USER MOD reduce.3.24.130724 H: found=0, std=0, add=676, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 674 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 79 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 83 ASN : amide:sc= 0 K(o=0,f=-0.53) USER MOD Set 2.1: A 41 MET CE :methyl -154:sc= -0.221 (180deg=-1.11) USER MOD Set 2.2: A 116 CYS SG : rot 160:sc= 0 USER MOD Set 3.1: A 33 SER OG : rot 170:sc= -1.16! USER MOD Set 3.2: A 37 LYS NZ :NH3+ -166:sc= -6.93! (180deg=-5.91!) USER MOD Single : A 39 LYS NZ :NH3+ -138:sc= 0.223 (180deg=0) USER MOD Single : A 47 HIS : no HE2:sc= 1.07 K(o=1.1,f=-3.5!) USER MOD Single : A 48 LYS NZ :NH3+ -152:sc= 0.354! (180deg=-1.62!) USER MOD Single : A 49 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 57 SER OG : rot 31:sc= 0.0107 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 CYS SG : rot 169:sc= -0.768! USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0.046) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 89 MET CE :methyl -155:sc= -0.16 (180deg=-0.945) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -1.18 K(o=-1.2,f=-1.8!) USER MOD Single : A 98 HIS : no HE2:sc= 0.468! C(o=0.47!,f=-9.4!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot -100:sc= -5.88! USER MOD Single : A 114 GLN : amide:sc= -0.257 X(o=-0.26,f=-0.35) USER MOD Single : A 120 LYS NZ :NH3+ -169:sc= 0.875 (180deg=0.373) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 128 GLN : amide:sc= 0 K(o=0,f=-1.2!) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 133 N SER A 33 0.146 -13.129 8.691 1.00 0.00 N ATOM 134 CA SER A 33 -0.487 -12.544 9.867 1.00 0.00 C ATOM 135 C SER A 33 -1.785 -13.275 10.196 1.00 0.00 C ATOM 136 O SER A 33 -1.862 -14.014 11.177 1.00 0.00 O ATOM 137 CB SER A 33 -0.781 -11.065 9.620 1.00 0.00 C ATOM 138 OG SER A 33 -2.042 -10.938 8.976 1.00 0.00 O ATOM 0 HA SER A 33 0.196 -12.642 10.711 1.00 0.00 H new ATOM 0 HB2 SER A 33 -0.786 -10.521 10.564 1.00 0.00 H new ATOM 0 HB3 SER A 33 0.002 -10.625 9.002 1.00 0.00 H new ATOM 0 HG SER A 33 -2.308 -9.995 8.961 1.00 0.00 H new ATOM 144 N LEU A 34 -2.803 -13.064 9.368 1.00 0.00 N ATOM 145 CA LEU A 34 -4.090 -13.719 9.573 1.00 0.00 C ATOM 146 C LEU A 34 -3.891 -15.150 10.060 1.00 0.00 C ATOM 147 O LEU A 34 -4.606 -15.620 10.945 1.00 0.00 O ATOM 148 CB LEU A 34 -4.886 -13.728 8.266 1.00 0.00 C ATOM 149 CG LEU A 34 -6.223 -14.437 8.487 1.00 0.00 C ATOM 150 CD1 LEU A 34 -6.999 -13.727 9.598 1.00 0.00 C ATOM 151 CD2 LEU A 34 -7.038 -14.400 7.193 1.00 0.00 C ATOM 0 H LEU A 34 -2.763 -12.450 8.555 1.00 0.00 H new ATOM 0 HA LEU A 34 -4.643 -13.163 10.330 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -5.056 -12.707 7.924 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -4.318 -14.235 7.486 1.00 0.00 H new ATOM 0 HG LEU A 34 -6.043 -15.473 8.775 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -7.952 -14.232 9.756 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -6.418 -13.751 10.520 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -7.180 -12.691 9.311 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -7.991 -14.905 7.349 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -7.219 -13.364 6.906 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -6.485 -14.905 6.400 1.00 0.00 H new ATOM 163 N GLU A 35 -2.915 -15.838 9.476 1.00 0.00 N ATOM 164 CA GLU A 35 -2.631 -17.216 9.859 1.00 0.00 C ATOM 165 C GLU A 35 -2.119 -17.279 11.295 1.00 0.00 C ATOM 166 O GLU A 35 -2.541 -18.130 12.078 1.00 0.00 O ATOM 167 CB GLU A 35 -1.585 -17.815 8.916 1.00 0.00 C ATOM 168 CG GLU A 35 -1.373 -19.291 9.260 1.00 0.00 C ATOM 169 CD GLU A 35 -0.366 -19.911 8.298 1.00 0.00 C ATOM 170 OE1 GLU A 35 -0.254 -21.126 8.289 1.00 0.00 O ATOM 171 OE2 GLU A 35 0.280 -19.161 7.583 1.00 0.00 O ATOM 0 H GLU A 35 -2.312 -15.467 8.742 1.00 0.00 H new ATOM 0 HA GLU A 35 -3.555 -17.790 9.789 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -1.913 -17.715 7.881 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.645 -17.271 9.006 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -1.015 -19.386 10.285 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -2.321 -19.826 9.202 1.00 0.00 H new ATOM 178 N GLU A 36 -1.208 -16.372 11.633 1.00 0.00 N ATOM 179 CA GLU A 36 -0.646 -16.334 12.979 1.00 0.00 C ATOM 180 C GLU A 36 -1.726 -15.993 14.001 1.00 0.00 C ATOM 181 O GLU A 36 -1.785 -16.588 15.077 1.00 0.00 O ATOM 182 CB GLU A 36 0.472 -15.293 13.048 1.00 0.00 C ATOM 183 CG GLU A 36 1.663 -15.765 12.211 1.00 0.00 C ATOM 184 CD GLU A 36 2.724 -14.672 12.151 1.00 0.00 C ATOM 185 OE1 GLU A 36 2.479 -13.605 12.689 1.00 0.00 O ATOM 186 OE2 GLU A 36 3.767 -14.918 11.566 1.00 0.00 O ATOM 0 H GLU A 36 -0.846 -15.659 11.000 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.240 -17.319 13.212 1.00 0.00 H new ATOM 0 HB2 GLU A 36 0.112 -14.333 12.678 1.00 0.00 H new ATOM 0 HB3 GLU A 36 0.779 -15.142 14.083 1.00 0.00 H new ATOM 0 HG2 GLU A 36 2.087 -16.671 12.645 1.00 0.00 H new ATOM 0 HG3 GLU A 36 1.333 -16.018 11.204 1.00 0.00 H new ATOM 193 N LYS A 37 -2.576 -15.031 13.657 1.00 0.00 N ATOM 194 CA LYS A 37 -3.651 -14.619 14.553 1.00 0.00 C ATOM 195 C LYS A 37 -4.511 -15.816 14.944 1.00 0.00 C ATOM 196 O LYS A 37 -4.804 -16.024 16.121 1.00 0.00 O ATOM 197 CB LYS A 37 -4.522 -13.562 13.872 1.00 0.00 C ATOM 198 CG LYS A 37 -3.971 -12.169 14.182 1.00 0.00 C ATOM 199 CD LYS A 37 -4.312 -11.218 13.033 1.00 0.00 C ATOM 200 CE LYS A 37 -3.121 -11.125 12.077 1.00 0.00 C ATOM 201 NZ LYS A 37 -3.614 -10.889 10.691 1.00 0.00 N ATOM 0 H LYS A 37 -2.543 -14.525 12.772 1.00 0.00 H new ATOM 0 HA LYS A 37 -3.206 -14.197 15.454 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -4.537 -13.727 12.795 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.551 -13.644 14.221 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -4.396 -11.797 15.114 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -2.891 -12.216 14.321 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.193 -11.576 12.500 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.556 -10.230 13.424 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.459 -10.315 12.382 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -2.538 -12.045 12.115 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.843 -11.060 10.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -4.403 -11.536 10.488 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -3.941 -9.906 10.602 1.00 0.00 H new ATOM 215 N ILE A 38 -4.913 -16.600 13.949 1.00 0.00 N ATOM 216 CA ILE A 38 -5.740 -17.775 14.200 1.00 0.00 C ATOM 217 C ILE A 38 -4.984 -18.790 15.051 1.00 0.00 C ATOM 218 O ILE A 38 -5.536 -19.361 15.991 1.00 0.00 O ATOM 219 CB ILE A 38 -6.148 -18.419 12.875 1.00 0.00 C ATOM 220 CG1 ILE A 38 -7.087 -17.476 12.119 1.00 0.00 C ATOM 221 CG2 ILE A 38 -6.868 -19.741 13.150 1.00 0.00 C ATOM 222 CD1 ILE A 38 -7.335 -18.022 10.712 1.00 0.00 C ATOM 0 H ILE A 38 -4.682 -16.445 12.968 1.00 0.00 H new ATOM 0 HA ILE A 38 -6.633 -17.459 14.740 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.259 -18.608 12.274 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -8.031 -17.380 12.655 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.650 -16.479 12.062 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -7.159 -20.200 12.205 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.201 -20.413 13.690 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.758 -19.553 13.751 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -8.004 -17.350 10.174 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -6.388 -18.096 10.178 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -7.791 -19.010 10.780 1.00 0.00 H new ATOM 234 N LYS A 39 -3.717 -19.010 14.714 1.00 0.00 N ATOM 235 CA LYS A 39 -2.894 -19.960 15.454 1.00 0.00 C ATOM 236 C LYS A 39 -2.764 -19.534 16.913 1.00 0.00 C ATOM 237 O LYS A 39 -2.793 -20.367 17.818 1.00 0.00 O ATOM 238 CB LYS A 39 -1.504 -20.050 14.821 1.00 0.00 C ATOM 239 CG LYS A 39 -1.599 -20.780 13.480 1.00 0.00 C ATOM 240 CD LYS A 39 -0.210 -20.862 12.843 1.00 0.00 C ATOM 241 CE LYS A 39 0.487 -22.144 13.302 1.00 0.00 C ATOM 242 NZ LYS A 39 1.867 -22.187 12.742 1.00 0.00 N ATOM 0 H LYS A 39 -3.241 -18.547 13.940 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.375 -20.937 15.414 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -1.094 -19.051 14.675 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -0.823 -20.579 15.488 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -2.003 -21.782 13.627 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.285 -20.254 12.816 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.295 -20.851 11.756 1.00 0.00 H new ATOM 0 HD3 LYS A 39 0.383 -19.992 13.125 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.524 -22.181 14.391 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -0.078 -23.016 12.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.077 -23.150 12.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 1.939 -21.522 11.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.549 -21.919 13.480 1.00 0.00 H new ATOM 256 N LEU A 40 -2.622 -18.231 17.133 1.00 0.00 N ATOM 257 CA LEU A 40 -2.489 -17.705 18.487 1.00 0.00 C ATOM 258 C LEU A 40 -3.792 -17.881 19.260 1.00 0.00 C ATOM 259 O LEU A 40 -3.793 -18.369 20.390 1.00 0.00 O ATOM 260 CB LEU A 40 -2.119 -16.221 18.437 1.00 0.00 C ATOM 261 CG LEU A 40 -2.010 -15.674 19.860 1.00 0.00 C ATOM 262 CD1 LEU A 40 -0.969 -16.479 20.639 1.00 0.00 C ATOM 263 CD2 LEU A 40 -1.583 -14.205 19.810 1.00 0.00 C ATOM 0 H LEU A 40 -2.596 -17.525 16.398 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.700 -18.259 18.996 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.173 -16.089 17.912 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.873 -15.666 17.880 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.978 -15.756 20.355 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -0.892 -16.088 21.654 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.271 -17.526 20.675 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.001 -16.397 20.144 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.505 -13.814 20.824 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.616 -14.124 19.315 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.324 -13.629 19.255 1.00 0.00 H new ATOM 275 N MET A 41 -4.899 -17.480 18.643 1.00 0.00 N ATOM 276 CA MET A 41 -6.204 -17.598 19.284 1.00 0.00 C ATOM 277 C MET A 41 -6.587 -19.065 19.453 1.00 0.00 C ATOM 278 O MET A 41 -7.299 -19.426 20.389 1.00 0.00 O ATOM 279 CB MET A 41 -7.265 -16.885 18.443 1.00 0.00 C ATOM 