.579 1.00 0.00 O ATOM 1277 CB GLU A 85 -0.412 -26.980 3.126 1.00 0.00 C ATOM 1278 CG GLU A 85 0.368 -27.652 4.258 1.00 0.00 C ATOM 1279 CD GLU A 85 0.415 -26.759 5.499 1.00 0.00 C ATOM 1280 OE1 GLU A 85 -0.559 -26.822 6.280 1.00 0.00 O ATOM 1281 OE2 GLU A 85 1.423 -26.033 5.638 1.00 0.00 O ATOM 0 H GLU A 85 -2.451 -28.425 3.565 1.00 0.00 H new ATOM 0 HA GLU A 85 -1.560 -25.820 4.496 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -0.577 -27.694 2.319 1.00 0.00 H new ATOM 0 HB3 GLU A 85 0.175 -26.161 2.711 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -0.098 -28.605 4.509 1.00 0.00 H new ATOM 0 HG3 GLU A 85 1.382 -27.871 3.925 1.00 0.00 H new ATOM 1288 N GLN A 86 -3.123 -26.278 1.649 1.00 0.00 N ATOM 1289 CA GLN A 86 -3.825 -25.599 0.574 1.00 0.00 C ATOM 1290 C GLN A 86 -4.659 -24.443 1.132 1.00 0.00 C ATOM 1291 O GLN A 86 -4.481 -23.294 0.730 1.00 0.00 O ATOM 1292 CB GLN A 86 -4.700 -26.576 -0.213 1.00 0.00 C ATOM 1293 CG GLN A 86 -3.850 -27.453 -1.135 1.00 0.00 C ATOM 1294 CD GLN A 86 -4.662 -28.634 -1.671 1.00 0.00 C ATOM 1295 OE1 GLN A 86 -5.716 -28.478 -2.264 1.00 0.00 O ATOM 1296 NE2 GLN A 86 -4.113 -29.821 -1.429 1.00 0.00 N ATOM 0 H GLN A 86 -3.203 -27.295 1.635 1.00 0.00 H new ATOM 0 HA GLN A 86 -3.086 -25.189 -0.114 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -5.261 -27.205 0.478 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -5.430 -26.022 -0.803 1.00 0.00 H new ATOM 0 HG2 GLN A 86 -3.476 -26.856 -1.967 1.00 0.00 H new ATOM 0 HG3 GLN A 86 -2.980 -27.822 -0.592 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -3.227 -29.880 -0.926 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -4.578 -30.672 -1.746 1.00 0.00 H new ATOM 1305 N ARG A 87 -5.551 -24.788 2.049 1.00 0.00 N ATOM 1306 CA ARG A 87 -6.412 -23.794 2.665 1.00 0.00 C ATOM 1307 C ARG A 87 -5.572 -22.690 3.310 1.00 0.00 C ATOM 1308 O ARG A 87 -5.745 -21.512 3.001 1.00 0.00 O ATOM 1309 CB ARG A 87 -7.312 -24.428 3.728 1.00 0.00 C ATOM 1310 CG ARG A 87 -8.789 -24.257 3.369 1.00 0.00 C ATOM 1311 CD ARG A 87 -9.632 -25.388 3.962 1.00 0.00 C ATOM 1312 NE ARG A 87 -11.056 -24.987 4.011 1.00 0.00 N ATOM 1313 CZ ARG A 87 -12.039 -25.762 4.487 1.00 0.00 C ATOM 1314 NH1 ARG A 87 -11.759 -26.985 4.959 1.00 0.00 N ATOM 1315 NH2 ARG A 87 -13.302 -25.315 4.491 1.00 0.00 N ATOM 0 H ARG A 87 -5.696 -25.742 2.380 1.00 0.00 H new ATOM 0 HA ARG A 87 -7.039 -23.367 1.882 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -7.078 -25.488 3.823 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -7.114 -23.970 4.697 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -9.148 -23.297 3.741 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -8.904 -24.243 2.285 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -9.520 -26.290 3.360 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -9.279 -25.628 4.965 1.00 0.00 H new ATOM 0 HE ARG A 87 -11.304 -24.062 3.660 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.797 -27.325 4.956 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -12.508 -27.575 5.322 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -13.515 -24.384 4.131 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -14.051 -25.905 4.854 1.00 0.00 H new ATOM 1329 N GLN A 88 -4.680 -23.110 4.195 1.00 0.00 N ATOM 1330 CA GLN A 88 -3.812 -22.172 4.886 1.00 0.00 C ATOM 1331 C GLN A 88 -3.174 -21.204 3.888 1.00 0.00 C ATOM 1332 O GLN A 88 -2.956 -20.035 4.203 1.00 0.00 O ATOM 1333 CB GLN A 88 -2.743 -22.908 5.696 1.00 0.00 C ATOM 1334 CG GLN A 88 -3.369 -23.672 6.864 1.00 0.00 C ATOM 1335 CD GLN A 88 -3.737 -22.722 8.007 1.00 0.00 C ATOM 1336 OE1 GLN A 88 -2.908 -22.326 8.810 1.00 0.00 O ATOM 1337 NE2 GLN A 88 -5.022 -22.381 8.034 1.00 0.00 N ATOM 0 H GLN A 88 -4.540 -24.088 4.449 1.00 0.00 H new ATOM 0 HA GLN A 88 -4.417 -21.595 5.585 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -2.205 -23.602 5.050 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -2.012 -22.193 6.074 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -4.260 -24.198 6.523 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -2.671 -24.428 7.225 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -5.662 -22.749 7.331 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -5.367 -21.751 8.758 1.00 0.00 H new ATOM 1346 N GLN A 89 -2.893 -21.727 2.703 1.00 0.00 N ATOM 1347 CA GLN A 89 -2.284 -20.924 1.657 1.00 0.00 C ATOM 1348 C GLN A 89 -3.265 -19.855 1.169 1.00 0.00 C ATOM 1349 O GLN A 89 -3.056 -18.665 1.399 1.00 0.00 O ATOM 1350 CB GLN A 89 -1.810 -21.802 0.497 1.00 0.00 C ATOM 1351 CG GLN A 89 -0.311 -22.092 0.606 1.00 0.00 C ATOM 1352 CD GLN A 89 0.276 -22.464 -0.757 1.00 0.00 C ATOM 1353 OE1 GLN A 89 -0.280 -22.171 -1.802 1.00 0.00 O ATOM 1354 NE2 GLN A 89 1.428 -23.126 -0.687 1.00 0.00 N ATOM 0 H GLN A 89 -3.076 -22.697 2.445 1.00 0.00 H new ATOM 0 HA GLN A 89 -1.409 -20.425 2.073 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -2.366 -22.739 0.495 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -2.020 -21.305 -0.450 1.00 0.00 H new ATOM 0 HG2 GLN A 89 0.205 -21.217 1.001 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -0.145 -22.906 1.312 1.00 0.00 H new ATOM 0 HE21 GLN A 89 1.839 -23.339 0.222 1.00 0.00 H new ATOM 0 HE22 GLN A 89 1.900 -23.420 -1.542 1.00 0.00 H new ATOM 1363 N ARG A 90 -4.313 -20.319 0.505 1.00 0.00 N ATOM 1364 CA ARG A 90 -5.326 -19.418 -0.017 1.00 0.00 C ATOM 1365 C ARG A 90 -5.835 -18.492 1.090 1.00 0.00 C ATOM 1366 O ARG A 90 -6.095 -17.314 0.850 1.00 0.00 O ATOM 1367 CB ARG A 90 -6.506 -20.196 -0.603 1.00 0.00 C ATOM 1368 CG ARG A 90 -7.091 -21.164 0.427 1.00 0.00 C ATOM 1369 CD ARG A 90 -8.171 -22.047 -0.201 1.00 0.00 C ATOM 1370 NE ARG A 90 -9.512 -21.491 0.089 1.00 0.00 N ATOM 1371 CZ ARG A 90 -10.651 -22.189 -0.008 1.00 0.00 C ATOM 1372 NH1 ARG A 90 -10.620 -23.473 -0.389 1.00 0.00 N ATOM 1373 NH2 ARG A 90 -11.822 -21.602 0.275 1.00 0.00 N ATOM 0 H ARG A 90 -4.483 -21.307 0.316 1.00 0.00 H new ATOM 0 HA ARG A 90 -4.866 -18.826 -0.808 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -7.277 -19.500 -0.932 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -6.180 -20.750 -1.483 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -6.297 -21.789 0.835 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -7.514 -20.602 1.260 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -8.020 -22.110 -1.279 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.096 -23.061 0.191 1.00 0.00 H new ATOM 0 HE ARG A 90 -9.572 -20.516 0.381 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -9.729 -23.919 -0.605 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -11.488 -24.004 -0.463 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.846 -20.624 0.564 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.690 -22.133 0.201 1.00 0.00 H new ATOM 1387 N LEU A 91 -5.962 -19.060 2.281 1.00 0.00 N ATOM 1388 CA LEU A 91 -6.434 -18.301 3.426 1.00 0.00 C ATOM 1389 C LEU A 91 -5.486 -17.128 3.681 1.00 0.00 C ATOM 1390 O LEU A 91 -5.927 -15.989 3.826 1.00 0.00 O ATOM 1391 CB LEU A 91 -6.618 -19.217 4.637 1.00 0.00 C ATOM 1392 CG LEU A 91 -7.834 -20.146 4.597 1.00 0.00 C ATOM 1393 CD1 LEU A 91 -7.927 -20.982 5.875 1.00 0.00 C ATOM 1394 CD2 LEU A 91 -9.118 -19.357 4.333 1.00 0.00 C ATOM 0 H LEU A 91 -5.746 -20.037 2.477 1.00 0.00 H new ATOM 0 HA LEU A 91 -7.418 -17.878 3.223 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -5.722 -19.828 4.745 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -6.689 -18.596 5.530 1.00 0.00 H new ATOM 0 HG LEU A 91 -7.707 -20.841 3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 91 -8.799 -21.633 5.821 1.00 0.00 H new ATOM 0 HD12 LEU A 91 -7.027 -21.588 5.979 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -8.021 -20.321 6.736 1.00 0.00 H new ATOM 0 HD21 LEU A 91 -9.967 -20.041 4.309 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -9.264 -18.624 5.126 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -9.039 -18.844 3.375 1.00 0.00 H new ATOM 1406 N GLN A 92 -4.201 -17.446 3.728 1.00 0.00 N ATOM 1407 CA GLN A 92 -3.186 -16.433 3.963 1.00 0.00 C ATOM 1408 C GLN A 92 -3.322 -15.300 2.943 1.00 0.00 C ATOM 1409 O GLN A 92 -3.185 -14.128 3.291 1.00 0.00 O ATOM 1410 CB GLN A 92 -1.783 -17.042 3.922 1.00 0.00 C ATOM 1411 CG GLN A 92 -1.536 -17.932 5.142 1.00 0.00 C ATOM 1412 CD GLN A 92 -0.577 -17.260 6.126 1.00 0.00 C ATOM 1413 OE1 GLN A 92 0.401 -17.837 6.573 1.00 0.00 O ATOM 1414 NE2 GLN A 92 -0.910 -16.010 6.438 1.00 0.00 N ATOM 0 H GLN A 92 -3.839 -18.392 3.607 1.00 0.00 H new ATOM 0 HA GLN A 92 -3.337 -16.019 4.960 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -1.663 -17.627 3.010 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -1.038 -16.247 3.891 