USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 695 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 37 TYR OH : rot 43:sc= 0.272 USER MOD Set 1.2: A 57 SER OG : rot -94:sc= -3.1! USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 77:sc= 1.01 USER MOD Single : A 20 SER OG : rot -52:sc= 0.594 USER MOD Single : A 21 SER OG : rot 180:sc= -1.66! USER MOD Single : A 27 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=-0.0095) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.396 USER MOD Single : A 33 THR OG1 : rot -70:sc= -2.38! USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.0381 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 TYR OH : rot 73:sc= -1.33! USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 TYR OH : rot 180:sc= 0.136 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -29:sc= 0.77 USER MOD Single : B 213 ASN : amide:sc= -1.27 K(o=-1.3,f=-1.8) USER MOD Single : B 215 LYS NZ :NH3+ -163:sc= -0.0506 (180deg=-0.503) USER MOD Single : B 217 THR OG1 : rot 180:sc= 0 USER MOD Single : B 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 114 N ASP A 11 1.255 -0.147 -8.805 1.00 0.00 N ATOM 115 CA ASP A 11 0.535 -0.489 -10.025 1.00 0.00 C ATOM 116 C ASP A 11 0.891 -1.899 -10.473 1.00 0.00 C ATOM 117 O ASP A 11 1.781 -2.534 -9.904 1.00 0.00 O ATOM 118 CB ASP A 11 0.881 0.504 -11.136 1.00 0.00 C ATOM 119 CG ASP A 11 0.232 1.853 -10.850 1.00 0.00 C ATOM 120 OD1 ASP A 11 -0.647 1.902 -10.006 1.00 0.00 O ATOM 121 OD2 ASP A 11 0.624 2.821 -11.480 1.00 0.00 O ATOM 0 HA ASP A 11 -0.534 -0.441 -9.819 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.962 0.619 -11.208 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.537 0.122 -12.097 1.00 0.00 H new ATOM 126 N LEU A 12 0.168 -2.396 -11.466 1.00 0.00 N ATOM 127 CA LEU A 12 0.400 -3.751 -11.944 1.00 0.00 C ATOM 128 C LEU A 12 1.825 -3.886 -12.469 1.00 0.00 C ATOM 129 O LEU A 12 2.341 -2.994 -13.140 1.00 0.00 O ATOM 130 CB LEU A 12 -0.619 -4.080 -13.069 1.00 0.00 C ATOM 131 CG LEU A 12 -1.182 -5.509 -12.925 1.00 0.00 C ATOM 132 CD1 LEU A 12 -0.035 -6.529 -12.796 1.00 0.00 C ATOM 133 CD2 LEU A 12 -2.098 -5.590 -11.695 1.00 0.00 C ATOM 0 H LEU A 12 -0.574 -1.890 -11.950 1.00 0.00 H new ATOM 0 HA LEU A 12 0.267 -4.453 -11.120 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.438 -3.361 -13.041 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.136 -3.975 -14.040 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.761 -5.747 -13.817 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -0.450 -7.532 -12.695 1.00 0.00 H new ATOM 0 HD12 LEU A 12 0.594 -6.484 -13.685 1.00 0.00 H new ATOM 0 HD13 LEU A 12 0.564 -6.294 -11.916 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -2.491 -6.602 -11.600 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.529 -5.337 -10.800 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.924 -4.889 -11.810 1.00 0.00 H new ATOM 145 N SER A 13 2.457 -5.020 -12.153 1.00 0.00 N ATOM 146 CA SER A 13 3.821 -5.279 -12.591 1.00 0.00 C ATOM 147 C SER A 13 4.003 -6.749 -12.935 1.00 0.00 C ATOM 148 O SER A 13 3.409 -7.627 -12.309 