280 CG MET A 41 -7.129 -15.372 18.625 1.00 0.00 C ATOM 281 SD MET A 41 -7.529 -14.931 20.334 1.00 0.00 S ATOM 282 CE MET A 41 -9.315 -15.202 20.225 1.00 0.00 C ATOM 0 H MET A 41 -4.919 -17.074 17.708 1.00 0.00 H new ATOM 0 HA MET A 41 -6.148 -17.133 20.268 1.00 0.00 H new ATOM 0 HB2 MET A 41 -7.148 -17.147 17.392 1.00 0.00 H new ATOM 0 HB3 MET A 41 -8.261 -17.210 18.743 1.00 0.00 H new ATOM 0 HG2 MET A 41 -6.114 -15.056 18.385 1.00 0.00 H new ATOM 0 HG3 MET A 41 -7.796 -14.851 17.938 1.00 0.00 H new ATOM 0 HE1 MET A 41 -9.823 -14.583 20.965 1.00 0.00 H new ATOM 0 HE2 MET A 41 -9.663 -14.935 19.227 1.00 0.00 H new ATOM 0 HE3 MET A 41 -9.536 -16.252 20.417 1.00 0.00 H new ATOM 292 N ARG A 42 -6.109 -19.905 18.540 1.00 0.00 N ATOM 293 CA ARG A 42 -6.409 -21.331 18.598 1.00 0.00 C ATOM 294 C ARG A 42 -5.793 -21.957 19.845 1.00 0.00 C ATOM 295 O ARG A 42 -6.179 -23.051 20.257 1.00 0.00 O ATOM 296 CB ARG A 42 -5.863 -22.030 17.351 1.00 0.00 C ATOM 297 CG ARG A 42 -6.818 -21.801 16.178 1.00 0.00 C ATOM 298 CD ARG A 42 -7.906 -22.877 16.187 1.00 0.00 C ATOM 299 NE ARG A 42 -7.309 -24.199 16.034 1.00 0.00 N ATOM 300 CZ ARG A 42 -6.997 -24.677 14.833 1.00 0.00 C ATOM 301 NH1 ARG A 42 -6.464 -25.863 14.721 1.00 0.00 N ATOM 302 NH2 ARG A 42 -7.224 -23.960 13.767 1.00 0.00 N ATOM 0 H ARG A 42 -5.517 -19.626 17.757 1.00 0.00 H new ATOM 0 HA ARG A 42 -7.491 -21.455 18.640 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -4.873 -21.643 17.109 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -5.751 -23.098 17.539 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -7.270 -20.812 16.251 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -6.269 -21.832 15.237 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -8.467 -22.829 17.120 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -8.615 -22.694 15.379 1.00 0.00 H new ATOM 0 HE ARG A 42 -7.128 -24.766 16.862 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -6.287 -26.423 15.555 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -6.225 -26.230 13.800 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -7.641 -23.033 13.855 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -6.985 -24.326 12.846 1.00 0.00 H new ATOM 316 N LEU A 43 -4.834 -21.256 20.442 1.00 0.00 N ATOM 317 CA LEU A 43 -4.172 -21.754 21.642 1.00 0.00 C ATOM 318 C LEU A 43 -4.821 -21.171 22.893 1.00 0.00 C ATOM 319 O LEU A 43 -4.954 -21.852 23.910 1.00 0.00 O ATOM 320 CB LEU A 43 -2.689 -21.380 21.613 1.00 0.00 C ATOM 321 CG LEU A 43 -1.908 -22.446 20.843 1.00 0.00 C ATOM 322 CD1 LEU A 43 -0.446 -22.016 20.714 1.00 0.00 C ATOM 323 CD2 LEU A 43 -1.982 -23.775 21.599 1.00 0.00 C ATOM 0 H LEU A 43 -4.500 -20.348 20.117 1.00 0.00 H new ATOM 0 HA LEU A 43 -4.273 -22.839 21.666 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -2.558 -20.406 21.141 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -2.304 -21.296 22.629 1.00 0.00 H new ATOM 0 HG LEU A 43 -2.340 -22.566 19.849 1.00 0.00 H new ATOM 0 HD11 LEU A 43 0.110 -22.776 20.165 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -0.391 -21.069 20.178 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -0.013 -21.896 21.707 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.426 -24.536 21.052 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.549 -23.653 22.592 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.023 -24.083 21.692 1.00 0.00 H new ATOM 335 N VAL A 44 -5.224 -19.907 22.810 1.00 0.00 N ATOM 336 CA VAL A 44 -5.859 -19.243 23.943 1.00 0.00 C ATOM 337 C VAL A 44 -7.173 -19.930 24.300 1.00 0.00 C ATOM 338 O VAL A 44 -7.448 -20.195 25.471 1.00 0.00 O ATOM 339 CB VAL A 44 -6.125 -17.775 23.605 1.00 0.00 C ATOM 340 CG1 VAL A 44 -6.733 -17.073 24.820 1.00 0.00 C ATOM 341 CG2 VAL A 44 -4.807 -17.093 23.230 1.00 0.00 C ATOM 0 H VAL A 44 -5.123 -19.326 21.978 1.00 0.00 H new ATOM 0 HA VAL A 44 -5.186 -19.304 24.799 1.00 0.00 H new ATOM 0 HB VAL A 44 -6.819 -17.715 22.766 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -6.922 -16.027 24.579 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -7.671 -17.559 25.089 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -6.040 -17.132 25.659 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -4.995 -16.047 22.989 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -4.114 -17.153 24.069 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -4.372 -17.593 22.364 1.00 0.00 H new ATOM 351 N VAL A 45 -7.981 -20.216 23.284 1.00 0.00 N ATOM 352 CA VAL A 45 -9.264 -20.874 23.504 1.00 0.00 C ATOM 353 C VAL A 45 -9.058 -22.285 24.044 1.00 0.00 C ATOM 354 O VAL A 45 -9.781 -22.730 24.936 1.00 0.00 O ATOM 355 CB VAL A 45 -10.049 -20.937 22.192 1.00 0.00 C ATOM 356 CG1 VAL A 45 -11.253 -21.865 22.362 1.00 0.00 C ATOM 357 CG2 VAL A 45 -10.536 -19.534 21.823 1.00 0.00 C ATOM 0 H VAL A 45 -7.773 -20.005 22.308 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.827 -20.296 24.237 1.00 0.00 H new ATOM 0 HB VAL A 45 -9.404 -21.319 21.400 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -11.812 -21.910 21.428 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.908 -22.864 22.627 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -11.898 -21.483 23.153 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -11.095 -19.577 20.889 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -11.181 -19.153 22.615 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -9.679 -18.871 21.703 1.00 0.00 H new ATOM 367 N ARG A 46 -8.068 -22.983 23.499 1.00 0.00 N ATOM 368 CA ARG A 46 -7.775 -24.344 23.934 1.00 0.00 C ATOM 369 C ARG A 46 -7.269 -24.349 25.373 1.00 0.00 C ATOM 370 O ARG A 46 -7.205 -25.397 26.015 1.00 0.00 O ATOM 371 CB ARG A 46 -6.722 -24.971 23.019 1.00 0.00 C ATOM 372 CG ARG A 46 -6.501 -26.431 23.419 1.00 0.00 C ATOM 373 CD ARG A 46 -5.551 -27.096 22.422 1.00 0.00 C ATOM 374 NE ARG A 46 -5.454 -28.525 22.693 1.00 0.00 N ATOM 375 CZ ARG A 46 -4.681 -29.314 21.954 1.00 0.00 C ATOM 376 NH1 ARG A 46 -4.611 -30.591 22.216 1.00 0.00 N ATOM 377 NH2 ARG A 46 -3.992 -28.812 20.966 1.00 0.00 N ATOM 0 H ARG A 46 -7.458 -22.632 22.760 1.00 0.00 H new ATOM 0 HA ARG A 46 -8.694 -24.927 23.881 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -7.047 -24.913 21.980 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -5.786 -24.417 23.092 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -6.085 -26.484 24.425 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -7.453 -26.961 23.439 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -5.909 -26.935 21.405 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -4.564 -26.638 22.489 1.00 0.00 H new ATOM 0 HE ARG A 46 -5.989 -28.926 23.463 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -5.150 -30.983 22.988 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -4.018 -31.196 21.649 1.00 0.00 H new ATOM 0 HH21 ARG A 46 -4.047 -27.814 20.761 1.00 0.00 H new ATOM 0 HH22 ARG A 46 -3.399 -29.417 20.399 1.00 0.00 H new ATOM 391 N HIS A 47 -6.911 -23.171 25.873 1.00 0.00 N ATOM 392 CA HIS A 47 -6.412 -23.052 27.238 1.00 0.00 C ATOM 393 C HIS A 47 -7.158 -21.953 27.988 1.00 0.00 C ATOM 394 O HIS A 47 -6.607 -21.316 28.886 1.00 0.00 O ATOM 395 CB HIS A 47 -4.915 -22.735 27.221 1.00 0.00 C ATOM 396 CG HIS A 47 -4.166 -23.883 26.602 1.00 0.00 C ATOM 397 ND1 HIS A 47 -3.738 -23.862 25.285 1.00 0.00 N ATOM 398 CD2 HIS A 47 -3.762 -25.094 27.108 1.00 0.00 C ATOM 399 CE1 HIS A 47 -3.107 -25.025 25.044 1.00 0.00 C ATOM 400 NE2 HIS A 47 -3.094 -25.814 26.122 1.00 0.00 N ATOM 0 H HIS A 47 -6.956 -22.292 25.358 1.00 0.00 H new ATOM 0 HA HIS A 47 -6.577 -24.001 27.749 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -4.732 -21.821 26.656 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -4.558 -22.559 28.236 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -3.876 -23.102 24.619 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.936 -25.436 28.118 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -2.665 -25.289 24.095 1.00 0.00 H new ATOM 407 N LYS A 48 -8.414 -21.735 27.613 1.00 0.00 N ATOM 408 CA LYS A 48 -9.227 -20.710 28.257 1.00 0.00 C ATOM 409 C LYS A 48 -9.600 -21.134 29.674 1.00 0.00 C ATOM 410 O LYS A 48 -9.795 -20.294 30.552 1.00 0.00 O ATOM 411 CB LYS A 48 -10.499 -20.465 27.444 1.00 0.00 C ATOM 412 CG LYS A 48 -11.298 -21.765 27.339 1.00 0.00 C ATOM 413 CD LYS A 48 -12.524 -21.542 26.453 1.00 0.00 C ATOM 414 CE LYS A 48 -13.332 -22.838 26.363 1.00 0.00 C ATOM 415 NZ LYS A 48 -14.545 -22.610 25.527 1.00 0.00 N ATOM 0 H LYS A 48 -8.889 -22.250 26.872 1.00 0.00 H new ATOM 0 HA LYS A 48 -8.645 -19.790 28.307 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -11.103 -19.692 27.919 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.243 -20.102 26.449 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -10.674 -22.555 26.922 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -11.608 -22.094 28.331 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.142 -20.744 26.864 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.213 -21.225 25.457 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -12.722 -23.630 25.929 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.622 -23.169 27.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.300 -23.260 25.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.867 -21.628 25.