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -2.483 -18.145 5.639 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -1.123 -18.888 4.821 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -1.742 -15.586 6.028 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -0.333 -15.475 7.087 1.00 0.00 H new ATOM 1423 N LYS A 93 -3.589 -15.689 1.705 1.00 0.00 N ATOM 1424 CA LYS A 93 -3.744 -14.721 0.634 1.00 0.00 C ATOM 1425 C LYS A 93 -5.044 -13.941 0.842 1.00 0.00 C ATOM 1426 O LYS A 93 -5.040 -12.710 0.843 1.00 0.00 O ATOM 1427 CB LYS A 93 -3.652 -15.410 -0.729 1.00 0.00 C ATOM 1428 CG LYS A 93 -2.702 -14.657 -1.662 1.00 0.00 C ATOM 1429 CD LYS A 93 -3.019 -14.960 -3.128 1.00 0.00 C ATOM 1430 CE LYS A 93 -4.410 -14.447 -3.507 1.00 0.00 C ATOM 1431 NZ LYS A 93 -5.257 -15.559 -3.992 1.00 0.00 N ATOM 0 H LYS A 93 -3.702 -16.662 1.420 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.930 -13.997 0.655 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.304 -16.435 -0.600 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -4.643 -15.465 -1.180 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -2.784 -13.585 -1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.672 -14.939 -1.443 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.269 -14.496 -3.769 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.965 -16.035 -3.301 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -4.878 -13.975 -2.643 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -4.324 -13.683 -4.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -6.197 -15.194 -4.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -4.817 -15.991 -4.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -5.353 -16.274 -3.243 1.00 0.00 H new ATOM 1445 N GLU A 94 -6.124 -14.688 1.013 1.00 0.00 N ATOM 1446 CA GLU A 94 -7.428 -14.082 1.221 1.00 0.00 C ATOM 1447 C GLU A 94 -7.319 -12.910 2.200 1.00 0.00 C ATOM 1448 O GLU A 94 -7.882 -11.843 1.961 1.00 0.00 O ATOM 1449 CB GLU A 94 -8.441 -15.116 1.716 1.00 0.00 C ATOM 1450 CG GLU A 94 -8.877 -16.044 0.579 1.00 0.00 C ATOM 1451 CD GLU A 94 -9.886 -15.350 -0.338 1.00 0.00 C ATOM 1452 OE1 GLU A 94 -10.709 -14.581 0.203 1.00 0.00 O ATOM 1453 OE2 GLU A 94 -9.811 -15.605 -1.559 1.00 0.00 O ATOM 0 H GLU A 94 -6.123 -15.708 1.012 1.00 0.00 H new ATOM 0 HA GLU A 94 -7.786 -13.700 0.265 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.002 -15.704 2.522 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.312 -14.608 2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.006 -16.351 0.001 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -9.320 -16.950 0.993 1.00 0.00 H new ATOM 1460 N ARG A 95 -6.589 -13.149 3.279 1.00 0.00 N ATOM 1461 CA ARG A 95 -6.399 -12.127 4.295 1.00 0.00 C ATOM 1462 C ARG A 95 -5.520 -10.998 3.753 1.00 0.00 C ATOM 1463 O ARG A 95 -5.765 -9.826 4.035 1.00 0.00 O ATOM 1464 CB ARG A 95 -5.748 -12.713 5.550 1.00 0.00 C ATOM 1465 CG ARG A 95 -6.752 -12.792 6.702 1.00 0.00 C ATOM 1466 CD ARG A 95 -6.856 -11.451 7.432 1.00 0.00 C ATOM 1467 NE ARG A 95 -7.212 -11.673 8.851 1.00 0.00 N ATOM 1468 CZ ARG A 95 -8.462 -11.870 9.290 1.00 0.00 C ATOM 1469 NH1 ARG A 95 -9.484 -11.872 8.424 1.00 0.00 N ATOM 1470 NH2 ARG A 95 -8.690 -12.064 10.596 1.00 0.00 N ATOM 0 H ARG A 95 -6.122 -14.035 3.472 1.00 0.00 H new ATOM 0 HA ARG A 95 -7.381 -11.734 4.558 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -5.360 -13.708 5.332 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -4.898 -12.097 5.845 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -7.731 -13.077 6.317 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -6.446 -13.569 7.403 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -5.908 -10.917 7.366 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -7.609 -10.825 6.953 1.00 0.00 H new ATOM 0 HE ARG A 95 -6.458 -11.676 9.538 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -9.310 -11.723 7.430 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -10.436 -12.022 8.759 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -7.912 -12.062 11.255 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -9.642 -12.214 10.931 1.00 0.00 H new ATOM 1484 N LEU A 96 -4.515 -11.390 2.984 1.00 0.00 N ATOM 1485 CA LEU A 96 -3.599 -10.426 2.400 1.00 0.00 C ATOM 1486 C LEU A 96 -4.390 -9.421 1.561 1.00 0.00 C ATOM 1487 O LEU A 96 -4.096 -8.226 1.576 1.00 0.00 O ATOM 1488 CB LEU A 96 -2.492 -11.141 1.622 1.00 0.00 C ATOM 1489 CG LEU A 96 -1.385 -11.779 2.463 1.00 0.00 C ATOM 1490 CD1 LEU A 96 -0.573 -12.777 1.635 1.00 0.00 C ATOM 1491 CD2 LEU A 96 -0.498 -10.709 3.104 1.00 0.00 C ATOM 0 H LEU A 96 -4.315 -12.363 2.752 1.00 0.00 H new ATOM 0 HA LEU A 96 -3.092 -9.860 3.182 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -2.949 -11.918 1.010 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -2.035 -10.425 0.939 1.00 0.00 H new ATOM 0 HG LEU A 96 -1.851 -12.339 3.274 1.00 0.00 H new ATOM 0 HD11 LEU A 96 0.207 -13.216 2.257 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -1.230 -13.565 1.268 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -0.116 -12.262 0.790 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.281 -11.189 3.696 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -0.038 -10.102 2.324 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -1.104 -10.073 3.749 1.00 0.00 H new ATOM 1503 N MET A 97 -5.378 -9.941 0.848 1.00 0.00 N ATOM 1504 CA MET A 97 -6.214 -9.104 0.004 1.00 0.00 C ATOM 1505 C MET A 97 -7.030 -8.120 0.844 1.00 0.00 C ATOM 1506 O MET A 97 -6.978 -6.912 0.617 1.00 0.00 O ATOM 1507 CB MET A 97 -7.160 -9.986 -0.813 1.00 0.00 C ATOM 1508 CG MET A 97 -6.378 -10.976 -1.679 1.00 0.00 C ATOM 1509 SD MET A 97 -6.804 -10.752 -3.398 1.00 0.00 S ATOM 1510 CE MET A 97 -6.397 -9.025 -3.596 1.00 0.00 C ATOM 0 H MET A 97 -5.619 -10.932 0.837 1.00 0.00 H new ATOM 0 HA MET A 97 -5.568 -8.534 -0.664 1.00 0.00 H new ATOM 0 HB2 MET A 97 -7.825 -10.531 -0.142 1.00 0.00 H new ATOM 0 HB3 MET A 97 -7.789 -9.361 -1.447 1.00 0.00 H new ATOM 0 HG2 MET A 97 -5.307 -10.828 -1.539 1.00 0.00 H new ATOM 0 HG3 MET A 97 -6.601 -11.997 -1.370 1.00 0.00 H new ATOM 0 HE1 MET A 97 -7.314 -8.445 -3.701 1.00 0.00 H new ATOM 0 HE2 MET A 97 -5.846 -8.678 -2.722 1.00 0.00 H new ATOM 0 HE3 MET A 97 -5.782 -8.896 -4.487 1.00 0.00 H new ATOM 1520 N ASN A 98 -7.766 -8.674 1.797 1.00 0.00 N ATOM 1521 CA ASN A 98 -8.592 -7.860 2.672 1.00 0.00 C ATOM 1522 C ASN A 98 -7.711 -6.837 3.393 1.00 0.00 C ATOM 1523 O ASN A 98 -7.964 -5.636 3.324 1.00 0.00 O ATOM 1524 CB ASN A 98 -9.283 -8.719 3.733 1.00 0.00 C ATOM 1525 CG ASN A 98 -10.805 -8.660 3.579 1.00 0.00 C ATOM 1526 OD1 ASN A 98 -11.523 -8.177 4.438 1.00 0.00 O ATOM 1527 ND2 ASN A 98 -11.253 -9.178 2.439 1.00 0.00 N ATOM 0 H ASN A 98 -7.807 -9.676 1.982 1.00 0.00 H new ATOM 0 HA ASN A 98 -9.346 -7.366 2.060 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -8.945 -9.752 3.647 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -9.001 -8.373 4.727 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -12.254 -9.187 2.241 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -10.596 -9.566 1.762 1.00 0.00 H new ATOM 1534 N ASP A 99 -6.694 -7.352 4.068 1.00 0.00 N ATOM 1535 CA ASP A 99 -5.774 -6.499 4.801 1.00 0.00 C ATOM 1536 C ASP A 99 -5.274 -5.385 3.879 1.00 0.00 C ATOM 1537 O ASP A 99 -5.299 -4.212 4.247 1.00 0.00 O ATOM 1538 CB ASP A 99 -4.558 -7.290 5.289 1.00 0.00 C ATOM 1539 CG ASP A 99 -4.833 -8.247 6.451 1.00 0.00 C ATOM 1540 OD1 ASP A 99 -5.194 -7.736 7.533 1.00 0.00 O ATOM 1541 OD2 ASP A 99 -4.676 -9.467 6.230 1.00 0.00 O ATOM 0 H ASP A 99 -6.487 -8.349 4.123 1.00 0.00 H new ATOM 0 HA ASP A 99 -6.306 -6.090 5.660 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -4.157 -7.863 4.453 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -3.784 -6.586 5.593 1.00 0.00 H new ATOM 1546 N PHE A 100 -4.831 -5.792 2.699 1.00 0.00 N ATOM 1547 CA PHE A 100 -4.326 -4.843 1.721 1.00 0.00 C ATOM 1548 C PHE A 100 -5.407 -3.834 1.327 1.00 0.00 C ATOM 1549 O PHE A 100 -5.141 -2.636 1.241 1.00 0.00 O ATOM 1550 CB PHE A 100 -3.920 -5.647 0.485 1.00 0.00 C ATOM 1551 CG PHE A 100 -3.723 -4.798 -0.773 1.00 0.00 C ATOM 1552 CD1 PHE A 100 -2.726 -3.874 -0.820 1.00 0.00 C ATOM 1553 CD2 PHE A 100 -4.544 -4.968 -1.843 1.00 0.00 C ATOM 1554 CE1 PHE A 100 -2.543 -3.086 -1.987 1.00 0.00 C ATOM 1555 CE2 PHE A 100 -4.361 -4.180 -3.011 1.00 0.00 C ATOM 1556 CZ PHE A 100 -3.364 -3.256 -3.058 1.00 0.00 C ATOM 0 H PHE A 100 -4.811 -6.766 2.398 1.00 0.00 H new ATOM 0 HA PHE A 100 -3.486 -4.289 2.140 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.994 -6.181 0.699 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -4.683 -6.400 0.287 