1.00 0.00 O ATOM 149 CB SER A 13 4.807 -4.898 -11.501 1.00 0.00 C ATOM 150 OG SER A 13 4.597 -5.727 -10.363 1.00 0.00 O ATOM 0 H SER A 13 2.043 -5.768 -11.597 1.00 0.00 H new ATOM 0 HA SER A 13 4.009 -4.676 -13.479 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.829 -5.011 -11.864 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.679 -3.850 -11.230 1.00 0.00 H new ATOM 0 HG SER A 13 5.234 -5.484 -9.659 1.00 0.00 H new ATOM 156 N PHE A 14 4.819 -6.999 -13.952 1.00 0.00 N ATOM 157 CA PHE A 14 5.087 -8.354 -14.418 1.00 0.00 C ATOM 158 C PHE A 14 6.532 -8.746 -14.136 1.00 0.00 C ATOM 159 O PHE A 14 7.440 -7.919 -14.233 1.00 0.00 O ATOM 160 CB PHE A 14 4.814 -8.422 -15.916 1.00 0.00 C ATOM 161 CG PHE A 14 3.364 -8.064 -16.175 1.00 0.00 C ATOM 162 CD1 PHE A 14 2.914 -6.750 -15.961 1.00 0.00 C ATOM 163 CD2 PHE A 14 2.475 -9.042 -16.640 1.00 0.00 C ATOM 164 CE1 PHE A 14 1.575 -6.425 -16.214 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.138 -8.710 -16.892 1.00 0.00 C ATOM 166 CZ PHE A 14 0.688 -7.403 -16.678 1.00 0.00 C ATOM 0 H PHE A 14 5.311 -6.273 -14.474 1.00 0.00 H new ATOM 0 HA PHE A 14 4.437 -9.050 -13.888 1.00 0.00 H new ATOM 0 HB2 PHE A 14 5.471 -7.735 -16.449 1.00 0.00 H new ATOM 0 HB3 PHE A 14 5.027 -9.423 -16.291 1.00 0.00 H new ATOM 0 HD1 PHE A 14 3.597 -5.994 -15.603 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.821 -10.052 -16.804 1.00 0.00 H new ATOM 0 HE1 PHE A 14 1.226 -5.416 -16.050 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.454 -9.464 -17.252 1.00 0.00 H new ATOM 0 HZ PHE A 14 -0.344 -7.149 -16.871 1.00 0.00 H new ATOM 176 N VAL A 15 6.740 -10.013 -13.795 1.00 0.00 N ATOM 177 CA VAL A 15 8.081 -10.521 -13.504 1.00 0.00 C ATOM 178 C VAL A 15 8.246 -11.928 -14.060 1.00 0.00 C ATOM 179 O VAL A 15 7.268 -12.588 -14.400 1.00 0.00 O ATOM 180 CB VAL A 15 8.314 -10.530 -11.997 1.00 0.00 C ATOM 181 CG1 VAL A 15 8.308 -9.092 -11.478 1.00 0.00 C ATOM 182 CG2 VAL A 15 7.198 -11.323 -11.315 1.00 0.00 C ATOM 0 H VAL A 15 5.999 -10.709 -13.713 1.00 0.00 H new ATOM 0 HA VAL A 15 8.814 -9.869 -13.978 1.00 0.00 H new ATOM 0 HB VAL A 15 9.275 -10.994 -11.777 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.474 -9.093 -10.401 1.00 0.00 H new ATOM 0 HG12 VAL A 15 9.101 -8.525 -11.967 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.345 -8.631 -11.696 1.00 0.00 H new ATOM 0 HG21 VAL A 15 7.363 -11.330 -10.238 1.00 0.00 H new ATOM 0 HG22 VAL A 15 6.236 -10.858 -11.532 1.00 0.00 H new ATOM 0 HG23 VAL A 15 7.198 -12.347 -11.689 1.00 0.00 H new ATOM 192 N ASP A 16 9.487 -12.377 -14.154 1.00 0.00 N ATOM 193 CA ASP A 16 9.766 -13.711 -14.669 1.00 0.00 C ATOM 194 C ASP A 16 9.117 -13.919 -16.036 1.00 0.00 C ATOM 195 O ASP A 16 8.681 -15.022 -16.363 1.00 0.00 O ATOM 196 CB ASP A 16 9.249 -14.766 -13.691 1.00 0.00 C ATOM 197 CG ASP A 16 9.804 -16.136 -14.063 1.00 0.00 C ATOM 198 OD1 ASP A 16 11.009 -16.307 -13.980 1.00 0.00 O ATOM 199 OD2 ASP A 16 9.017 -16.994 -14.425 1.00 0.00 O ATOM 0 H ASP A 16 10.313 -11.843 -13.883 1.00 0.00 H new ATOM 0 HA ASP A 16 10.846 -13.812 -14.780 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.545 -14.508 -12.674 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.159 -14.788 -13.709 1.00 0.00 H new ATOM 204 N ILE A 17 9.056 -12.854 -16.830 1.00 0.00 N ATOM 205 CA ILE A 17 8.458 -12.940 -18.158 1.00 0.00 C ATOM 206 C ILE A 17 9.165 -14.024 -18.968 1.00 0.00 C ATOM 207 O ILE A 17 10.395 -14.069 -19.025 1.00 0.00 O ATOM 208 CB ILE A 17 8.591 -11.581 -18.868 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.510 -10.617 -18.356 1.00 0.00 C ATOM 210 CG2 ILE A 17 8.441 -11.736 -20.390 1.00 0.00 C ATOM 211 CD1 ILE A 17 7.771 -10.230 -16.897 1.00 0.00 C ATOM 0 H ILE A 17 9.409 -11.930 -16.580 1.00 0.00 H new ATOM 0 HA ILE A 17 7.402 -13.195 -18.068 1.00 0.00 H new ATOM 0 HB ILE A 17 9.582 -11.183 -18.650 1.00 0.00 H new ATOM 0 HG12 ILE A 17 7.492 -9.721 -18.977 1.00 0.00 H new ATOM 0 HG13 ILE A 17 6.529 -11.085 -18.443 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.539 -10.761 -20.866 1.00 0.00 H new ATOM 0 HG22 ILE A 17 9.217 -12.403 -20.766 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.461 -12.154 -20.618 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.993 -9.547 -16.557 1.00 0.00 H new ATOM 0 HD12 ILE A 17 7.764 -11.126 -16.276 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.742 -9.741 -16.818 1.00 0.00 H new ATOM 223 N THR A 18 8.375 -14.889 -19.601 1.00 0.00 N ATOM 224 CA THR A 18 8.923 -15.974 -20.418 1.00 0.00 C ATOM 225 C THR A 18 8.200 -16.029 -21.763 1.00 0.00 C ATOM 226 O THR A 18 7.434 -15.126 -22.107 1.00 0.00 O ATOM 227 CB THR A 18 8.788 -17.322 -19.672 1.00 0.00 C ATOM 228 OG1 THR A 18 8.607 -17.072 -18.286 1.00 0.00 O ATOM 229 CG2 THR A 18 10.051 -18.171 -19.870 1.00 0.00 C ATOM 0 H THR A 18 7.356 -14.861 -19.565 1.00 0.00 H new ATOM 0 HA THR A 18 9.981 -15.785 -20.599 1.00 0.00 H new ATOM 0 HB THR A 18 7.931 -17.864 -20.071 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.683 -16.788 -18.123 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.941 -19.117 -19.339 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.195 -18.366 -20.933 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.915 -17.634 -19.479 1.00 0.00 H new ATOM 237 N ASP A 19 8.440 -17.100 -22.511 1.00 0.00 N ATOM 238 CA ASP A 19 7.801 -17.280 -23.813 1.00 0.00 C ATOM 239 C ASP A 19 6.495 -18.054 -23.670 1.00 0.00 C ATOM 240 O ASP A 19 5.498 -17.725 -24.312 1.00 0.00 O ATOM 241 CB ASP A 19 8.736 -18.039 -24.755 1.00 0.00 C ATOM 242 CG ASP A 19 9.167 -19.351 -24.107 1.00 0.00 C ATOM 243 OD1 ASP A 19 9.190 -19.407 -22.889 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.468 -20.279 -24.839 1.00 0.00 O ATOM 0 H ASP A 19 9.070 -17.855 -22.241 1.00 0.00 H new ATOM 0 HA ASP A 19 7.586 -16.294 -24.225 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.232 -18.238 -25.701 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.611 -17.430 -24.982 1.00 0.00 H new ATOM 249 N SER A 20 6.511 -19.095 -22.833 1.00 0.00 N ATOM 250 CA SER A 20 5.325 -19.931 -22.617 1.00 0.00 C ATOM 251 C SER A 20 4.804 -19.782 -21.192 1.00 0.00 C ATOM 252 O SER A 20 3.885 -20.496 -20.783 1.00 0.00 O ATOM 253 CB SER A 20 5.665 -21.396 -22.885 1.00 0.00 C ATOM 254 OG SER A 20 4.521 -22.197 -22.627 1.00 0.00 O ATOM 0 H SER A 20 7.329 -19.379 -22.295 1.00 0.00 H new ATOM 0 HA SER A 20 4.548 -19.602 -23.307 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.987 -21.524 -23.918 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.494 -21.711 -22.251 1.00 0.00 H new ATOM 0 HG SER A 20 4.179 -22.000 -21.730 1.00 0.00 H new ATOM 260 N SER A 21 5.390 -18.860 -20.441 1.00 0.00 N ATOM 261 CA SER A 21 4.975 -18.627 -19.061 1.00 0.00 C ATOM 262 C SER A 21 5.300 -17.196 -18.648 1.00 0.00 C ATOM 263 O SER A 21 6.229 -16.580 -19.167 1.00 0.00 O ATOM 264 CB SER A 21 5.694 -19.598 -18.127 1.00 0.00 C ATOM 265 OG SER A 21 5.247 -19.388 -16.796 1.00 0.00 O ATOM 0 H SER A 21 6.152 -18.262 -20.761 1.00 0.00 H new ATOM 0 HA SER A 21 3.899 -18.786 -18.991 1.00 0.00 H new ATOM 0 HB2 SER A 21 5.497 -20.626 -18.431 1.00 0.00 H new ATOM 0 HB3 SER A 21 6.772 -19.449 -18.188 1.00 0.00 H new ATOM 0 HG SER A 21 5.706 -20.011 -16.195 1.00 0.00 H new ATOM 271 N ILE A 22 4.529 -16.674 -17.708 1.00 0.00 N ATOM 272 CA ILE A 22 4.731 -15.310 -17.213 1.00 0.00 C ATOM 273 C ILE A 22 4.476 -15.256 -15.711 1.00 0.00 C ATOM 274 O ILE A 22 3.623 -15.979 -15.195 1.00 0.00 O ATOM 275 CB ILE A 22 3.784 -14.352 -17.942 1.00 0.00 C ATOM 276 CG1 ILE A 22 2.335 -14.833 -17.789 1.00 0.00 C ATOM 277 CG2 ILE A 22 4.143 -14.308 -19.426 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.388 -13.775 -18.356 1.00 0.00 C ATOM 0 H ILE A 22 3.754 -17.170 -17.268 1.00 0.00 H new ATOM 0 HA ILE A 22 5.761 -15.009 -17.404 1.00 0.00 H new ATOM 0 HB ILE A 22 3.884 -13.357 -17.509 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.197 -15.779 -18.312 1.00 0.00 H new ATOM 0 HG13 ILE A 22 2.109 -15.014 -16.738 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.468 -13.626 -19.943 1.00 0.00 H new ATOM 0 HG22 ILE A 22 5.170 -13.960 -19.542 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.048 -15.306 -19.853 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.358 -14.114 -18.249 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.521 -12.839 -17.813 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.610 -13.616 -19.411 1.00 0.00 H new ATOM 290 N GLY A 23 5.218 -14.403 -15.010 1.00 0.00 N ATOM 291 CA GLY A 23 5.061 -14.274 -13.562 1.00 0.00 C ATOM 292 C GLY A 23 4.111 -13.134 -13.213 1.00 0.00 C ATOM 293 O GLY A 23 4.543 -12.023 -12.909 1.00 0.00 O ATOM 0 H GLY A 23 5.929 -13.795 -15.416 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.680 -15.208 -13.150 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.033 -14.095 -13.102 1.00 0.00 H new ATOM 297 N LEU A 24 2.815 -13.422 -13.257 1.00 0.00 N ATOM 298 CA LEU A 24 1.815 -12.412 -12.941 1.00 0.00 C ATOM 299 C LEU A 24 1.827 -12.109 -11.451 1.00 0.00 C ATOM 300 O LEU A 24 1.567 -12.983 -10.623 1.00 0.00 O ATOM 301 CB LEU A 24 0.424 -12.906 -13.349 1.00 0.00 C ATOM 302 CG LEU A 24 0.294 -12.918 -14.885 1.00 0.00 C ATOM 303 CD1 LEU A 24 -0.964 -13.697 -15.287 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.192 -11.479 -15.427 1.00 0.00 C ATOM 0 H LEU A 24 2.436 -14.336 -13.506 1.00 0.00 H new ATOM 0 HA LEU A 24 2.053 -11.503 -13.493 1.00 0.00 H new ATOM 0 HB2 LEU A 24 0.256 -13.908 -12.954 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.341 -12.261 -12.917 1.00 0.00 H new ATOM 0 HG LEU A 24 1.178 -13.396 -15.307 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.055 -13.705 -16.373 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -0.890 -14.721 -14.921 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.842 -13.219 -14.853 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.101 -11.505 -16.513 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.684 -10.991 -15.001 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.087 -10.922 -15.151 1.00 0.00 H new ATOM 316 N ARG A 25 2.129 -10.856 -11.112 1.00 0.00 N ATOM 317 CA ARG A 25 2.174 -10.433 -9.717 1.00 0.00 C ATOM 318 C ARG A 25 1.593 -9.040 -9.567 1.00 0.00 C ATOM 319 O ARG A 25 1.857 -8.151 -10.376 1.00 0.00 O ATOM 320 CB ARG A 25 3.611 -10.476 -9.195 1.00 0.00 C ATOM 321 CG ARG A 25 3.634 -10.067 -7.715 1.00 0.00 C ATOM 322 CD ARG A 25 4.910 -10.592 -7.053 1.00 0.00 C ATOM 323 NE ARG A 25 5.035 -10.060 -5.704 1.00 0.00 N ATOM 324 CZ ARG A 25 5.546 -8.851 -5.489 1.00 0.00 C ATOM 325 NH1 ARG A 25 5.934 -8.122 -6.499 1.00 0.00 N ATOM 326 NH2 ARG A 25 5.659 -8.395 -4.273 1.00 0.00 N ATOM 0 H ARG A 25 2.345 -10.120 -11.784 1.00 0.00 H new ATOM 0 HA ARG A 25 1.571 -11.121 -9.125 1.00 0.00 H new ATOM 0 HB2 ARG A 25 4.021 -11.479 -9.312 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.241 -9.804 -9.778 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.588 -8.982 -7.627 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.758 -10.466 -7.204 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.890 -11.681 -7.021 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.779 -10.307 -7.646 1.00 0.00 H new ATOM 0 HE ARG A 25 4.726 -10.623 -4.911 1.00 0.00 H new ATOM 0 HH11 ARG A 25 5.845 -8.480 -7.450 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.326 -7.194 -6.338 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.355 -8.966 -3.484 1.00 0.00 H new ATOM 0 HH22 ARG A 25 6.051 -7.468 -4.111 1.00 0.00 H new ATOM 340 N TRP A 26 0.787 -8.863 -8.527 1.00 0.00 N ATOM 341 CA TRP A 26 0.145 -7.581 -8.264 1.00 0.00 C ATOM 342 C TRP A 26 0.048 -7.338 -6.768 1.00 0.00 C ATOM 343 O TRP A 26 0.070 -8.277 -5.977 1.00 0.00 O ATOM 344 CB TRP A 26 -1.255 -7.569 -8.873 1.00 0.00 C ATOM 345 CG TRP A 26 -2.107 -8.604 -8.216 1.00 0.00 C ATOM 346 CD1 TRP A 26 -2.807 -8.426 -7.072 1.00 0.00 C ATOM 347 CD2 TRP A 26 -2.373 -9.969 -8.651 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.484 -9.597 -6.777 1.00 0.00 N ATOM 349 CE2 TRP A 26 -3.246 -10.576 -7.720 1.00 0.00 C ATOM 350 CE3 TRP A 26 -1.941 -10.730 -9.752 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -3.678 -11.894 -7.878 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -2.374 -12.056 -9.913 1.00 0.00 C ATOM 353 CH2 TRP A 26 -3.241 -12.635 -8.977 1.00 0.00 C ATOM 0 H TRP A 26 0.562 -9.593 -7.851 1.00 0.00 H new ATOM 0 HA TRP A 26 0.745 -6.791 -8.715 