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -14.315 -22.782 24.527 1.00 0.00 H new ATOM 429 N HIS A 49 -9.697 -22.442 29.888 1.00 0.00 N ATOM 430 CA HIS A 49 -10.050 -22.966 31.203 1.00 0.00 C ATOM 431 C HIS A 49 -8.978 -22.609 32.227 1.00 0.00 C ATOM 432 O HIS A 49 -9.286 -22.282 33.374 1.00 0.00 O ATOM 433 CB HIS A 49 -10.206 -24.487 31.134 1.00 0.00 C ATOM 434 CG HIS A 49 -11.626 -24.830 30.779 1.00 0.00 C ATOM 435 ND1 HIS A 49 -12.075 -24.857 29.468 1.00 0.00 N ATOM 436 CD2 HIS A 49 -12.711 -25.162 31.553 1.00 0.00 C ATOM 437 CE1 HIS A 49 -13.377 -25.195 29.491 1.00 0.00 C ATOM 438 NE2 HIS A 49 -13.815 -25.392 30.737 1.00 0.00 N ATOM 0 H HIS A 49 -9.538 -23.154 29.175 1.00 0.00 H new ATOM 0 HA HIS A 49 -10.994 -22.517 31.511 1.00 0.00 H new ATOM 0 HB2 HIS A 49 -9.524 -24.900 30.390 1.00 0.00 H new ATOM 0 HB3 HIS A 49 -9.941 -24.934 32.092 1.00 0.00 H new ATOM 0 HD2 HIS A 49 -12.708 -25.234 32.631 1.00 0.00 H new ATOM 0 HE1 HIS A 49 -13.993 -25.295 28.609 1.00 0.00 H new ATOM 0 HE2 HIS A 49 -14.757 -25.655 31.028 1.00 0.00 H new ATOM 445 N GLU A 50 -7.719 -22.673 31.806 1.00 0.00 N ATOM 446 CA GLU A 50 -6.609 -22.354 32.697 1.00 0.00 C ATOM 447 C GLU A 50 -6.866 -21.037 33.423 1.00 0.00 C ATOM 448 O GLU A 50 -6.656 -19.959 32.867 1.00 0.00 O ATOM 449 CB GLU A 50 -5.310 -22.252 31.896 1.00 0.00 C ATOM 450 CG GLU A 50 -4.910 -23.640 31.392 1.00 0.00 C ATOM 451 CD GLU A 50 -3.649 -23.542 30.540 1.00 0.00 C ATOM 452 OE1 GLU A 50 -3.176 -22.436 30.342 1.00 0.00 O ATOM 453 OE2 GLU A 50 -3.175 -24.576 30.097 1.00 0.00 O ATOM 0 H GLU A 50 -7.443 -22.941 30.861 1.00 0.00 H new ATOM 0 HA GLU A 50 -6.519 -23.151 33.435 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -5.442 -21.572 31.054 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -4.518 -21.838 32.519 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -4.737 -24.307 32.237 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -5.722 -24.071 30.806 1.00 0.00 H new ATOM 567 N SER A 57 -0.699 -13.199 34.943 1.00 0.00 N ATOM 568 CA SER A 57 0.291 -13.368 33.886 1.00 0.00 C ATOM 569 C SER A 57 0.586 -14.847 33.660 1.00 0.00 C ATOM 570 O SER A 57 0.852 -15.272 32.536 1.00 0.00 O ATOM 571 CB SER A 57 1.582 -12.640 34.260 1.00 0.00 C ATOM 572 OG SER A 57 1.358 -11.237 34.221 1.00 0.00 O ATOM 0 HA SER A 57 -0.111 -12.945 32.966 1.00 0.00 H new ATOM 0 HB2 SER A 57 1.907 -12.940 35.256 1.00 0.00 H new ATOM 0 HB3 SER A 57 2.380 -12.912 33.569 1.00 0.00 H new ATOM 0 HG SER A 57 0.424 -11.048 34.452 1.00 0.00 H new ATOM 578 N GLU A 58 0.553 -15.647 34.726 1.00 0.00 N ATOM 579 CA GLU A 58 0.835 -17.070 34.584 1.00 0.00 C ATOM 580 C GLU A 58 0.132 -17.636 33.355 1.00 0.00 C ATOM 581 O GLU A 58 0.573 -18.631 32.779 1.00 0.00 O ATOM 582 CB GLU A 58 0.369 -17.822 35.832 1.00 0.00 C ATOM 583 CG GLU A 58 0.764 -19.296 35.719 1.00 0.00 C ATOM 584 CD GLU A 58 0.516 -20.006 37.045 1.00 0.00 C ATOM 585 OE1 GLU A 58 -0.090 -19.401 37.914 1.00 0.00 O ATOM 586 OE2 GLU A 58 0.936 -21.144 37.173 1.00 0.00 O ATOM 0 H GLU A 58 0.339 -15.341 35.675 1.00 0.00 H new ATOM 0 HA GLU A 58 1.911 -17.197 34.464 1.00 0.00 H new ATOM 0 HB2 GLU A 58 0.817 -17.382 36.723 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -0.712 -17.732 35.941 1.00 0.00 H new ATOM 0 HG2 GLU A 58 0.188 -19.775 34.927 1.00 0.00 H new ATOM 0 HG3 GLU A 58 1.815 -19.379 35.444 1.00 0.00 H new ATOM 593 N PHE A 59 -0.963 -16.996 32.958 1.00 0.00 N ATOM 594 CA PHE A 59 -1.719 -17.445 31.795 1.00 0.00 C ATOM 595 C PHE A 59 -1.043 -16.987 30.507 1.00 0.00 C ATOM 596 O PHE A 59 -0.536 -17.803 29.737 1.00 0.00 O ATOM 597 CB PHE A 59 -3.143 -16.889 31.852 1.00 0.00 C ATOM 598 CG PHE A 59 -3.854 -17.189 30.554 1.00 0.00 C ATOM 599 CD1 PHE A 59 -4.114 -18.515 30.189 1.00 0.00 C ATOM 600 CD2 PHE A 59 -4.253 -16.141 29.716 1.00 0.00 C ATOM 601 CE1 PHE A 59 -4.773 -18.793 28.985 1.00 0.00 C ATOM 602 CE2 PHE A 59 -4.911 -16.419 28.512 1.00 0.00 C ATOM 603 CZ PHE A 59 -5.171 -17.745 28.147 1.00 0.00 C ATOM 0 H PHE A 59 -1.344 -16.171 33.421 1.00 0.00 H new ATOM 0 HA PHE A 59 -1.754 -18.534 31.806 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -3.685 -17.333 32.687 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.118 -15.813 32.025 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -3.806 -19.323 30.836 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.053 -15.118 29.998 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -4.974 -19.816 28.703 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.218 -15.611 27.865 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.679 -17.960 27.218 1.00 0.00 H new ATOM 613 N TYR A 60 -1.040 -15.678 30.279 1.00 0.00 N ATOM 614 CA TYR A 60 -0.423 -15.122 29.080 1.00 0.00 C ATOM 615 C TYR A 60 1.038 -15.549 28.982 1.00 0.00 C ATOM 616 O TYR A 60 1.585 -15.679 27.886 1.00 0.00 O ATOM 617 CB TYR A 60 -0.509 -13.595 29.108 1.00 0.00 C ATOM 618 CG TYR A 60 -1.953 -13.174 29.233 1.00 0.00 C ATOM 619 CD1 TYR A 60 -2.542 -13.061 30.498 1.00 0.00 C ATOM 620 CD2 TYR A 60 -2.703 -12.895 28.085 1.00 0.00 C ATOM 621 CE1 TYR A 60 -3.882 -12.671 30.615 1.00 0.00 C ATOM 622 CE2 TYR A 60 -4.042 -12.504 28.201 1.00 0.00 C ATOM 623 CZ TYR A 60 -4.632 -12.392 29.466 1.00 0.00 C ATOM 624 OH TYR A 60 -5.952 -12.006 29.580 1.00 0.00 O ATOM 0 H TYR A 60 -1.455 -14.986 30.904 1.00 0.00 H new ATOM 0 HA TYR A 60 -0.960 -15.500 28.210 1.00 0.00 H new ATOM 0 HB2 TYR A 60 0.069 -13.203 29.945 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -0.075 -13.179 28.199 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -1.963 -13.275 31.384 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -2.249 -12.981 27.109 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -4.337 -12.585 31.591 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -4.620 -12.289 27.315 1.00 0.00 H new ATOM 0 HH TYR A 60 -6.325 -11.850 28.687 1.00 0.00 H new ATOM 634 N ALA A 61 1.665 -15.767 30.134 1.00 0.00 N ATOM 635 CA ALA A 61 3.063 -16.179 30.165 1.00 0.00 C ATOM 636 C ALA A 61 3.217 -17.597 29.625 1.00 0.00 C ATOM 637 O ALA A 61 4.305 -18.000 29.215 1.00 0.00 O ATOM 638 CB ALA A 61 3.594 -16.117 31.599 1.00 0.00 C ATOM 0 H ALA A 61 1.231 -15.666 31.051 1.00 0.00 H new ATOM 0 HA ALA A 61 3.636 -15.499 29.535 1.00 0.00 H new ATOM 0 HB1 ALA A 61 4.639 -16.426 31.614 1.00 0.00 H new ATOM 0 HB2 ALA A 61 3.512 -15.097 31.973 1.00 0.00 H new ATOM 0 HB3 ALA A 61 3.009 -16.784 32.233 1.00 0.00 H new ATOM 644 N LYS A 62 2.121 -18.349 29.628 1.00 0.00 N ATOM 645 CA LYS A 62 2.147 -19.721 29.136 1.00 0.00 C ATOM 646 C LYS A 62 1.781 -19.767 27.656 1.00 0.00 C ATOM 647 O LYS A 62 2.316 -20.578 26.899 1.00 0.00 O ATOM 648 CB LYS A 62 1.164 -20.580 29.933 1.00 0.00 C ATOM 649 CG LYS A 62 1.611 -22.043 29.889 1.00 0.00 C ATOM 650 CD LYS A 62 0.697 -22.884 30.783 1.00 0.00 C ATOM 651 CE LYS A 62 1.089 -22.681 32.248 1.00 0.00 C ATOM 652 NZ LYS A 62 0.444 -23.732 33.084 1.00 0.00 N ATOM 0 H LYS A 62 1.210 -18.034 29.963 1.00 0.00 H new ATOM 0 HA LYS A 62 3.156 -20.113 29.261 1.00 0.00 H new ATOM 0 HB2 LYS A 62 1.117 -20.234 30.966 1.00 0.00 H new ATOM 0 HB3 LYS A 62 0.161 -20.483 29.518 1.00 0.00 H new ATOM 0 HG2 LYS A 62 1.577 -22.414 28.865 1.00 0.00 H new ATOM 0 HG3 LYS A 62 2.644 -22.129 30.225 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -0.343 -22.596 30.631 1.00 0.00 H new ATOM 0 HD3 LYS A 62 0.779 -23.938 30.516 1.00 0.00 H new ATOM 0 HE2 LYS A 62 2.173 -22.729 32.356 1.00 0.00 H new ATOM 0 HE3 LYS A 62 0.779 -21.692 32.585 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 0.710 -23.595 34.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -0.590 -23.665 32.989 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 0.761 -24.671 32.767 1.00 0.00 H new ATOM 666 N ILE A 63 0.867 -18.892 27.250 1.00 0.00 N ATOM 667 CA ILE A 63 0.437 -18.842 25.857 1.00 0.00 C ATOM 668 C ILE A 63 1.608 -18.486 24.947 1.00 0.00 C ATOM 669 O ILE A 63 1.837 -19.139 23.929 1.00 0.00 O ATOM 670 CB ILE A 63 -0.675 -17.806 25.691 1.00 0.00 C ATOM 671 CG1 ILE A 63 -1.896 -18.234 26.508 1.00 0.00 C ATOM 672 CG2 ILE A 63 -1.061 -17.703 24.214 1.00 0.00 C ATOM 673 CD1 ILE A 63 -2.364 -19.613 26.042 1.00 0.00 C ATOM 0 H ILE A 63 0.413 -18.213 27.860 1.00 0.00 H new ATOM 0 HA ILE A 63 0.061 -19.826 25.577 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.323 -16.836 26.043 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -1.645 -18.263 27.568 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -2.699 -17.507 26.390 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -1.854 -16.964 24.096 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -0.192 -17.399 23.631 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -1.413 -18.673 23.861 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -3.234 -19.918 26.624 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -2.631 -19.569 24.986 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.561 -20.337 26.183 1.00 0.00 H new ATOM 685 N ALA A 64 2.346 -17.445 25.320 1.00 0.00 N ATOM 686 CA ALA A 64 3.491 -17.010 24.529 1.00 0.00 C ATOM 687 C ALA A 64 4.595 -18.063 24.559 1.00 0.00 C ATOM 688 O ALA A 64 5.514 -18.036 23.740 1.00 0.00 O ATOM 689 CB ALA A 64 4.031 -15.687 25.075 1.00 0.00 C ATOM 0 H ALA A 64 2.173 -16.891 26.159 1.00 0.00 H new ATOM 0 HA ALA A 64 3.164 -16.871 23.498 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.886 -15.369 24.478 1.00 0.00 H new ATOM 0 HB2 ALA A 64 3.251 -14.927 25.025 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.341 -15.821 26.111 1.00 0.00 H new ATOM 695 N ARG A 65 4.496 -18.990 25.506 1.00 0.00 N ATOM 696 CA ARG A 65 5.493 -20.047 25.633 1.00 0.00 C ATOM 697 C ARG A 65 5.188 -21.189 24.668 1.00 0.00 C ATOM 698 O ARG A 65 6.080 -21.691 23.985 1.00 0.00 O ATOM 699 CB ARG A 65 5.511 -20.579 27.067 1.00 0.00 C ATOM 700 CG ARG A 65 6.456 -21.779 27.155 1.00 0.00 C ATOM 701 CD ARG A 65 6.566 -22.237 28.610 1.00 0.00 C ATOM 702 NE ARG A 65 7.239 -21.220 29.410 1.00 0.00 N ATOM 703 CZ ARG A 65 7.416 -21.380 30.718 1.00 0.00 C ATOM 704 NH1 ARG A 65 8.022 -20.457 31.412 1.00 0.00 N ATOM 705 NH2 ARG A 65 6.984 -22.462 31.307 1.00 0.00 N ATOM 0 H ARG A 65 3.742 -19.031 26.192 1.00 0.00 H new ATOM 0 HA ARG A 65 6.470 -19.631 25.389 1.00 0.00 H new ATOM 0 HB2 ARG A 65 5.836 -19.796 27.752 1.00 0.00 H new ATOM 0 HB3 ARG A 65 4.506 -20.871 27.370 1.00 0.00 H new ATOM 0 HG2 ARG A 65 6.085 -22.594 26.533 1.00 0.00 H new ATOM 0 HG3 ARG A 65 7.440 -21.509 26.772 1.00 0.00 H new ATOM 0 HD2 ARG A 65 5.572 -22.429 29.014 1.00 0.00 H new ATOM 0 HD3 ARG A 65 7.118 -23.175 28.663 1.00 0.00 H new ATOM 0 HE ARG A 65 7.580 -20.371 28.958 1.00 0.00 H new ATOM 0 HH11 ARG A 65 8.360 -19.612 30.951 1.00 0.00 H new ATOM 0 HH12 ARG A 65 8.158 -20.580 32.415 1.00 0.00 H new ATOM 0 HH21 ARG A 65 6.511 -23.184 30.764 1.00 0.00 H new ATOM 0 HH22 ARG A 65 7.120 -22.585 32.310 1.00 0.00 H new ATOM 719 N ILE A 66 3.923 -21.594 24.619 1.00 0.00 N ATOM 720 CA ILE A 66 3.513 -22.679 23.735 1.00 0.00 C ATOM 721 C ILE A 66 3.262 -22.154 22.325 1.00 0.00 C ATOM 722 O ILE A 66 3.247 -22.920 21.361 1.00 0.00 O ATOM 723 CB ILE A 66 2.240 -23.336 24.271 1.00 0.00 C ATOM 724 CG1 ILE A 66 2.544 -24.020 25.605 1.00 0.00 C ATOM 725 CG2 ILE A 66 1.741 -24.377 23.267 1.00 0.00 C ATOM 726 CD1 ILE A 66 1.235 -24.445 26.272 1.00 0.00 C ATOM 0 H ILE A 66 3.170 -21.191 25.176 1.00 0.00 H new ATOM 0 HA ILE A 66 4.315 -23.417 23.699 1.00 0.00 H new ATOM 0 HB ILE A 66 1.473 -22.576 24.418 1.00 0.00 H new ATOM 0 HG12 ILE A 66 3.181 -24.890 25.443 1.00 0.00 H new ATOM 0 HG13 ILE A 66 3.093 -23.341 26.257 1.00 0.00 H new ATOM 0 HG21 ILE A 66 0.834 -24.845 23.649 1.00 0.00 H new ATOM 0 HG22 ILE A 66 1.525 -23.891 22.316 1.00 0.00 H new ATOM 0 HG23 ILE A 66 2.508 -25.138 23.120 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.452 -24.932 27.222 1.00 0.00 H new ATOM 0 HD12 ILE A 66 0.614 -23.566 