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -2.074 -3.740 0.030 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -5.335 -5.702 -1.805 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -1.752 -2.352 -2.024 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -5.013 -4.315 -3.861 1.00 0.00 H new ATOM 0 HZ PHE A 100 -3.224 -2.657 -3.946 1.00 0.00 H new ATOM 1566 N SER A 101 -6.603 -4.356 1.098 1.00 0.00 N ATOM 1567 CA SER A 101 -7.725 -3.516 0.715 1.00 0.00 C ATOM 1568 C SER A 101 -7.961 -2.442 1.777 1.00 0.00 C ATOM 1569 O SER A 101 -7.935 -1.249 1.476 1.00 0.00 O ATOM 1570 CB SER A 101 -8.992 -4.349 0.511 1.00 0.00 C ATOM 1571 OG SER A 101 -10.126 -3.758 1.140 1.00 0.00 O ATOM 0 H SER A 101 -6.820 -5.350 1.170 1.00 0.00 H new ATOM 0 HA SER A 101 -7.484 -3.034 -0.232 1.00 0.00 H new ATOM 0 HB2 SER A 101 -9.186 -4.459 -0.556 1.00 0.00 H new ATOM 0 HB3 SER A 101 -8.836 -5.351 0.912 1.00 0.00 H new ATOM 0 HG SER A 101 -10.915 -4.319 0.986 1.00 0.00 H new ATOM 1577 N ALA A 102 -8.185 -2.902 2.999 1.00 0.00 N ATOM 1578 CA ALA A 102 -8.426 -1.995 4.109 1.00 0.00 C ATOM 1579 C ALA A 102 -7.354 -0.903 4.110 1.00 0.00 C ATOM 1580 O ALA A 102 -7.645 0.257 4.399 1.00 0.00 O ATOM 1581 CB ALA A 102 -8.455 -2.786 5.418 1.00 0.00 C ATOM 0 H ALA A 102 -8.205 -3.892 3.245 1.00 0.00 H new ATOM 0 HA ALA A 102 -9.395 -1.506 4.003 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -8.636 -2.106 6.250 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -9.252 -3.529 5.377 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -7.498 -3.288 5.561 1.00 0.00 H new ATOM 1587 N ALA A 103 -6.137 -1.313 3.785 1.00 0.00 N ATOM 1588 CA ALA A 103 -5.020 -0.384 3.745 1.00 0.00 C ATOM 1589 C ALA A 103 -5.122 0.475 2.483 1.00 0.00 C ATOM 1590 O ALA A 103 -4.681 1.624 2.473 1.00 0.00 O ATOM 1591 CB ALA A 103 -3.705 -1.162 3.817 1.00 0.00 C ATOM 0 H ALA A 103 -5.900 -2.276 3.547 1.00 0.00 H new ATOM 0 HA ALA A 103 -5.048 0.287 4.604 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -2.868 -0.465 3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.670 -1.732 4.746 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -3.639 -1.845 2.970 1.00 0.00 H new ATOM 1597 N LEU A 104 -5.704 -0.114 1.450 1.00 0.00 N ATOM 1598 CA LEU A 104 -5.869 0.582 0.185 1.00 0.00 C ATOM 1599 C LEU A 104 -6.905 1.696 0.353 1.00 0.00 C ATOM 1600 O LEU A 104 -6.590 2.872 0.180 1.00 0.00 O ATOM 1601 CB LEU A 104 -6.205 -0.407 -0.932 1.00 0.00 C ATOM 1602 CG LEU A 104 -6.860 0.188 -2.180 1.00 0.00 C ATOM 1603 CD1 LEU A 104 -5.844 0.971 -3.013 1.00 0.00 C ATOM 1604 CD2 LEU A 104 -7.560 -0.897 -3.002 1.00 0.00 C ATOM 0 H LEU A 104 -6.068 -1.067 1.463 1.00 0.00 H new ATOM 0 HA LEU A 104 -4.934 1.057 -0.113 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.286 -0.910 -1.233 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.869 -1.171 -0.527 1.00 0.00 H new ATOM 0 HG LEU A 104 -7.626 0.894 -1.859 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.336 1.383 -3.894 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -5.432 1.783 -2.414 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -5.039 0.305 -3.325 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -8.017 -0.447 -3.883 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -6.831 -1.645 -3.313 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.331 -1.372 -2.396 1.00 0.00 H new ATOM 1616 N ASN A 105 -8.120 1.285 0.687 1.00 0.00 N ATOM 1617 CA ASN A 105 -9.204 2.233 0.879 1.00 0.00 C ATOM 1618 C ASN A 105 -8.691 3.432 1.679 1.00 0.00 C ATOM 1619 O ASN A 105 -9.018 4.576 1.368 1.00 0.00 O ATOM 1620 CB ASN A 105 -10.356 1.601 1.663 1.00 0.00 C ATOM 1621 CG ASN A 105 -11.636 2.425 1.516 1.00 0.00 C ATOM 1622 OD1 ASN A 105 -11.620 3.645 1.484 1.00 0.00 O ATOM 1623 ND2 ASN A 105 -12.744 1.694 1.430 1.00 0.00 N ATOM 0 H ASN A 105 -8.377 0.308 0.829 1.00 0.00 H new ATOM 0 HA ASN A 105 -9.562 2.540 -0.104 1.00 0.00 H new ATOM 0 HB2 ASN A 105 -10.530 0.586 1.306 1.00 0.00 H new ATOM 0 HB3 ASN A 105 -10.086 1.527 2.716 1.00 0.00 H new ATOM 0 HD21 ASN A 105 -13.650 2.151 1.331 1.00 0.00 H new ATOM 0 HD22 ASN A 105 -12.687 0.676 1.463 1.00 0.00 H new ATOM 1630 N ASN A 106 -7.895 3.129 2.694 1.00 0.00 N ATOM 1631 CA ASN A 106 -7.333 4.168 3.541 1.00 0.00 C ATOM 1632 C ASN A 106 -6.625 5.205 2.666 1.00 0.00 C ATOM 1633 O ASN A 106 -6.967 6.386 2.698 1.00 0.00 O ATOM 1634 CB ASN A 