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -1.705 -6.584 -8.750 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -1.196 -7.761 -9.944 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.833 -7.520 -6.485 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -4.085 -9.721 -5.962 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -1.272 -10.292 -10.478 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -4.346 -12.337 -7.154 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -2.037 -12.632 -10.762 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -3.571 -13.655 -9.106 1.00 0.00 H new ATOM 364 N THR A 27 -0.054 -6.067 -6.384 1.00 0.00 N ATOM 365 CA THR A 27 -0.153 -5.704 -4.973 1.00 0.00 C ATOM 366 C THR A 27 -1.570 -5.227 -4.635 1.00 0.00 C ATOM 367 O THR A 27 -1.920 -4.087 -4.938 1.00 0.00 O ATOM 368 CB THR A 27 0.825 -4.573 -4.653 1.00 0.00 C ATOM 369 OG1 THR A 27 2.031 -4.771 -5.377 1.00 0.00 O ATOM 370 CG2 THR A 27 1.117 -4.566 -3.149 1.00 0.00 C ATOM 0 H THR A 27 -0.070 -5.275 -7.027 1.00 0.00 H new ATOM 0 HA THR A 27 0.086 -6.588 -4.382 1.00 0.00 H new ATOM 0 HB THR A 27 0.388 -3.617 -4.940 1.00 0.00 H new ATOM 0 HG1 THR A 27 2.658 -4.045 -5.174 1.00 0.00 H new ATOM 0 HG21 THR A 27 1.814 -3.761 -2.917 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.189 -4.412 -2.599 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.556 -5.521 -2.859 1.00 0.00 H new ATOM 378 N PRO A 28 -2.382 -6.039 -4.016 1.00 0.00 N ATOM 379 CA PRO A 28 -3.764 -5.625 -3.648 1.00 0.00 C ATOM 380 C PRO A 28 -3.795 -4.323 -2.834 1.00 0.00 C ATOM 381 O PRO A 28 -2.859 -4.009 -2.099 1.00 0.00 O ATOM 382 CB PRO A 28 -4.308 -6.812 -2.833 1.00 0.00 C ATOM 383 CG PRO A 28 -3.477 -7.989 -3.246 1.00 0.00 C ATOM 384 CD PRO A 28 -2.104 -7.431 -3.622 1.00 0.00 C ATOM 0 HA PRO A 28 -4.366 -5.406 -4.530 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -4.222 -6.626 -1.762 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -5.364 -6.983 -3.043 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -3.394 -8.711 -2.434 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.930 -8.509 -4.090 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -1.410 -7.477 -2.782 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.654 -7.995 -4.439 1.00 0.00 H new ATOM 392 N LEU A 29 -4.890 -3.573 -2.991 1.00 0.00 N ATOM 393 CA LEU A 29 -5.063 -2.305 -2.288 1.00 0.00 C ATOM 394 C LEU A 29 -5.797 -2.511 -0.980 1.00 0.00 C ATOM 395 O LEU A 29 -6.767 -3.263 -0.892 1.00 0.00 O ATOM 396 CB LEU A 29 -5.861 -1.324 -3.157 1.00 0.00 C ATOM 397 CG LEU A 29 -5.193 -1.187 -4.527 1.00 0.00 C ATOM 398 CD1 LEU A 29 -6.053 -0.288 -5.423 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.795 -0.580 -4.357 1.00 0.00 C ATOM 0 H LEU A 29 -5.669 -3.825 -3.600 1.00 0.00 H new ATOM 0 HA LEU A 29 -4.073 -1.897 -2.083 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.885 -1.678 -3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.914 -0.351 -2.669 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.099 -2.169 -4.991 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.580 -0.188 -6.400 