26.448 1.00 0.00 H new ATOM 0 HD13 ILE A 66 0.704 -25.140 25.621 1.00 0.00 H new ATOM 738 N GLY A 67 3.064 -20.845 22.212 1.00 0.00 N ATOM 739 CA GLY A 67 2.814 -20.229 20.914 1.00 0.00 C ATOM 740 C GLY A 67 4.109 -20.079 20.123 1.00 0.00 C ATOM 741 O GLY A 67 4.087 -19.866 18.911 1.00 0.00 O ATOM 0 H GLY A 67 3.072 -20.194 22.997 1.00 0.00 H new ATOM 0 HA2 GLY A 67 2.107 -20.836 20.349 1.00 0.00 H new ATOM 0 HA3 GLY A 67 2.354 -19.251 21.054 1.00 0.00 H new ATOM 745 N TYR A 68 5.237 -20.193 20.817 1.00 0.00 N ATOM 746 CA TYR A 68 6.537 -20.068 20.169 1.00 0.00 C ATOM 747 C TYR A 68 7.286 -21.396 20.209 1.00 0.00 C ATOM 748 O TYR A 68 8.351 -21.538 19.609 1.00 0.00 O ATOM 749 CB TYR A 68 7.368 -18.990 20.867 1.00 0.00 C ATOM 750 CG TYR A 68 8.795 -19.058 20.379 1.00 0.00 C ATOM 751 CD1 TYR A 68 9.108 -18.659 19.074 1.00 0.00 C ATOM 752 CD2 TYR A 68 9.805 -19.521 21.231 1.00 0.00 C ATOM 753 CE1 TYR A 68 10.432 -18.723 18.621 1.00 0.00 C ATOM 754 CE2 TYR A 68 11.128 -19.584 20.778 1.00 0.00 C ATOM 755 CZ TYR A 68 11.442 -19.185 19.473 1.00 0.00 C ATOM 756 OH TYR A 68 12.746 -19.248 19.027 1.00 0.00 O ATOM 0 H TYR A 68 5.277 -20.370 21.821 1.00 0.00 H new ATOM 0 HA TYR A 68 6.377 -19.785 19.129 1.00 0.00 H new ATOM 0 HB2 TYR A 68 6.949 -18.004 20.663 1.00 0.00 H new ATOM 0 HB3 TYR A 68 7.335 -19.133 21.947 1.00 0.00 H new ATOM 0 HD1 TYR A 68 8.329 -18.302 18.417 1.00 0.00 H new ATOM 0 HD2 TYR A 68 9.563 -19.829 22.237 1.00 0.00 H new ATOM 0 HE1 TYR A 68 10.674 -18.416 17.614 1.00 0.00 H new ATOM 0 HE2 TYR A 68 11.907 -19.941 21.435 1.00 0.00 H new ATOM 0 HH TYR A 68 13.321 -19.590 19.744 1.00 0.00 H new ATOM 766 N GLU A 69 6.722 -22.366 20.922 1.00 0.00 N ATOM 767 CA GLU A 69 7.346 -23.680 21.034 1.00 0.00 C ATOM 768 C GLU A 69 6.541 -24.723 20.265 1.00 0.00 C ATOM 769 O GLU A 69 6.858 -25.912 20.296 1.00 0.00 O ATOM 770 CB GLU A 69 7.442 -24.089 22.505 1.00 0.00 C ATOM 771 CG GLU A 69 8.444 -23.182 23.223 1.00 0.00 C ATOM 772 CD GLU A 69 8.479 -23.520 24.710 1.00 0.00 C ATOM 773 OE1 GLU A 69 7.766 -24.425 25.109 1.00 0.00 O ATOM 774 OE2 GLU A 69 9.220 -22.868 25.427 1.00 0.00 O ATOM 0 H GLU A 69 5.841 -22.269 21.427 1.00 0.00 H new ATOM 0 HA GLU A 69 8.347 -23.623 20.607 1.00 0.00 H new ATOM 0 HB2 GLU A 69 6.463 -24.014 22.979 1.00 0.00 H new ATOM 0 HB3 GLU A 69 7.756 -25.130 22.584 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.436 -23.307 22.789 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.165 -22.137 23.085 1.00 0.00 H new ATOM 781 N ASP A 70 5.499 -24.269 19.576 1.00 0.00 N ATOM 782 CA ASP A 70 4.655 -25.172 18.803 1.00 0.00 C ATOM 783 C ASP A 70 4.189 -24.500 17.516 1.00 0.00 C ATOM 784 O ASP A 70 4.245 -25.093 16.439 1.00 0.00 O ATOM 785 CB ASP A 70 3.439 -25.590 19.632 1.00 0.00 C ATOM 786 CG ASP A 70 3.862 -26.575 20.717 1.00 0.00 C ATOM 787 OD1 ASP A 70 4.946 -27.123 20.603 1.00 0.00 O ATOM 788 OD2 ASP A 70 3.095 -26.767 21.646 1.00 0.00 O ATOM 0 H ASP A 70 5.220 -23.289 19.537 1.00 0.00 H new ATOM 0 HA ASP A 70 5.240 -26.055 18.547 1.00 0.00 H new ATOM 0 HB2 ASP A 70 2.978 -24.712 20.085 1.00 0.00 H new ATOM 0 HB3 ASP A 70 2.688 -26.047 18.987 1.00 0.00 H new ATOM 793 N GLU A 71 3.729 -23.259 17.636 1.00 0.00 N ATOM 794 CA GLU A 71 3.255 -22.515 16.474 1.00 0.00 C ATOM 795 C GLU A 71 4.418 -21.828 15.767 1.00 0.00 C ATOM 796 O GLU A 71 4.326 -21.487 14.587 1.00 0.00 O ATOM 797 CB GLU A 71 2.228 -21.467 16.908 1.00 0.00 C ATOM 798 CG GLU A 71 1.316 -22.060 17.984 1.00 0.00 C ATOM 799 CD GLU A 71 0.559 -23.258 17.422 1.00 0.00 C ATOM 800 OE1 GLU A 71 0.526 -23.399 16.211 1.00 0.00 O ATOM 801 OE2 GLU A 71 0.022 -24.017 18.212 1.00 0.00 O ATOM 0 H GLU A 71 3.674 -22.750 18.518 1.00 0.00 H new ATOM 0 HA GLU A 71 2.788 -23.216 15.783 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.736 -20.583 17.294 1.00 0.00 H new ATOM 0 HB3 GLU A 71 1.636 -21.146 16.051 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.908 -22.365 18.847 1.00 0.00 H new ATOM 0 HG3 GLU A 71 0.611 -21.305 18.332 1.00 0.00 H new ATOM 808 N GLY A 72 5.512 -21.628 16.495 1.00 0.00 N ATOM 809 CA GLY A 72 6.690 -20.986 15.924 1.00 0.00 C ATOM 810 C GLY A 72 6.316 -19.686 15.221 1.00 0.00 C ATOM 811 O GLY A 72 5.919 -19.691 14.056 1.00 0.00 O ATOM 0 H GLY A 72 5.607 -21.899 17.474 1.00 0.00 H new ATOM 0 HA2 GLY A 72 7.415 -20.782 16.712 1.00 0.00 H new ATOM 0 HA3 GLY A 72 7.170 -21.662 15.216 1.00 0.00 H new ATOM 893 N GLU A 78 5.559 -11.598 27.961 1.00 0.00 N ATOM 894 CA GLU A 78 4.393 -11.513 28.833 1.00 0.00 C ATOM 895 C GLU A 78 3.522 -10.321 28.449 1.00 0.00 C ATOM 896 O GLU A 78 2.361 -10.483 28.075 1.00 0.00 O ATOM 897 CB GLU A 78 4.839 -11.374 30.290 1.00 0.00 C ATOM 898 CG GLU A 78 5.528 -12.665 30.738 1.00 0.00 C ATOM 899 CD GLU A 78 6.985 -12.661 30.289 1.00 0.00 C ATOM 900 OE1 GLU A 78 7.366 -11.738 29.589 1.00 0.00 O ATOM 901 OE2 GLU A 78 7.698 -13.583 30.651 1.00 0.00 O ATOM 0 HA GLU A 78 3.809 -12.426 28.718 1.00 0.00 H new ATOM 0 HB2 GLU A 78 5.521 -10.530 30.394 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.979 -11.168 30.927 1.00 0.00 H new ATOM 0 HG2 GLU A 78 5.473 -12.759 31.823 1.00 0.00 H new ATOM 0 HG3 GLU A 78 5.011 -13.528 30.317 1.00 0.00 H new ATOM 908 N SER A 79 4.102 -9.136 28.536 1.00 0.00 N ATOM 909 CA SER A 79 3.401 -7.906 28.185 1.00 0.00 C ATOM 910 C SER A 79 2.828 -8.000 26.774 1.00 0.00 C ATOM 911 O SER A 79 1.638 -7.770 26.561 1.00 0.00 O ATOM 912 CB SER A 79 4.358 -6.717 28.271 1.00 0.00 C ATOM 913 OG SER A 79 3.777 -5.598 27.613 1.00 0.00 O ATOM 0 H SER A 79 5.063 -8.996 28.849 1.00 0.00 H new ATOM 0 HA SER A 79 2.581 -7.763 28.889 1.00 0.00 H new ATOM 0 HB2 SER A 79 4.562 -6.475 29.314 1.00 0.00 H new ATOM 0 HB3 SER A 79 5.313 -6.970 27.810 1.00 0.00 H new ATOM 0 HG SER A 79 4.387 -4.833 27.667 1.00 0.00 H new ATOM 919 N ALA A 80 3.683 -8.338 25.815 1.00 0.00 N ATOM 920 CA ALA A 80 3.251 -8.459 24.427 1.00 0.00 C ATOM 921 C ALA A 80 2.108 -9.462 24.308 1.00 0.00 C ATOM 922 O ALA A 80 1.275 -9.364 23.406 1.00 0.00 O ATOM 923 CB ALA A 80 4.422 -8.910 23.553 1.00 0.00 C ATOM 0 H ALA A 80 4.672 -8.532 25.971 1.00 0.00 H new ATOM 0 HA ALA A 80 2.901 -7.484 24.088 1.00 0.00 H new ATOM 0 HB1 ALA A 80 4.091 -8.998 22.518 1.00 0.00 H new ATOM 0 HB2 ALA A 80 5.226 -8.177 23.616 1.00 0.00 H new ATOM 0 HB3 ALA A 80 4.785 -9.877 23.901 1.00 0.00 H new ATOM 929 N CYS A 81 2.074 -10.425 25.222 1.00 0.00 N ATOM 930 CA CYS A 81 1.028 -11.441 25.209 1.00 0.00 C ATOM 931 C CYS A 81 -0.304 -10.845 25.653 1.00 0.00 C ATOM 932 O CYS A 81 -1.350 -11.485 25.540 1.00 0.00 O ATOM 933 CB CYS A 81 1.408 -12.594 26.140 1.00 0.00 C ATOM 934 SG CYS A 81 0.309 -14.001 25.838 1.00 0.00 S ATOM 0 H CYS A 81 2.753 -10.524 25.976 1.00 0.00 H new ATOM 0 HA CYS A 81 0.924 -11.815 24.191 1.00 0.00 H new ATOM 0 HB2 CYS A 81 2.445 -12.886 25.971 1.00 0.00 H new ATOM 0 HB3 CYS A 81 1.332 -12.276 27.180 1.00 0.00 H new ATOM 0 HG CYS A 81 0.766 -15.049 26.457 1.00 0.00 H new ATOM 940 N ARG A 82 -0.258 -9.616 26.156 1.00 0.00 N ATOM 941 CA ARG A 82 -1.469 -8.943 26.614 1.00 0.00 C ATOM 942 C ARG A 82 -1.886 -7.860 25.624 1.00 0.00 C ATOM 943 O ARG A 82 -3.053 -7.473 25.568 1.00 0.00 O ATOM 944 CB ARG A 82 -1.230 -8.316 27.989 1.00 0.00 C ATOM 945 CG ARG A 82 -0.730 -9.388 28.959 1.00 0.00 C ATOM 946 CD ARG A 82 -1.911 -9.956 29.747 1.00 0.00 C ATOM 947 NE ARG A 82 -2.533 -8.908 30.548 1.00 0.00 N ATOM 948 CZ ARG A 82 -2.040 -8.566 31.734 1.00 0.00 C ATOM 949 NH1 ARG A 82 -2.614 -7.626 32.433 1.00 0.00 N ATOM 950 NH2 ARG A 82 -0.981 -9.171 32.199 1.00 0.00 N ATOM 0 H ARG A 82 0.597 -9.069 26.257 1.00 0.00 H new ATOM 0 HA ARG A 82 -2.268 -9.681 26.686 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -0.499 -7.511 27.911 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.153 -7.873 28.364 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -0.229 -10.185 28.410 1.00 0.00 H new ATOM 0 HG3 ARG A 82 0.005 -8.961 29.642 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -2.643 -10.383 29.062 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -1.571 -10.765 30.394 1.00 0.00 H new ATOM 0 HE ARG A 82 -3.360 -8.429 30.192 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -3.441 -7.153 32.069 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -2.235 -7.364 33.343 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -0.532 -9.906 31.652 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -0.602 -8.909 33.109 1.00 0.00 H new ATOM 964 N ASN A 83 -0.924 -7.374 24.846 1.00 0.00 N ATOM 965 CA ASN A 83 -1.204 -6.334 23.862 1.00 0.00 C ATOM 966 C ASN A 83 -1.684 -6.951 22.552 1.00 0.00 C ATOM 967 O ASN A 83 -2.668 -6.499 21.966 1.00 0.00 O ATOM 968 CB ASN A 83 0.056 -5.505 23.606 1.00 0.00 C ATOM 969 CG ASN A 83 0.541 -4.879 24.909 1.00 0.00 C ATOM 970 OD1 ASN A 83 -0.266 -4.422 25.718 1.00 0.00 O ATOM 971 ND2 ASN A 83 1.821 -4.829 25.161 1.00 0.00 N ATOM 0 H ASN A 83 0.048 -7.680 24.877 1.00 0.00 H new ATOM 0 HA ASN A 83 -1.989 -5.689 24.256 1.00 0.00 H new ATOM 0 HB2 ASN A 83 0.837 -6.137 23.183 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -0.154 -4.725 22.874 1.00 0.00 H new ATOM 0 HD21 ASN A 83 2.154 -4.411 26.030 1.00 0.00 H new ATOM 0 HD22 ASN A 83 2.488 -5.208 24.489 1.00 0.00 H new ATOM 978 N GLN A 84 -0.983 -7.986 22.099 1.00 0.00 N ATOM 979 CA GLN A 84 -1.347 -8.657 20.857 1.00 0.00 C ATOM 980 C GLN A 84 -2.781 -9.174 20.926 1.00 0.00 C ATOM 981 O GLN A 84 -3.639 -8.759 20.147 1.00 0.00 O ATOM 982 CB GLN A 84 -0.394 -9.825 20.595 1.00 0.00 C ATOM 983 CG GLN A 84 0.990 -9.283 20.234 1.00 0.00 C ATOM 984 CD GLN A 84 1.959 -10.438 20.005 1.00 0.00 C ATOM 985 OE1 GLN A 84 2.362 -11.109 20.955 1.00 0.00 O ATOM 986 NE2 GLN A 84 2.358 -10.712 18.793 1.00 0.00 N ATOM 0 H GLN A 84 -0.166 -8.375 22.569 1.00 0.00 H new ATOM 0 HA GLN A 84 -1.272 -7.937 20.042 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.328 -10.460 21.479 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -0.776 -10.445 19.784 1.00 0.00 H new ATOM 0 HG2 GLN A 84 0.926 -8.668 19.336 1.00 0.00 H new ATOM 0 HG3 GLN A 84 1.359 -8.642 21.034 1.00 0.00 H new ATOM 0 HE21 GLN A 84 2.023 -10.155 18.007 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.005 -11.484 18.631 1.00 0.00 H new ATOM 995 N ILE A 85 -3.032 -10.081 21.864 1.00 0.00 N ATOM 996 CA ILE A 85 -4.366 -10.649 22.025 1.00 0.00 C ATOM 997 C ILE A 85 -5.401 -9.544 22.212 1.00 0.00 C ATOM 998 O ILE A 85 -6.510 -9.623 21.684 1.00 0.00 O ATOM 999 CB ILE A 85 -4.392 -11.584 23.236 1.00 0.00 C ATOM 1000 CG1 ILE A 85 -3.306 -12.651 23.078 1.00 0.00 C ATOM 1001 CG2 ILE A 85 -5.761 -12.261 23.329 1.00 0.00 C ATOM 1002 CD1 ILE