106 -6.305 3.589 4.514 1.00 0.00 C ATOM 1635 CG ASN A 106 -6.768 3.754 5.963 1.00 0.00 C ATOM 1636 OD1 ASN A 106 -6.835 4.848 6.500 1.00 0.00 O ATOM 1637 ND2 ASN A 106 -7.083 2.610 6.564 1.00 0.00 N ATOM 0 H ASN A 106 -7.626 2.179 2.949 1.00 0.00 H new ATOM 0 HA ASN A 106 -8.148 4.621 4.106 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -6.148 2.532 4.297 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -5.346 4.089 4.376 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -7.403 2.614 7.532 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -7.004 1.729 6.056 1.00 0.00 H new ATOM 1644 N PHE A 107 -5.651 4.726 1.907 1.00 0.00 N ATOM 1645 CA PHE A 107 -4.892 5.596 1.025 1.00 0.00 C ATOM 1646 C PHE A 107 -5.822 6.412 0.125 1.00 0.00 C ATOM 1647 O PHE A 107 -5.617 7.610 -0.062 1.00 0.00 O ATOM 1648 CB PHE A 107 -4.017 4.695 0.152 1.00 0.00 C ATOM 1649 CG PHE A 107 -2.916 5.441 -0.605 1.00 0.00 C ATOM 1650 CD1 PHE A 107 -2.232 6.446 0.006 1.00 0.00 C ATOM 1651 CD2 PHE A 107 -2.620 5.099 -1.887 1.00 0.00 C ATOM 1652 CE1 PHE A 107 -1.211 7.139 -0.696 1.00 0.00 C ATOM 1653 CE2 PHE A 107 -1.598 5.791 -2.589 1.00 0.00 C ATOM 1654 CZ PHE A 107 -0.915 6.797 -1.979 1.00 0.00 C ATOM 0 H PHE A 107 -5.370 3.746 1.884 1.00 0.00 H new ATOM 0 HA PHE A 107 -4.297 6.294 1.614 1.00 0.00 H new ATOM 0 HB2 PHE A 107 -3.558 3.932 0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 107 -4.651 4.177 -0.567 1.00 0.00 H new ATOM 0 HD1 PHE A 107 -2.466 6.717 1.025 1.00 0.00 H new ATOM 0 HD2 PHE A 107 -3.162 4.301 -2.372 1.00 0.00 H new ATOM 0 HE1 PHE A 107 -0.669 7.938 -0.211 1.00 0.00 H new ATOM 0 HE2 PHE A 107 -1.363 5.519 -3.607 1.00 0.00 H new ATOM 0 HZ PHE A 107 -0.138 7.324 -2.513 1.00 0.00 H new ATOM 1664 N GLN A 108 -6.825 5.729 -0.408 1.00 0.00 N ATOM 1665 CA GLN A 108 -7.787 6.376 -1.284 1.00 0.00 C ATOM 1666 C GLN A 108 -8.463 7.542 -0.561 1.00 0.00 C ATOM 1667 O GLN A 108 -8.295 8.698 -0.947 1.00 0.00 O ATOM 1668 CB GLN A 108 -8.824 5.373 -1.795 1.00 0.00 C ATOM 1669 CG GLN A 108 -8.310 4.636 -3.033 1.00 0.00 C ATOM 1670 CD GLN A 108 -9.472 4.129 -3.891 1.00 0.00 C ATOM 1671 OE1 GLN A 108 -10.504 4.766 -4.022 1.00 0.00 O ATOM 1672 NE2 GLN A 108 -9.246 2.951 -4.465 1.00 0.00 N ATOM 0 H GLN A 108 -6.992 4.735 -0.250 1.00 0.00 H new ATOM 0 HA GLN A 108 -7.254 6.770 -2.149 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -9.057 4.654 -1.010 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -9.751 5.894 -2.036 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -7.682 5.303 -3.623 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -7.685 3.797 -2.728 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -8.359 2.471 -4.313 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -9.960 2.527 -5.057 1.00 0.00 H new ATOM 1681 N ALA A 109 -9.215 7.199 0.475 1.00 0.00 N ATOM 1682 CA ALA A 109 -9.917 8.204 1.256 1.00 0.00 C ATOM 1683 C ALA A 109 -8.956 9.346 1.591 1.00 0.00 C ATOM 1684 O ALA A 109 -9.386 10.476 1.822 1.00 0.00 O ATOM 1685 CB ALA A 109 -10.510 7.555 2.508 1.00 0.00 C ATOM 0 H ALA A 109 -9.353 6.239 0.792 1.00 0.00 H new ATOM 0 HA ALA A 109 -10.744 8.626 0.685 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -11.036 8.308 3.094 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -11.208 6.770 2.215 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -9.709 7.123 3.108 1.00 0.00 H new ATOM 1691 N VAL A 110 -7.674 9.013 1.606 1.00 0.00 N ATOM 1692 CA VAL A 110 -6.649 9.998 1.909 1.00 0.00 C ATOM 1693 C VAL A 110 -6.304 10.776 0.638 1.00 0.00 C ATOM 1694 O VAL A 110 -6.112 11.991 0.682 1.00 0.00 O ATOM 1695 CB VAL A 110 -5.434 9.312 2.538 1.00 0.00 C ATOM 1696 CG1 VAL A 110 -4.213 10.233 2.518 1.00 0.00 C ATOM 1697 CG2 VAL A 110 -5.745 8.844 3.961 1.00 0.00 C ATOM 0 H VAL A 110 -7.321 8.075 1.413 1.00 0.00 H new ATOM 0 HA VAL A 110 -7.015 10.717 2.641 1.00 0.00 H new ATOM 0 HB VAL A 110 -5.199 8.432 1.940 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -3.364 9.721 2.971 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -3.972 10.495 1.488 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -4.432 11.140 3.081 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -4.865 8.360 4.385 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.018 9.702 4.575 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -6.573 8.136 3.938 1.00 0.00 H new