A 85 -3.241 -13.505 24.345 1.00 0.00 C ATOM 0 H ILE A 85 -2.336 -10.436 22.519 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.611 -11.212 21.125 1.00 0.00 H new ATOM 0 HB ILE A 85 -4.209 -11.009 24.144 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -3.522 -13.279 22.214 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -2.341 -12.178 22.895 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -5.780 -12.927 24.192 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -6.535 -11.502 23.440 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -5.944 -12.837 22.422 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -2.468 -14.265 24.232 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -3.005 -12.871 25.200 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -4.204 -13.989 24.507 1.00 0.00 H new ATOM 1014 N ILE A 86 -5.030 -8.514 22.966 1.00 0.00 N ATOM 1015 CA ILE A 86 -5.936 -7.398 23.216 1.00 0.00 C ATOM 1016 C ILE A 86 -6.271 -6.677 21.914 1.00 0.00 C ATOM 1017 O ILE A 86 -7.429 -6.349 21.656 1.00 0.00 O ATOM 1018 CB ILE A 86 -5.293 -6.414 24.195 1.00 0.00 C ATOM 1019 CG1 ILE A 86 -5.721 -6.765 25.623 1.00 0.00 C ATOM 1020 CG2 ILE A 86 -5.747 -4.992 23.863 1.00 0.00 C ATOM 1021 CD1 ILE A 86 -5.275 -5.655 26.576 1.00 0.00 C ATOM 0 H ILE A 86 -4.116 -8.429 23.411 1.00 0.00 H new ATOM 0 HA ILE A 86 -6.857 -7.791 23.647 1.00 0.00 H new ATOM 0 HB ILE A 86 -4.208 -6.477 24.113 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -6.803 -6.887 25.670 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -5.280 -7.716 25.923 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -5.289 -4.291 24.561 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -5.445 -4.742 22.846 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -6.832 -4.928 23.945 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -5.579 -5.904 27.593 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -4.190 -5.555 26.536 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.737 -4.713 26.279 1.00 0.00 H new ATOM 1033 N SER A 87 -5.250 -6.433 21.099 1.00 0.00 N ATOM 1034 CA SER A 87 -5.449 -5.749 19.826 1.00 0.00 C ATOM 1035 C SER A 87 -6.448 -6.508 18.959 1.00 0.00 C ATOM 1036 O SER A 87 -7.350 -5.914 18.368 1.00 0.00 O ATOM 1037 CB SER A 87 -4.117 -5.628 19.086 1.00 0.00 C ATOM 1038 OG SER A 87 -4.366 -5.341 17.716 1.00 0.00 O ATOM 0 H SER A 87 -4.284 -6.696 21.295 1.00 0.00 H new ATOM 0 HA SER A 87 -5.845 -4.754 20.028 1.00 0.00 H new ATOM 0 HB2 SER A 87 -3.511 -4.839 19.531 1.00 0.00 H new ATOM 0 HB3 SER A 87 -3.551 -6.555 19.178 1.00 0.00 H new ATOM 0 HG SER A 87 -3.514 -5.261 17.238 1.00 0.00 H new ATOM 1044 N ILE A 88 -6.282 -7.825 18.887 1.00 0.00 N ATOM 1045 CA ILE A 88 -7.175 -8.656 18.088 1.00 0.00 C ATOM 1046 C ILE A 88 -8.625 -8.446 18.512 1.00 0.00 C ATOM 1047 O ILE A 88 -9.544 -8.578 17.703 1.00 0.00 O ATOM 1048 CB ILE A 88 -6.802 -10.130 18.251 1.00 0.00 C ATOM 1049 CG1 ILE A 88 -5.351 -10.339 17.812 1.00 0.00 C ATOM 1050 CG2 ILE A 88 -7.724 -10.989 17.385 1.00 0.00 C ATOM 1051 CD1 ILE A 88 -4.909 -11.760 18.168 1.00 0.00 C ATOM 0 H ILE A 88 -5.543 -8.337 19.369 1.00 0.00 H new ATOM 0 HA ILE A 88 -7.069 -8.368 17.042 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.912 -10.419 19.296 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.258 -10.176 16.738 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -4.703 -9.612 18.302 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -7.458 -12.040 17.501 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -8.758 -10.840 17.696 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -7.614 -10.701 16.340 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -3.875 -11.909 17.855 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -4.987 -11.906 19.245 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -5.550 -12.479 17.657 1.00 0.00 H new ATOM 1063 N MET A 89 -8.823 -8.120 19.785 1.00 0.00 N ATOM 1064 CA MET A 89 -10.167 -7.895 20.305 1.00 0.00 C ATOM 1065 C MET A 89 -10.771 -6.630 19.704 1.00 0.00 C ATOM 1066 O MET A 89 -11.870 -6.658 19.150 1.00 0.00 O ATOM 1067 CB MET A 89 -10.122 -7.767 21.829 1.00 0.00 C ATOM 1068 CG MET A 89 -9.679 -9.097 22.441 1.00 0.00 C ATOM 1069 SD MET A 89 -10.911 -10.371 22.075 1.00 0.00 S ATOM 1070 CE MET A 89 -12.203 -9.763 23.186 1.00 0.00 C ATOM 0 H MET A 89 -8.077 -8.006 20.471 1.00 0.00 H new ATOM 0 HA MET A 89 -10.790 -8.746 20.030 1.00 0.00 H new ATOM 0 HB2 MET A 89 -9.432 -6.974 22.118 1.00 0.00 H new ATOM 0 HB3 MET A 89 -11.105 -7.489 22.210 1.00 0.00 H new ATOM 0 HG2 MET A 89 -8.709 -9.389 22.040 1.00 0.00 H new ATOM 0 HG3 MET A 89 -9.559 -8.991 23.519 1.00 0.00 H new ATOM 0 HE1 MET A 89 -12.858 -10.587 23.468 1.00 0.00 H new ATOM 0 HE2 MET A 89 -11.745 -9.342 24.081 1.00 0.00 H new ATOM 0 HE3 MET A 89 -12.785 -8.993 22.680 1.00 0.00 H new ATOM 1080 N ARG A 90 -10.045 -5.523 19.817 1.00 0.00 N ATOM 1081 CA ARG A 90 -10.520 -4.252 19.281 1.00 0.00 C ATOM 1082 C ARG A 90 -11.021 -4.427 17.851 1.00 0.00 C ATOM 1083 O ARG A 90 -12.053 -3.872 17.473 1.00 0.00 O ATOM 1084 CB ARG A 90 -9.390 -3.221 19.305 1.00 0.00 C ATOM 1085 CG ARG A 90 -9.930 -1.862 18.855 1.00 0.00 C ATOM 1086 CD ARG A 90 -8.783 -0.852 18.792 1.00 0.00 C ATOM 1087 NE ARG A 90 -7.860 -1.202 17.718 1.00 0.00 N ATOM 1088 CZ ARG A 90 -6.831 -0.419 17.413 1.00 0.00 C ATOM 1089 NH1 ARG A 90 -6.019 -0.754 16.448 1.00 0.00 N ATOM 1090 NH2 ARG A 90 -6.632 0.685 18.080 1.00 0.00 N ATOM 0 H ARG A 90 -9.133 -5.479 20.271 1.00 0.00 H new ATOM 0 HA ARG A 90 -11.345 -3.902 19.902 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -8.974 -3.145 20.310 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -8.580 -3.538 18.648 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -10.403 -1.953 17.877 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -10.696 -1.515 19.549 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -9.180 0.150 18.628 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -8.253 -0.833 19.744 1.00 0.00 H new ATOM 0 HE ARG A 90 -8.007 -2.063 17.192 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -6.174 -1.617 15.927 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -5.229 -0.152 16.214 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -7.266 0.946 18.835 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -5.842 1.287 17.846 1.00 0.00 H new ATOM 1104 N VAL A 91 -10.284 -5.200 17.060 1.00 0.00 N ATOM 1105 CA VAL A 91 -10.664 -5.440 15.673 1.00 0.00 C ATOM 1106 C VAL A 91 -11.918 -6.305 15.601 1.00 0.00 C ATOM 1107 O VAL A 91 -12.788 -6.086 14.759 1.00 0.00 O ATOM 1108 CB VAL A 91 -9.520 -6.133 14.931 1.00 0.00 C ATOM 1109 CG1 VAL A 91 -8.185 -5.531 15.373 1.00 0.00 C ATOM 1110 CG2 VAL A 91 -9.536 -7.629 15.256 1.00 0.00 C ATOM 0 H VAL A 91 -9.426 -5.668 17.353 1.00 0.00 H new ATOM 0 HA VAL A 91 -10.873 -4.479 15.203 1.00 0.00 H new ATOM 0 HB VAL A 91 -9.644 -5.991 13.857 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -7.370 -6.025 14.844 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -8.173 -4.465 15.144 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -8.059 -5.673 16.446 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -8.721 -8.125 14.728 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -9.411 -7.769 16.330 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -10.487 -8.059 14.942 1.00 0.00 H new ATOM 1120 N TYR A 92 -12.003 -7.290 16.490 1.00 0.00 N ATOM 1121 CA TYR A 92 -13.155 -8.183 16.518 1.00 0.00 C ATOM 1122 C TYR A 92 -14.425 -7.410 16.859 1.00 0.00 C ATOM 1123 O TYR A 92 -15.484 -7.649 16.278 1.00 0.00 O ATOM 1124 CB TYR A 92 -12.935 -9.288 17.552 1.00 0.00 C ATOM 1125 CG TYR A 92 -14.191 -10.116 17.680 1.00 0.00 C ATOM 1126 CD1 TYR A 92 -14.521 -11.046 16.687 1.00 0.00 C ATOM 1127 CD2 TYR A 92 -15.026 -9.954 18.793 1.00 0.00 C ATOM 1128 CE1 TYR A 92 -15.686 -11.813 16.806 1.00 0.00 C ATOM 1129 CE2 TYR A 92 -16.190 -10.721 18.912 1.00 0.00 C ATOM 1130 CZ TYR A 92 -16.521 -11.651 17.918 1.00 0.00 C ATOM 1131 OH TYR A 92 -17.669 -12.408 18.036 1.00 0.00 O ATOM 0 H TYR A 92 -11.293 -7.489 17.195 1.00 0.00 H new ATOM 0 HA TYR A 92 -13.269 -8.628 15.530 1.00 0.00 H new ATOM 0 HB2 TYR A 92 -12.099 -9.920 17.252 1.00 0.00 H new ATOM 0 HB3 TYR A 92 -12.675 -8.852 18.516 1.00 0.00 H new ATOM 0 HD1 TYR A 92 -13.877 -11.172 15.829 1.00 0.00 H new ATOM 0 HD2 TYR A 92 -14.771 -9.237 19.559 1.00 0.00 H new ATOM 0 HE1 TYR A 92 -15.941 -12.530 16.040 1.00 0.00 H new ATOM 0 HE2 TYR A 92 -16.833 -10.596 19.770 1.00 0.00 H new ATOM 0 HH TYR A 92 -18.133 -12.172 18.866 1.00 0.00 H new ATOM 1141 N GLU A 93 -14.312 -6.484 17.805 1.00 0.00 N ATOM 1142 CA GLU A 93 -15.458 -5.682 18.216 1.00 0.00 C ATOM 1143 C GLU A 93 -15.794 -4.641 17.153 1.00 0.00 C ATOM 1144 O GLU A 93 -16.962 -4.336 16.915 1.00 0.00 O ATOM 1145 CB GLU A 93 -15.157 -4.980 19.542 1.00 0.00 C ATOM 1146 CG GLU A 93 -14.991 -6.026 20.646 1.00 0.00 C ATOM 1147 CD GLU A 93 -16.301 -6.777 20.855 1.00 0.00 C ATOM 1148 OE1 GLU A 93 -17.328 -6.264 20.440 1.00 0.00 O ATOM 1149 OE2 GLU A 93 -16.259 -7.854 21.426 1.00 0.00 O ATOM 0 H GLU A 93 -13.445 -6.271 18.298 1.00 0.00 H new ATOM 0 HA GLU A 93 -16.314 -6.345 18.342 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -14.249 -4.383 19.452 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -15.966 -4.294 19.795 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -14.200 -6.726 20.379 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -14.688 -5.542 21.574 1.00 0.00 H new ATOM 1156 N GLN A 94 -14.761 -4.098 16.516 1.00 0.00 N ATOM 1157 CA GLN A 94 -14.958 -3.092 15.479 1.00 0.00 C ATOM 1158 C GLN A 94 -15.684 -3.692 14.280 1.00 0.00 C ATOM 1159 O GLN A 94 -16.716 -3.179 13.846 1.00 0.00 O ATOM 1160 CB GLN A 94 -13.607 -2.530 15.032 1.00 0.00 C ATOM 1161 CG GLN A 94 -13.122 -1.495 16.049 1.00 0.00 C ATOM 1162 CD GLN A 94 -11.715 -1.030 15.689 1.00 0.00 C ATOM 1163 OE1 GLN A 94 -11.161 -1.453 14.674 1.00 0.00 O ATOM 1164 NE2 GLN A 94 -11.100 -0.180 16.465 1.00 0.00 N ATOM 0 H GLN A 94 -13.786 -4.336 16.698 1.00 0.00 H new ATOM 0 HA GLN A 94 -15.567 -2.288 15.892 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -12.878 -3.336 14.942 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -13.700 -2.072 14.047 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -13.802 -0.643 16.066 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -13.126 -1.927 17.050 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -11.561 0.169 17.305 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -10.159 0.135 16.231 1.00 0.00 H new ATOM 1173 N ARG A 95 -15.138 -4.780 13.747 1.00 0.00 N ATOM 1174 CA ARG A 95 -15.743 -5.441 12.597 1.00 0.00 C ATOM 1175 C ARG A 95 -17.045 -6.127 12.996 1.00 0.00 C ATOM 1176 O ARG A 95 -17.801 -6.591 12.142 1.00 0.00 O ATOM 1177 CB ARG A 95 -14.775 -6.477 12.021 1.00 0.00 C ATOM 1178 CG ARG A 95 -13.808 -5.790 11.054 1.00 0.00 C ATOM 1179 CD ARG A 95 -12.894 -6.837 10.417 1.00 0.00 C ATOM 1180 NE ARG A 95 -11.978 -6.202 9.475 1.00 0.00 N ATOM 1181 CZ ARG A 95 -12.322 -6.011 8.206 1.00 0.00 C ATOM 1182 NH1 ARG A 95 -11.485 -5.440 7.382 1.00 0.00 N ATOM 1183 NH2 ARG A 95 -13.495 -6.395 7.782 1.00 0.00 N ATOM 0 H ARG A 95 -14.284 -5.220 14.090 1.00 0.00 H new ATOM 0 HA ARG A 95 -15.960 -4.686 11.841 1.00 0.00 H new ATOM 0 HB2 ARG A 95 -14.220 -6.959 12.826 1.00 0.00 H new ATOM 0 HB3 ARG A 95 -15.329 -7.260 11.503 1.00 0.00 H new ATOM 0 HG2 ARG A 95 -14.365 -5.260 10.282 1.00 0.00 H new ATOM 0 HG3 ARG A 95 -13.213 -5.047 11.585 1.00 0.00 H new ATOM 0 HD2 ARG A 95 -12.329 -7.356 11.191 1.00 0.00 H new ATOM 0 HD3 ARG A 95 -13.493 -7.588 9.902 1.00 0.00 H new ATOM 0 HE ARG A 95 -11.058 -5.900 9.796 1.00 0.00 H new ATOM 0 HH11 ARG A 95 -10.568 -5.141 7.713 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -11.749 -5.293 6.408 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -14.148 -6.842 8.425 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -13.758 -6.248 6.808 1.00 0.00 H new ATOM 1197 N LEU A 96 -17.302 -6.187 14.299 1.00 0.00 N ATOM 1198 CA LEU A 96 -18.517 -6.820 14.799 1.00 0.00 C ATOM 1199 C LEU A 96 -19.697 -5.856 14.714 1.00 0.00 C ATOM 1200 O LEU A 96 -20.829 -6.267 14.461 1.00 0.00 O ATOM 1201 CB LEU A 96 -18.318 -7.258 16.251 1.00 0.00 C ATOM 1202 CG LEU A 96 -19.638 -7.789 16.810 1.00 0.00 C ATOM 1203 CD1 LEU A 96 -20.154 -8.919 15.917 1.00 0.00 C ATOM 1204 CD2 LEU A 96 -19.413 -8.324 18.226 1.00 0.00 C ATOM 0 H LEU A 96 -16.691 -5.808 15.022 1.00 0.00 H new ATOM 0 HA LEU A 96 -18.730 -7.693 14.182 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -17.551 -8.030 16.307 1.00 0.00 H new ATOM 0 HB3 LEU A 96 -17.969 -6.417 16.851 1.00 0.00 H new ATOM 0 HG LEU A 96 -20.371 -6.983 16.836 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -21.095 -9.297 16.316 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -20.314 -8.541 14.907 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -19.421 -9.725 15.890 1.00 0.00 H new ATOM 0 HD21 LEU A 96 -20.354 -8.703 18.626 1.00 0.00 H new ATOM 0 HD22 LEU A 96 -18.680 -9.130 18.198 1.00 0.00 H new ATOM 0 HD23 LEU A 96 -19.045 -7.521 18.864 1.00 0.00 H new ATOM 1216 N ALA A 97 -19.423 -4.573 14.927 1.00 0.00 N ATOM 1217 CA ALA A 97 -20.470 -3.560 14.872 1.00 0.00 C ATOM 1218 C ALA A 97 -20.724 -3.129 13.431 1.00 0.00 C ATOM 1219 O ALA A 97 -21.831 -2.720 13.082 1.00 0.00 O ATOM 1220 CB ALA A 97 -20.064 -2.344 15.707 1.00 0.00 C ATOM 0 H ALA A 97 -18.492 -4.212 15.138 1.00 0.00 H new ATOM 0 HA ALA A 97 -21.386 -3.989 15.277 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -20.851 -1.592 15.661 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -19.913 -2.648 16.743 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -19.138 -1.925 15.313 1.00 0.00 H new ATOM 1226 N HIS A 98 -19.691 -3.223 12.600 1.00 0.00 N ATOM 1227 CA HIS A 98 -19.811 -2.829 11.201 1.00 0.00 C ATOM 1228 C HIS A 98 -20.571 -3.887 10.409 1.00 0.00 C ATOM 1229 O HIS A 98 -20.271 -5.078 10.499 1.00 0.00 O ATOM 1230 CB HIS A 98 -18.421 -2.634 10.593 1.00 0.00 C ATOM 1231 CG HIS A 98 -17.796 -1.388 11.159 1.00 0.00 C ATOM 1232 ND1 HIS A 98 -17.161 -1.374 12.391 1.00 0.00 N ATOM 1233 CD2 HIS A 98 -17.700 -0.108 10.674 1.00 0.00 C ATOM 1234 CE1 HIS A 98 -16.715 -0.123 12.604 1.00 0.00 C ATOM 1235 NE2 HIS A 98 -17.017 0.690 11.588 1.00 0.00 N ATOM 0 H HIS A 98 -18.768 -3.566 12.868 1.00 0.00 H new ATOM 0 HA HIS A 98 -20.363 -1.891 11.154 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -17.793 -3.499 10.809 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -18.495 -2.556 9.508 1.00 0.00 H new ATOM 0 HD1 HIS A 98 -17.052 -2.168 13.022 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -18.094 0.229 9.727 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -16.178 0.186 13.489 1.00 0.00 H new ATOM 1343 N THR A 105 -18.036 -13.461 2.489 1.00 0.00 N ATOM 1344 CA THR A 105 -17.422 -14.014 3.692 1.00 0.00 C ATOM 1345 C THR A 105 -16.289 -14.966 3.325 1.00 0.00 C ATOM 1346 O THR A 105 -16.150 -15.366 2.169 1.00 0.00 O ATOM 1347 CB THR A 105 -18.472 -14.760 4.518 1.00 0.00 C ATOM 1348 OG1 THR A 105 -18.712 -16.034 3.936 1.00 0.00 O ATOM 1349 CG2 THR A 105 -19.772 -13.955 4.542 1.00 0.00 C ATOM 0 HA THR A 105 -17.014 -13.192 4.281 1.00 0.00 H new ATOM 0 HB THR A 105 -18.109 -14.888 5.538 1.00 0.00 H new ATOM 0 HG1 THR A 105 -19.383 -16.514 4.465 1.00 0.00 H new ATOM 0 HG21 THR A 105 -20.519 -14.488 5.131 1.00 0.00 H new ATOM 0 HG22 THR A 105 -19.587 -12.978 4.989 1.00 0.00 H new ATOM 0 HG23 THR A 105 -20.138 -13.825 3.524 1.00 0.00 H new ATOM 1357 N THR A 106 -15.481 -15.325 4.317 1.00 0.00 N ATOM 1358 CA THR A 106 -14.364 -16.235 4.088 1.00 0.00 C ATOM 1359 C THR A 106 -14.231 -17.221 5.244 1.00 0.00 C ATOM 1360 O THR A 106 -14.746 -16.987 6.338 1.00 0.00 O ATOM 1361 CB THR A 106 -13.065 -15.441 3.940 1.00 0.00 C ATOM 1362 OG1 THR A 106 -13.231 -14.153 4.518 1.00 0.00 O ATOM 1363 CG2 THR A 106 -12.718 -15.296 2.458 1.00 0.00 C ATOM 0 H THR A 106 -15.577 -15.003 5.280 1.00 0.00 H new ATOM 0 HA THR A 106 -14.555 -16.792 3.171 1.00 0.00 H new ATOM 0 HB THR A 106 -12.258 -15.967 4.449 1.00 0.00 H new ATOM 0 HG1 THR A 106 -13.405 -13.497 3.811 1.00 0.00 H new ATOM 0 HG21 THR A 106 -11.792 -14.730 2.355 1.00 0.00 H new ATOM 0 HG22 THR A 106 -12.590 -16.284 2.016 1.00 0.00 H new ATOM 0 HG23 THR A 106 -13.524 -14.770 1.945 1.00 0.00 H new ATOM 1371 N PRO A 107 -13.573 -18.331 5.023 1.00 0.00 N ATOM 1372 CA PRO A 107 -13.391 -19.380 6.067 1.00 0.00 C ATOM 1373 C PRO A 107 -12.402 -18.950 7.147 1.00 0.00 C ATOM 1374 O PRO A 107 -12.590 -19.247 8.327 1.00 0.00 O ATOM 1375 CB PRO A 107 -12.858 -20.582 5.285 1.00 0.00 C ATOM 1376 CG PRO A 107 -12.217 -20.010 4.063 1.00 0.00 C ATOM 1377 CD PRO A 107 -12.930 -18.701 3.753 1.00 0.00 C ATOM 0 HA PRO A 107 -14.318 -19.591 6.601 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -12.139 -21.148 5.877 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -13.664 -21.267 5.021 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -11.154 -19.839 4.230 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -12.301 -20.702 3.225 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -12.229 -17.934 3.423 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -13.664 -18.826 2.957 1.00 0.00 H new ATOM 1385 N GLU A 108 -11.350 -18.250 6.735 1.00 0.00 N ATOM 1386 CA GLU A 108 -10.338 -17.785 7.677 1.00 0.00 C ATOM 1387 C GLU A 108 -10.920 -16.726 8.608 1.00 0.00 C ATOM 1388 O GLU A 108 -10.777 -16.812 9.828 1.00 0.00 O ATOM 1389 CB GLU A 108 -9.147 -17.200 6.916 1.00 0.00 C ATOM 1390 CG GLU A 108 -8.450 -18.309 6.126 1.00 0.00 C ATOM 1391 CD GLU A 108 -9.113 -18.472 4.762 1.00 0.00 C ATOM 1392 OE1 GLU A 108 -10.112 -17.813 4.529 1.00 0.00 O ATOM 1393 OE2 GLU A 108 -8.611 -19.254 3.972 1.00 0.00 O ATOM 0 H GLU A 108 -11.176 -17.994 5.763 1.00 0.00 H new ATOM 0 HA GLU A 108 -10.006 -18.634 8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -9.485 -16.415 6.240 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -8.447 -16.741 7.614 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -7.394 -18.069 6.000 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -8.500 -19.247 6.679 1.00 0.00 H new ATOM 1400 N GLU A 109 -11.577 -15.729 8.025 1.00 0.00 N ATOM 1401 CA GLU A 109 -12.176 -14.658 8.813 1.00 0.00 C ATOM 1402 C GLU A 109 -13.273 -15.209 9.719 1.00 0.00 C ATOM 1403 O GLU A 109 -13.483 -14.716 10.827 1.00 0.00 O ATOM 1404 CB GLU A 109 -12.765 -13.593 7.886 1.00 0.00 C ATOM 1405 CG GLU A 109 -14.005 -14.154 7.187 1.00 0.00 C ATOM 1406 CD GLU A 109 -14.638 -13.080 6.308 1.00 0.00 C ATOM 1407 OE1 GLU A 109 -13.896 -12.315 5.714 1.00 0.00 O ATOM 1408 OE2 GLU A 109 -15.855 -13.038 6.242 1.00 0.00 O ATOM 0 H GLU A 109 -11.708 -15.640 7.017 1.00 0.00 H new ATOM 0 HA GLU A 109 -11.399 -14.210 9.432 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -13.028 -12.703 8.458 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -12.024 -13.289 7.147 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -13.732 -15.017 6.581 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -14.725 -14.500 7.928 1.00 0.00 H new ATOM 1415 N ASP A 110 -13.969 -16.235 9.240 1.00 0.00 N ATOM 1416 CA ASP A 110 -15.042 -16.846 10.015 1.00 0.00 C ATOM 1417 C ASP A 110 -14.482 -17.534 11.256 1.00 0.00 C ATOM 1418 O ASP A 110 -14.995 -17.357 12.361 1.00 0.00 O ATOM 1419 CB ASP A 110 -15.791 -17.867 9.157 1.00 0.00 C ATOM 1420 CG ASP A 110 -16.862 -17.166 8.329 1.00 0.00 C ATOM 1421 OD1 ASP A 110 -17.048 -15.976 8.522 1.00 0.00 O ATOM 1422 OD2 ASP A 110 -17.481 -17.830 7.513 1.00 0.00 O ATOM 0 H ASP A 110 -13.811 -16.658 8.325 1.00 0.00 H new ATOM 0 HA ASP A 110 -15.730 -16.061 10.328 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -15.092 -18.385 8.500 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -16.249 -18.623 9.794 1.00 0.00 H new ATOM 1427 N GLU A 111 -13.426 -18.319 11.065 1.00 0.00 N ATOM 1428 CA GLU A 111 -12.804 -19.029 12.176 1.00 0.00 C ATOM 1429 C GLU A 111 -12.345 -18.047 13.249 1.00 0.00 C ATOM 1430 O GLU A 111 -12.679 -18.197 14.425 1.00 0.00 O ATOM 1431 CB GLU A 111 -11.606 -19.837 11.675 1.00 0.00 C ATOM 1432 CG GLU A 111 -11.001 -20.629 12.836 1.00 0.00 C ATOM 1433 CD GLU A 111 -9.830 -21.470 12.340 1.00 0.00 C ATOM 1434 OE1 GLU A 111 -9.396 -21.244 11.223 1.00 0.00 O ATOM 1435 OE2 GLU A 111 -9.384 -22.327 13.085 1.00 0.00 O ATOM 0 H GLU A 111 -12.986 -18.478 10.159 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.541 -19.705 12.609 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -11.918 -20.516 10.882 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.858 -19.170 11.247 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -10.664 -19.946 13.616 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.759 -21.273 13.282 1.00 0.00 H new ATOM 1442 N LEU A 112 -11.580 -17.043 12.837 1.00 0.00 N ATOM 1443 CA LEU A 112 -11.081 -16.041 13.772 1.00 0.00 C ATOM 1444 C LEU A 112 -12.228 -15.449 14.584 1.00 0.00 C ATOM 1445 O LEU A 112 -12.120 -15.282 15.799 1.00 0.00 O ATOM 1446 CB LEU A 112 -10.363 -14.926 13.010 1.00 0.00 C ATOM 1447 CG LEU A 112 -9.868 -13.869 13.998 1.00 0.00 C ATOM 1448 CD1 LEU A 112 -8.940 -14.523 15.024 1.00 0.00 