ATOM 1707 N GLN A 111 -6.236 10.046 -0.465 1.00 0.00 N ATOM 1708 CA GLN A 111 -5.917 10.653 -1.746 1.00 0.00 C ATOM 1709 C GLN A 111 -6.918 11.763 -2.071 1.00 0.00 C ATOM 1710 O GLN A 111 -6.549 12.792 -2.634 1.00 0.00 O ATOM 1711 CB GLN A 111 -5.884 9.602 -2.858 1.00 0.00 C ATOM 1712 CG GLN A 111 -7.192 9.602 -3.651 1.00 0.00 C ATOM 1713 CD GLN A 111 -7.213 8.465 -4.675 1.00 0.00 C ATOM 1714 OE1 GLN A 111 -7.827 7.429 -4.479 1.00 0.00 O ATOM 1715 NE2 GLN A 111 -6.508 8.715 -5.775 1.00 0.00 N ATOM 0 H GLN A 111 -6.396 9.039 -0.498 1.00 0.00 H new ATOM 0 HA GLN A 111 -4.923 11.095 -1.679 1.00 0.00 H new ATOM 0 HB2 GLN A 111 -5.048 9.803 -3.528 1.00 0.00 H new ATOM 0 HB3 GLN A 111 -5.716 8.615 -2.426 1.00 0.00 H new ATOM 0 HG2 GLN A 111 -8.035 9.497 -2.968 1.00 0.00 H new ATOM 0 HG3 GLN A 111 -7.312 10.558 -4.161 1.00 0.00 H new ATOM 0 HE21 GLN A 111 -6.017 9.604 -5.875 1.00 0.00 H new ATOM 0 HE22 GLN A 111 -6.458 8.018 -6.518 1.00 0.00 H new ATOM 1724 N ARG A 112 -8.167 11.517 -1.702 1.00 0.00 N ATOM 1725 CA ARG A 112 -9.224 12.483 -1.947 1.00 0.00 C ATOM 1726 C ARG A 112 -9.000 13.740 -1.103 1.00 0.00 C ATOM 1727 O ARG A 112 -8.787 14.824 -1.643 1.00 0.00 O ATOM 1728 CB ARG A 112 -10.597 11.893 -1.616 1.00 0.00 C ATOM 1729 CG ARG A 112 -11.716 12.868 -1.988 1.00 0.00 C ATOM 1730 CD ARG A 112 -12.202 13.639 -0.758 1.00 0.00 C ATOM 1731 NE ARG A 112 -12.644 14.995 -1.153 1.00 0.00 N ATOM 1732 CZ ARG A 112 -13.864 15.279 -1.629 1.00 0.00 C ATOM 1733 NH1 ARG A 112 -14.771 14.303 -1.771 1.00 0.00 N ATOM 1734 NH2 ARG A 112 -14.177 16.538 -1.961 1.00 0.00 N ATOM 0 H ARG A 112 -8.470 10.662 -1.235 1.00 0.00 H new ATOM 0 HA ARG A 112 -9.198 12.742 -3.005 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -10.733 10.955 -2.154 1.00 0.00 H new ATOM 0 HB3 ARG A 112 -10.650 11.661 -0.552 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -11.357 13.568 -2.742 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -12.548 12.321 -2.431 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -13.024 13.103 -0.284 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -11.401 13.709 -0.022 1.00 0.00 H new ATOM 0 HE ARG A 112 -11.978 15.762 -1.057 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -14.533 13.344 -1.517 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -15.700 14.519 -2.133 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -13.487 17.281 -1.852 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -15.106 16.754 -2.323 1.00 0.00 H new ATOM 1748 N ARG A 113 -9.057 13.552 0.207 1.00 0.00 N ATOM 1749 CA ARG A 113 -8.864 14.657 1.131 1.00 0.00 C ATOM 1750 C ARG A 113 -7.673 15.512 0.693 1.00 0.00 C ATOM 1751 O ARG A 113 -7.733 16.740 0.744 1.00 0.00 O ATOM 1752 CB ARG A 113 -8.623 14.150 2.554 1.00 0.00 C ATOM 1753 CG ARG A 113 -9.875 14.323 3.416 1.00 0.00 C ATOM 1754 CD ARG A 113 -9.625 15.315 4.553 1.00 0.00 C ATOM 1755 NE ARG A 113 -10.091 16.664 4.159 1.00 0.00 N ATOM 1756 CZ ARG A 113 -10.113 17.721 4.982 1.00 0.00 C ATOM 1757 NH1 ARG A 113 -9.696 17.593 6.249 1.00 0.00 N ATOM 1758 NH2 ARG A 113 -10.551 18.907 4.538 1.00 0.00 N ATOM 0 H ARG A 113 -9.234 12.651 0.651 1.00 0.00 H new ATOM 0 HA ARG A 113 -9.772 15.260 1.122 1.00 0.00 H new ATOM 0 HB2 ARG A 113 -8.339 13.098 2.526 1.00 0.00 H new ATOM 0 HB3 ARG A 113 -7.791 14.693 3.002 1.00 0.00 H new ATOM 0 HG2 ARG A 113 -10.701 14.674 2.797 1.00 0.00 H new ATOM 0 HG3 ARG A 113 -10.173 13.359 3.829 1.00 0.00 H new ATOM 0 HD2 ARG A 113 -10.147 14.989 5.453 1.00 0.00 H new ATOM 0 HD3 ARG A 113 -8.562 15.344 4.794 1.00 0.00 H new ATOM 0 HE ARG A 113 -10.416 16.797 3.201 1.00 0.00 H new ATOM 0 HH11 ARG A 113 -9.362 16.691 6.587 1.00 0.00 H new ATOM 0 HH12 ARG A 113 -9.713 18.398 6.875 1.00 0.00 H new ATOM 0 HH21 ARG A 113 -10.868 19.005 3.573 1.00 0.00 H new ATOM 0 HH22 ARG A 113 -10.568 19.712 5.165 1.00 0.00 H new ATOM 1772 N VAL A 114 -6.618 14.829 0.273 1.00 0.00 N ATOM 1773 CA VAL A 114 -5.414 15.511 -0.174 1.00 0.00 C ATOM 1774 C VAL A 114 -5.783 16.535 -1.249 1.00 0.00 C ATOM 1775 O VAL A 114 -5.496 17.722 -1.105 1.00 0.00 O ATOM 1776 CB VAL A 114 -4.380 14.489 -0.650 1.00 0.00 C ATOM 1777 CG1 VAL A 114 -3.135 15.185 -1.202 1.00 0.00 C ATOM 1778 CG2 VAL A 114 -4.013 13.517 0.473 1.00 0.00 C ATOM 0 H VAL A 114 -6.571 13.811 0.233 1.00 0.00 H new ATOM 0 HA VAL A 114 -4.955 16.057 0.650 1.00 0.00 H new