C ATOM 1449 CD2 LEU A 112 -9.102 -12.782 13.240 1.00 0.00 C ATOM 0 H LEU A 112 -11.293 -16.901 11.869 1.00 0.00 H new ATOM 0 HA LEU A 112 -10.380 -16.524 14.453 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.523 -15.337 12.450 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -11.039 -14.473 12.285 1.00 0.00 H new ATOM 0 HG LEU A 112 -10.721 -13.424 14.511 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -8.587 -13.769 15.728 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.484 -15.298 15.564 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -8.087 -14.968 14.512 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.749 -12.028 13.943 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.250 -13.228 12.727 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -9.761 -12.315 12.509 1.00 0.00 H new ATOM 1461 N ASP A 113 -13.326 -15.134 13.905 1.00 0.00 N ATOM 1462 CA ASP A 113 -14.488 -14.560 14.574 1.00 0.00 C ATOM 1463 C ASP A 113 -15.006 -15.507 15.652 1.00 0.00 C ATOM 1464 O ASP A 113 -15.314 -15.085 16.766 1.00 0.00 O ATOM 1465 CB ASP A 113 -15.596 -14.289 13.555 1.00 0.00 C ATOM 1466 CG ASP A 113 -15.376 -12.932 12.895 1.00 0.00 C ATOM 1467 OD1 ASP A 113 -14.467 -12.233 13.312 1.00 0.00 O ATOM 1468 OD2 ASP A 113 -16.119 -12.612 11.981 1.00 0.00 O ATOM 0 H ASP A 113 -13.436 -15.265 12.899 1.00 0.00 H new ATOM 0 HA ASP A 113 -14.189 -13.622 15.042 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -15.606 -15.074 12.798 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -16.568 -14.310 14.048 1.00 0.00 H new ATOM 1473 N GLN A 114 -15.099 -16.789 15.312 1.00 0.00 N ATOM 1474 CA GLN A 114 -15.581 -17.787 16.259 1.00 0.00 C ATOM 1475 C GLN A 114 -14.654 -17.868 17.468 1.00 0.00 C ATOM 1476 O GLN A 114 -15.110 -17.870 18.612 1.00 0.00 O ATOM 1477 CB GLN A 114 -15.659 -19.156 15.581 1.00 0.00 C ATOM 1478 CG GLN A 114 -16.728 -19.124 14.486 1.00 0.00 C ATOM 1479 CD GLN A 114 -18.101 -18.890 15.106 1.00 0.00 C ATOM 1480 OE1 GLN A 114 -18.503 -19.612 16.018 1.00 0.00 O ATOM 1481 NE2 GLN A 114 -18.850 -17.917 14.662 1.00 0.00 N ATOM 0 H GLN A 114 -14.849 -17.159 14.395 1.00 0.00 H new ATOM 0 HA GLN A 114 -16.575 -17.492 16.595 1.00 0.00 H new ATOM 0 HB2 GLN A 114 -14.692 -19.417 15.152 1.00 0.00 H new ATOM 0 HB3 GLN A 114 -15.899 -19.924 16.316 1.00 0.00 H new ATOM 0 HG2 GLN A 114 -16.504 -18.334 13.770 1.00 0.00 H new ATOM 0 HG3 GLN A 114 -16.724 -20.064 13.935 1.00 0.00 H new ATOM 0 HE21 GLN A 114 -18.515 -17.320 13.906 1.00 0.00 H new ATOM 0 HE22 GLN A 114 -19.770 -17.754 15.071 1.00 0.00 H new ATOM 1490 N LEU A 115 -13.353 -17.935 17.206 1.00 0.00 N ATOM 1491 CA LEU A 115 -12.371 -18.015 18.282 1.00 0.00 C ATOM 1492 C LEU A 115 -12.501 -16.816 19.215 1.00 0.00 C ATOM 1493 O LEU A 115 -12.440 -16.959 20.437 1.00 0.00 O ATOM 1494 CB LEU A 115 -10.958 -18.058 17.697 1.00 0.00 C ATOM 1495 CG LEU A 115 -10.777 -19.346 16.893 1.00 0.00 C ATOM 1496 CD1 LEU A 115 -9.482 -19.266 16.083 1.00 0.00 C ATOM 1497 CD2 LEU A 115 -10.705 -20.538 17.850 1.00 0.00 C ATOM 0 H LEU A 115 -12.956 -17.936 16.266 1.00 0.00 H new ATOM 0 HA LEU A 115 -12.556 -18.926 18.851 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.791 -17.191 17.057 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.220 -18.010 18.498 1.00 0.00 H new ATOM 0 HG LEU A 115 -11.622 -19.472 16.216 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.354 -20.184 15.510 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -9.531 -18.417 15.401 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.637 -19.139 16.760 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.576 -21.457 17.278 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.860 -20.411 18.527 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.627 -20.597 18.428 1.00 0.00 H new ATOM 1509 N CYS A 116 -12.682 -15.636 18.633 1.00 0.00 N ATOM 1510 CA CYS A 116 -12.821 -14.418 19.423 1.00 0.00 C ATOM 1511 C CYS A 116 -14.070 -14.486 20.294 1.00 0.00 C ATOM 1512 O CYS A 116 -14.051 -14.079 21.456 1.00 0.00 O ATOM 1513 CB CYS A 116 -12.906 -13.202 18.499 1.00 0.00 C ATOM 1514 SG CYS A 116 -11.244 -12.750 17.942 1.00 0.00 S ATOM 0 H CYS A 116 -12.736 -15.497 17.624 1.00 0.00 H new ATOM 0 HA CYS A 116 -11.947 -14.323 20.067 1.00 0.00 H new ATOM 0 HB2 CYS A 116 -13.540 -13.427 17.641 1.00 0.00 H new ATOM 0 HB3 CYS A 116 -13.366 -12.364 19.024 1.00 0.00 H new ATOM 0 HG CYS A 116 -11.329 -12.028 16.864 1.00 0.00 H new ATOM 1520 N ASP A 117 -15.155 -15.002 19.726 1.00 0.00 N ATOM 1521 CA ASP A 117 -16.409 -15.119 20.461 1.00 0.00 C ATOM 1522 C ASP A 117 -16.233 -16.023 21.677 1.00 0.00 C ATOM 1523 O ASP A 117 -16.677 -15.694 22.777 1.00 0.00 O ATOM 1524 CB ASP A 117 -17.497 -15.690 19.551 1.00 0.00 C ATOM 1525 CG ASP A 117 -18.805 -15.825 20.323 1.00 0.00 C ATOM 1526 OD1 ASP A 117 -19.321 -14.809 20.758 1.00 0.00 O ATOM 1527 OD2 ASP A 117 -19.272 -16.943 20.468 1.00 0.00 O ATOM 0 H ASP A 117 -15.192 -15.344 18.766 1.00 0.00 H new ATOM 0 HA ASP A 117 -16.705 -14.126 20.800 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -17.640 -15.039 18.688 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -17.189 -16.663 19.168 1.00 0.00 H new ATOM 1532 N GLU A 118 -15.583 -17.164 21.471 1.00 0.00 N ATOM 1533 CA GLU A 118 -15.353 -18.108 22.558 1.00 0.00 C ATOM 1534 C GLU A 118 -14.496 -17.472 23.647 1.00 0.00 C ATOM 1535 O GLU A 118 -14.802 -17.580 24.834 1.00 0.00 O ATOM 1536 CB GLU A 118 -14.657 -19.361 22.023 1.00 0.00 C ATOM 1537 CG GLU A 118 -14.664 -20.448 23.100 1.00 0.00 C ATOM 1538 CD GLU A 118 -14.207 -21.775 22.504 1.00 0.00 C ATOM 1539 OE1 GLU A 118 -14.194 -21.883 21.289 1.00 0.00 O ATOM 1540 OE2 GLU A 118 -13.876 -22.664 23.272 1.00 0.00 O ATOM 0 H GLU A 118 -15.209 -17.456 20.568 1.00 0.00 H new ATOM 0 HA GLU A 118 -16.317 -18.384 22.986 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -15.166 -19.718 21.128 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -13.632 -19.126 21.735 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -14.006 -20.163 23.921 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -15.666 -20.553 23.516 1.00 0.00 H new ATOM 1547 N TRP A 119 -13.421 -16.808 23.234 1.00 0.00 N ATOM 1548 CA TRP A 119 -12.526 -16.157 24.183 1.00 0.00 C ATOM 1549 C TRP A 119 -13.248 -15.027 24.910 1.00 0.00 C ATOM 1550 O TRP A 119 -13.066 -14.832 26.112 1.00 0.00 O ATOM 1551 CB TRP A 119 -11.305 -15.598 23.451 1.00 0.00 C ATOM 1552 CG TRP A 119 -10.515 -14.737 24.385 1.00 0.00 C ATOM 1553 CD1 TRP A 119 -10.445 -13.387 24.325 1.00 0.00 C ATOM 1554 CD2 TRP A 119 -9.685 -15.141 25.512 1.00 0.00 C ATOM 1555 NE1 TRP A 119 -9.625 -12.937 25.344 1.00 0.00 N ATOM 1556 CE2 TRP A 119 -9.132 -13.980 26.103 1.00 0.00 C ATOM 1557 CE3 TRP A 119 -9.361 -16.389 26.073 1.00 0.00 C ATOM 1558 CZ2 TRP A 119 -8.288 -14.055 27.211 1.00 0.00 C ATOM 1559 CZ3 TRP A 119 -8.511 -16.468 27.188 1.00 0.00 C ATOM 1560 CH2 TRP A 119 -7.976 -15.303 27.756 1.00 0.00 C ATOM 0 H TRP A 119 -13.150 -16.707 22.256 1.00 0.00 H new ATOM 0 HA TRP A 119 -12.202 -16.897 24.915 1.00 0.00 H new ATOM 0 HB2 TRP A 119 -10.685 -16.414 23.079 1.00 0.00 H new ATOM 0 HB3 TRP A 119 -11.621 -15.018 22.584 1.00 0.00 H new ATOM 0 HD1 TRP A 119 -10.947 -12.763 23.600 1.00 0.00 H new ATOM 0 HE1 TRP A 119 -9.411 -11.954 25.514 1.00 0.00 H new ATOM 0 HE3 TRP A 119 -9.768 -17.292 25.644 1.00 0.00 H new ATOM 0 HZ2 TRP A 119 -7.879 -13.155 27.645 1.00 0.00 H new ATOM 0 HZ3 TRP A 119 -8.268 -17.432 27.611 1.00 0.00 H new ATOM 0 HH2 TRP A 119 -7.323 -15.370 28.614 1.00 0.00 H new ATOM 1571 N LYS A 120 -14.068 -14.285 24.172 1.00 0.00 N ATOM 1572 CA LYS A 120 -14.814 -13.177 24.757 1.00 0.00 C ATOM 1573 C LYS A 120 -15.765 -13.683 25.836 1.00 0.00 C ATOM 1574 O LYS A 120 -15.965 -13.028 26.859 1.00 0.00 O ATOM 1575 CB LYS A 120 -15.610 -12.451 23.671 1.00 0.00 C ATOM 1576 CG LYS A 120 -16.288 -11.219 24.271 1.00 0.00 C ATOM 1577 CD LYS A 120 -17.036 -10.462 23.172 1.00 0.00 C ATOM 1578 CE LYS A 120 -17.702 -9.220 23.769 1.00 0.00 C ATOM 1579 NZ LYS A 120 -18.415 -8.474 22.694 1.00 0.00 N ATOM 0 H LYS A 120 -14.232 -14.429 23.176 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.104 -12.485 25.210 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -14.948 -12.155 22.857 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.358 -13.120 23.246 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -16.981 -11.519 25.057 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -15.544 -10.570 24.733 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.345 -10.172 22.381 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.788 -11.108 22.718 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -18.403 -9.511 24.551 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -16.952 -8.580 24.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -18.708 -7.543 23.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -17.780 -8.347 21.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -19.255 -9.010 22.398 1.00 0.00 H new ATOM 1593 N ALA A 121 -16.350 -14.853 25.600 1.00 0.00 N ATOM 1594 CA ALA A 121 -17.279 -15.438 26.560 1.00 0.00 C ATOM 1595 C ALA A 121 -16.558 -15.792 27.856 1.00 0.00 C ATOM 1596 O ALA A 121 -17.058 -15.525 28.949 1.00 0.00 O ATOM 1597 CB ALA A 121 -17.917 -16.697 25.968 1.00 0.00 C ATOM 0 H ALA A 121 -16.199 -15.411 24.759 1.00 0.00 H new ATOM 0 HA ALA A 121 -18.056 -14.705 26.779 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -18.610 -17.128 26.691 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -18.458 -16.437 25.058 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -17.139 -17.423 25.733 1.00 0.00 H new ATOM 1603 N ARG A 122 -15.379 -16.392 27.726 1.00 0.00 N ATOM 1604 CA ARG A 122 -14.597 -16.777 28.895 1.00 0.00 C ATOM 1605 C ARG A 122 -14.261 -15.553 29.740 1.00 0.00 C ATOM 1606 O ARG A 122 -14.346 -15.592 30.968 1.00 0.00 O ATOM 1607 CB ARG A 122 -13.303 -17.466 28.454 1.00 0.00 C ATOM 1608 CG ARG A 122 -12.112 -16.818 29.162 1.00 0.00 C ATOM 1609 CD ARG A 122 -10.846 -17.626 28.876 1.00 0.00 C ATOM 1610 NE ARG A 122 -9.690 -16.991 29.499 1.00 0.00 N ATOM 1611 CZ ARG A 122 -9.339 -17.277 30.748 1.00 0.00 C ATOM 1612 NH1 ARG A 122 -8.301 -16.695 31.283 1.00 0.00 N ATOM 1613 NH2 ARG A 122 -10.034 -18.138 31.440 1.00 0.00 N ATOM 0 H ARG A 122 -14.947 -16.621 26.831 1.00 0.00 H new ATOM 0 HA ARG A 122 -15.190 -17.468 29.495 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -13.346 -18.529 28.691 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -13.185 -17.385 27.373 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -11.986 -15.791 28.818 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -12.294 -16.775 30.236 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -10.961 -18.641 29.256 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -10.691 -17.704 27.800 1.00 0.00 H new ATOM 0 HE ARG A 122 -9.142 -16.316 28.966 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -7.759 -16.021 30.742 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -8.031 -16.914 32.242 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -10.847 -18.591 31.022 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -9.765 -18.358 32.399 1.00 0.00 H new ATOM 1627 N LEU A 123 -13.880 -14.467 29.075 1.00 0.00 N ATOM 1628 CA LEU A 123 -13.534 -13.236 29.776 1.00 0.00 C ATOM 1629 C LEU A 123 -14.742 -12.696 30.535 1.00 0.00 C ATOM 1630 O LEU A 123 -14.613 -12.200 31.654 1.00 0.00 O ATOM 1631 CB LEU A 123 -13.044 -12.186 28.777 1.00 0.00 C ATOM 1632 CG LEU A 123 -11.677 -12.598 28.232 1.00 0.00 C ATOM 1633 CD1 LEU A 123 -11.252 -11.627 27.129 1.00 0.00 C ATOM 1634 CD2 LEU A 123 -10.646 -12.565 29.363 1.00 0.00 C ATOM 0 H LEU A 123 -13.803 -14.414 28.059 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.739 -13.456 30.489 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -13.758 -12.086 27.959 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -12.975 -11.212 29.262 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.739 -13.607 27.824 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -10.277 -11.921 26.741 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -11.985 -11.649 26.323 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.191 -10.618 27.536 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.671 -12.859 28.975 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -10.585 -11.556 29.771 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.947 -13.257 30.150 1.00 0.00 H new ATOM 1646 N SER A 124 -15.915 -12.796 29.918 1.00 0.00 N ATOM 1647 CA SER A 124 -17.140 -12.315 30.546 1.00 0.00 C ATOM 1648 C SER A 124 -17.509 -13.188 31.740 1.00 0.00 C ATOM 1649 O SER A 124 -17.949 -12.687 32.775 1.00 0.00 O ATOM 1650 CB SER A 124 -18.284 -12.325 29.532 1.00 0.00 C ATOM 1651 OG SER A 124 -19.522 -12.204 30.219 1.00 0.00 O ATOM 0 H SER A 124 -16.043 -13.202 28.991 1.00 0.00 H new ATOM 0 HA SER A 124 -16.972 -11.296 30.894 1.00 0.00 H new ATOM 0 HB2 SER A 124 -18.166 -11.504 28.825 1.00 0.00 H new ATOM 0 HB3 SER A 124 -18.265 -13.249 28.954 1.00 0.00 H new ATOM 0 HG SER A 124 -20.257 -12.209 29.571 1.00 0.00 H new ATOM 1657 N GLU A 125 -17.325 -14.496 31.590 1.00 0.00 N ATOM 1658 CA GLU A 125 -17.642 -15.430 32.664 1.00 0.00 C ATOM 1659 C GLU A 125 -16.820 -15.112 33.909 1.00 0.00 C ATOM 1660 O GLU A 125 -17.332 -15.151 35.028 1.00 0.00 O ATOM 1661 CB GLU A 125 -17.353 -16.863 32.212 1.00 0.00 C ATOM 1662 CG GLU A 125 -17.733 -17.837 33.328 1.00 0.00 C ATOM 1663 CD GLU A 125 -17.468 -19.271 32.882 1.00 0.00 C ATOM 1664 OE1 GLU A 125 -16.394 -19.519 32.358 1.00 0.00 O ATOM 1665 OE2 GLU A 125 -18.343 -20.100 33.070 1.00 0.00 O ATOM 0 H GLU A 125 -16.961 -14.930 30.742 1.00 0.00 H new ATOM 0 HA GLU A 125 -18.700 -15.332 32.906 1.00 0.00 H new ATOM 0 HB2 GLU A 125 -17.918 -17.091 31.308 1.00 0.00 H new ATOM 0 HB3 GLU A 125 -16.297 -16.971 31.964 1.00 0.00 H new ATOM 0 HG2 GLU A 125 -17.158 -17.615 34.227 1.00 0.00 H new ATOM 0 HG3 GLU A 125 -18.785 -17.716 33.585 1.00 0.00 H new ATOM 1672 N LEU A 126 -15.545 -14.797 33.706 1.00 0.00 N ATOM 1673 CA LEU A 126 -14.662 -14.473 34.820 1.00 0.00 C ATOM 1674 C LEU A 126 -15.067 -13.147 35.457 1.00 0.00 C ATOM 1675 O LEU A 126 -14.946 -12.967 36.668 1.00 0.00 O ATOM 1676 CB LEU A 126 -13.215 -14.386 34.332 1.00 0.00 C ATOM 1677 CG LEU A 126 -12.747 -15.767 33.872 1.00 0.00 C ATOM 1678 CD1 LEU A 126 -11.367 -15.649 33.222 1.00 0.00 C ATOM 1679 CD2 LEU A 126 -12.662 -16.703 35.079 1.00 0.00 C ATOM 0 H LEU A 126 -15.103 -14.759 32.788 1.00 0.00 H new ATOM 0 HA LEU A 126 -14.746 -15.263 35.567 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -13.139 -13.673 33.511 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -12.572 -14.020 35.132 1.00 0.00 H new ATOM 0 HG LEU A 126 -13.456 -16.168 33.148 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.034 -16.634 32.894 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -11.426 -14.981 32.363 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -10.657 -15.248 33.945 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.328 -17.688 34.753 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -11.952 -16.301 35.802 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -13.644 -16.788 35.543 1.00 0.00 H new ATOM 1691 N GLN A 127 -15.549 -12.224 34.631 1.00 0.00 N ATOM 1692 CA GLN A 127 -15.969 -10.917 35.125 1.00 0.00 C ATOM 1693 C GLN A 127 -17.193 -11.053 36.025 1.00 0.00 C ATOM 1694 O GLN A 127 -17.277 -10.416 37.075 1.00 0.00 O ATOM 1695 CB GLN A 127 -16.299 -9.996 33.949 1.00 0.00 C ATOM 1696 CG GLN A 127 -15.001 -9.537 33.280 1.00 0.00 C ATOM 1697 CD GLN A 127 -15.319 -8.714 32.036 1.00 0.00 C ATOM 1698 OE1 GLN A 127 -16.486 -8.451 31.746 1.00 0.00 O ATOM 1699 NE2 GLN A 127 -14.344 -8.290 31.279 1.00 0.00 N ATOM 0 H GLN A 127 -15.658 -12.354 33.625 1.00 0.00 H new ATOM 0 HA GLN A 127 -15.151 -10.488 35.704 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -16.927 -10.520 33.228 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -16.866 -9.133 34.297 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -14.412 -8.943 33.979 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -14.396 -10.402 33.009 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -13.378 -8.509 31.521 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -14.548 -7.739 30.445 1.00 0.00 H new ATOM 1708 N GLN A 128 -18.138 -11.889 35.608 1.00 0.00 N ATOM 1709 CA GLN A 128 -19.354 -12.101 36.385 1.00 0.00 C ATOM 1710 C GLN A 128 -19.012 -12.577 37.793 1.00 0.00 C ATOM 1711 O GLN A 128 -19.671 -12.201 38.763 1.00 0.00 O ATOM 1712 CB GLN A 128 -20.241 -13.139 35.695 1.00 0.00 C ATOM 1713 CG GLN A 128 -20.792 -12.554 34.392 1.00 0.00 C ATOM 1714 CD GLN A 128 -21.617 -13.605 33.657 1.00 0.00 C ATOM 1715 OE1 GLN A 128 -21.820 -14.706 34.170 1.00 0.00 O ATOM 1716 NE2 GLN A 128 -22.107 -13.330 32.480 1.00 0.00 N ATOM 0 H GLN A 128 -18.087 -12.427 34.743 1.00 0.00 H new ATOM 0 HA GLN A 128 -19.890 -11.154 36.453 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -19.668 -14.042 35.487 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -21.061 -13.427 36.353 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -21.408 -11.681 34.607 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -19.971 -12.216 33.759 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -21.937 -12.417 32.057 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -22.660 -14.028 31.982 1.00 0.00 H new ATOM 1725 N TYR A 129 -17.979 -13.406 37.898 1.00 0.00 N ATOM 1726 CA TYR A 129 -17.554 -13.922 39.194 1.00 0.00 C ATOM 1727 C TYR A 129 -17.014 -12.794 40.068 1.00 0.00 C ATOM 1728 O TYR A 129 -17.257 -12.760 41.274 1.00 0.00 O ATOM 1729 CB TYR A 129 -16.471 -14.986 39.004 1.00 0.00 C ATOM 1730 CG TYR A 129 -17.120 -16.320 38.721 1.00 0.00 C ATOM 1731 CD1 TYR A 129 -16.975 -16.916 37.463 1.00 0.00 C ATOM 1732 CD2 TYR A 129 -17.866 -16.960 39.718 1.00 0.00 C ATOM 1733 CE1 TYR A 129 -17.577 -18.153 37.201 1.00 0.00 C ATOM 1734 CE2 TYR A 129 -18.468 -18.197 39.456 1.00 0.00 C ATOM 1735 CZ TYR A 129 -18.323 -18.793 38.198 1.00 0.00 C ATOM 1736 OH TYR A 129 -18.916 -20.012 37.940 1.00 0.00 O ATOM 0 H TYR A 129 -17.424 -13.733 37.107 1.00 0.00 H new ATOM 0 HA TYR A 129 -18.418 -14.368 39.687 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -15.813 -14.708 38.181 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -15.851 -15.053 39.898 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -16.399 -16.422 36.694 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -17.977 -16.500 40.689 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -17.466 -18.613 36.230 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -19.044 -18.691 40.225 1.00 0.00 H new ATOM 0 HH TYR A 129 -19.395 -20.318 38.738 1.00 0.00 H new ATOM 1746 N ARG A 130 -16.281 -11.874 39.450 1.00 0.00 N ATOM 1747 CA ARG A 130 -15.711 -10.748 40.182 1.00 0.00 C ATOM 1748 C ARG A 130 -16.815 -9.898 40.802 1.00 0.00 C ATOM 1749 O ARG A 130 -16.700 -9.448 41.942 1.00 0.00 O ATOM 1750 CB ARG A 130 -14.868 -9.886 39.241 1.00 0.00 C ATOM 1751 CG ARG A 130 -14.207 -8.758 40.035 1.00 0.00 C ATOM 1752 CD ARG A 130 -13.384 -7.882 39.090 1.00 0.00 C ATOM 1753 NE ARG A 130 -12.627 -6.893 39.849 1.00 0.00 N ATOM 1754 CZ ARG A 130 -13.158 -5.717 40.168 1.00 0.00 C ATOM 1755 NH1 ARG A 130 -12.460 -4.849 40.848 1.00 0.00 N ATOM 1756 NH2 ARG A 130 -14.377 -5.431 39.801 1.00 0.00 N ATOM 0 H ARG A 130 -16.069 -11.885 38.452 1.00 0.00 H new ATOM 0 HA ARG A 130 -15.079 -11.140 40.979 1.00 0.00 H new ATOM 0 HB2 ARG A 130 -14.107 -10.497 38.755 1.00 0.00 H new ATOM 0 HB3 ARG A 130 -15.495 -9.470 38.452 1.00 0.00 H new ATOM 0 HG2 ARG A 130 -14.967 -8.157 40.535 1.00 0.00 H new ATOM 0 HG3 ARG A 130 -13.566 -9.174 40.813 1.00 0.00 H new ATOM 0 HD2 ARG A 130 -12.703 -8.503 38.508 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -14.043 -7.380 38.381 1.00 0.00 H new ATOM 0 HE ARG A 130 -11.673 -7.108 40.140 1.00 0.00 H new ATOM 0 HH11 ARG A 130 -11.507 -5.073 41.135 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -12.867 -3.946 41.093 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -14.922 -6.110 39.270 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -14.785 -4.529 40.046 1.00 0.00 H new ATOM 1770 N GLU A 131 -17.885 -9.682 40.044 1.00 0.00 N ATOM 1771 CA GLU A 131 -19.003 -8.879 40.527 1.00 0.00 C ATOM 1772 C GLU A 131 -19.632 -9.523 41.758 1.00 0.00 C ATOM 1773 O GLU A 131 -20.088 -8.830 42.668 1.00 0.00 O ATOM 1774 CB GLU A 131 -20.057 -8.736 39.428 1.00 0.00 C ATOM 1775 CG GLU A 131 -19.494 -7.888 38.286 1.00 0.00 C ATOM 1776 CD GLU A 131 -20.508 -7.802 37.151 1.00 0.00 C ATOM 1777 OE1 GLU A 131 -21.579 -8.369 37.296 1.00 0.00 O ATOM 1778 OE2 GLU A 131 -20.199 -7.172 36.153 1.00 0.00 O ATOM 0 H GLU A 131 -18.002 -10.049 39.099 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.627 -7.893 40.799 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -20.346 -9.719 39.056 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -20.957 -8.271 39.831 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -19.256 -6.888 38.648 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -18.564 -8.325 37.922 1.00 0.00 H new