ATOM 0 HB VAL A 114 -4.827 13.912 -1.459 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -2.416 14.436 -1.533 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -3.415 15.817 -2.045 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -2.685 15.799 -0.422 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -3.276 12.801 0.108 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -3.595 14.072 1.313 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -4.906 12.984 0.799 1.00 0.00 H new ATOM 1788 N SER A 115 -6.412 16.038 -2.304 1.00 0.00 N ATOM 1789 CA SER A 115 -6.822 16.894 -3.403 1.00 0.00 C ATOM 1790 C SER A 115 -7.582 18.109 -2.865 1.00 0.00 C ATOM 1791 O SER A 115 -7.244 19.248 -3.184 1.00 0.00 O ATOM 1792 CB SER A 115 -7.688 16.128 -4.405 1.00 0.00 C ATOM 1793 OG SER A 115 -7.097 14.888 -4.783 1.00 0.00 O ATOM 0 H SER A 115 -6.648 15.052 -2.421 1.00 0.00 H new ATOM 0 HA SER A 115 -5.927 17.234 -3.923 1.00 0.00 H new ATOM 0 HB2 SER A 115 -8.670 15.944 -3.969 1.00 0.00 H new ATOM 0 HB3 SER A 115 -7.844 16.741 -5.293 1.00 0.00 H new ATOM 0 HG SER A 115 -7.681 14.429 -5.422 1.00 0.00 H new ATOM 1799 N GLU A 116 -8.593 17.824 -2.058 1.00 0.00 N ATOM 1800 CA GLU A 116 -9.403 18.879 -1.472 1.00 0.00 C ATOM 1801 C GLU A 116 -8.508 19.963 -0.870 1.00 0.00 C ATOM 1802 O GLU A 116 -8.808 21.151 -0.977 1.00 0.00 O ATOM 1803 CB GLU A 116 -10.363 18.314 -0.423 1.00 0.00 C ATOM 1804 CG GLU A 116 -11.716 19.027 -0.477 1.00 0.00 C ATOM 1805 CD GLU A 116 -11.834 20.064 0.642 1.00 0.00 C ATOM 1806 OE1 GLU A 116 -11.382 21.206 0.408 1.00 0.00 O ATOM 1807 OE2 GLU A 116 -12.373 19.691 1.706 1.00 0.00 O ATOM 0 H GLU A 116 -8.870 16.878 -1.796 1.00 0.00 H new ATOM 0 HA GLU A 116 -10.004 19.330 -2.261 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -10.504 17.246 -0.591 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -9.928 18.426 0.570 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.836 19.515 -1.444 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.520 18.297 -0.387 1.00 0.00 H new ATOM 1814 N LYS A 117 -7.427 19.515 -0.248 1.00 0.00 N ATOM 1815 CA LYS A 117 -6.486 20.433 0.371 1.00 0.00 C ATOM 1816 C LYS A 117 -5.767 21.231 -0.717 1.00 0.00 C ATOM 1817 O LYS A 117 -5.599 22.444 -0.595 1.00 0.00 O ATOM 1818 CB LYS A 117 -5.540 19.678 1.308 1.00 0.00 C ATOM 1819 CG LYS A 117 -4.494 20.621 1.907 1.00 0.00 C ATOM 1820 CD LYS A 117 -4.966 21.181 3.250 1.00 0.00 C ATOM 1821 CE LYS A 117 -5.334 22.661 3.128 1.00 0.00 C ATOM 1822 NZ LYS A 117 -4.190 23.437 2.598 1.00 0.00 N ATOM 0 H LYS A 117 -7.182 18.529 -0.160 1.00 0.00 H new ATOM 0 HA LYS A 117 -7.012 21.153 0.998 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -6.113 19.209 2.108 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -5.042 18.878 0.761 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -3.553 20.088 2.042 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -4.299 21.441 1.215 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -5.829 20.616 3.601 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -4.180 21.058 3.996 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.195 22.775 2.469 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -5.625 23.051 4.103 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -4.196 24.391 3.012 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -3.301 22.958 2.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -4.268 23.508 1.563 1.00 0.00 H new ATOM 1836 N GLU A 118 -5.361 20.519 -1.758 1.00 0.00 N ATOM 1837 CA GLU A 118 -4.663 21.147 -2.868 1.00 0.00 C ATOM 1838 C GLU A 118 -5.611 22.069 -3.637 1.00 0.00 C ATOM 1839 O GLU A 118 -5.175 23.046 -4.244 1.00 0.00 O ATOM 1840 CB GLU A 118 -4.049 20.095 -3.794 1.00 0.00 C ATOM 1841 CG GLU A 118 -2.627 19.740 -3.354 1.00 0.00 C ATOM 1842 CD GLU A 118 -1.626 20.794 -3.832 1.00 0.00 C ATOM 1843 OE1 GLU A 118 -1.794 21.963 -3.423 1.00 0.00 O ATOM 1844 OE2 GLU A 118 -0.715 20.406 -4.595 1.00 0.00 O ATOM 0 H GLU A 118 -5.502 19.514 -1.857 1.00 0.00 H new ATOM 0 HA GLU A 118 -3.848 21.750 -2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -4.668 19.198 -3.793 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -4.034 20.470 -4.817 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -2.587 19.662 -2.268 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -2.352 18.764 -3.754 1.00 0.00 H new