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -7.041 -0.732 -5.542 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.150 0.696 -4.965 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.319 -0.483 -5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.879 0.403 -3.895 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.191 -1.229 -3.722 1.00 0.00 H new ATOM 411 N ASN A 30 -5.320 -1.833 0.038 1.00 0.00 N ATOM 412 CA ASN A 30 -5.918 -1.928 1.349 1.00 0.00 C ATOM 413 C ASN A 30 -7.433 -1.780 1.246 1.00 0.00 C ATOM 414 O ASN A 30 -8.183 -2.430 1.975 1.00 0.00 O ATOM 415 CB ASN A 30 -5.342 -0.829 2.224 1.00 0.00 C ATOM 416 CG ASN A 30 -6.010 -0.850 3.597 1.00 0.00 C ATOM 417 OD1 ASN A 30 -6.911 -0.056 3.861 1.00 0.00 O ATOM 418 ND2 ASN A 30 -5.622 -1.722 4.492 1.00 0.00 N ATOM 0 H ASN A 30 -4.516 -1.207 -0.017 1.00 0.00 H new ATOM 0 HA ASN A 30 -5.699 -2.902 1.787 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -4.266 -0.965 2.332 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -5.495 0.141 1.751 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -6.067 -1.744 5.410 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.875 -2.380 4.272 1.00 0.00 H new ATOM 425 N SER A 31 -7.871 -0.934 0.318 1.00 0.00 N ATOM 426 CA SER A 31 -9.296 -0.721 0.101 1.00 0.00 C ATOM 427 C SER A 31 -9.883 -1.854 -0.741 1.00 0.00 C ATOM 428 O SER A 31 -11.037 -2.240 -0.559 1.00 0.00 O ATOM 429 CB SER A 31 -9.527 0.614 -0.600 1.00 0.00 C ATOM 430 OG SER A 31 -9.015 1.664 0.210 1.00 0.00 O ATOM 0 H SER A 31 -7.262 -0.388 -0.292 1.00 0.00 H new ATOM 0 HA SER A 31 -9.794 -0.707 1.070 1.00 0.00 H new ATOM 0 HB2 SER A 31 -9.036 0.617 -1.573 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.591 0.764 -0.780 1.00 0.00 H new ATOM 0 HG SER A 31 -9.160 2.523 -0.238 1.00 0.00 H new ATOM 436 N SER A 32 -9.079 -2.382 -1.667 1.00 0.00 N ATOM 437 CA SER A 32 -9.540 -3.468 -2.529 1.00 0.00 C ATOM 438 C SER A 32 -9.974 -4.663 -1.680 1.00 0.00 C ATOM 439 O SER A 32 -9.203 -5.172 -0.869 1.00 0.00 O ATOM 440 CB SER A 32 -8.421 -3.888 -3.497 1.00 0.00 C ATOM 441 OG SER A 32 -8.369 -2.965 -4.579 1.00 0.00 O ATOM 0 H SER A 32 -8.120 -2.079 -1.836 1.00 0.00 H new ATOM 0 HA SER A 32 -10.394 -3.118 -3.109 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.463 -3.912 -2.977 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.606 -4.895 -3.871 1.00 0.00 H new ATOM 0 HG SER A 32 -7.656 -3.227 -5.198 1.00 0.00 H new ATOM 447 N THR A 33 -11.213 -5.100 -1.876 1.00 0.00 N ATOM 448 CA THR A 33 -11.745 -6.231 -1.122 1.00 0.00 C ATOM 449 C THR A 33 -10.863 -7.455 -1.323 1.00 0.00 C ATOM 450 O THR A 33 -10.280 -7.643 -2.391 1.00 0.00 O ATOM 451 CB THR A 33 -13.169 -6.550 -1.581 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.902 -5.341 -1.727 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.859 -7.450 -0.552 1.00 0.00 C ATOM 0 H THR A 33 -11.865 -4.692 -2.546 1.00 0.00 H new ATOM 0 HA THR A 33 -11.760 -5.966 -0.065 1.00 0.00 H new ATOM 0 HB THR A 33 -13.130 -7.069 -2.539 1.00 0.00 H new ATOM 0 HG1 THR A 33 -14.073 -4.953 -0.843 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.873 -7.673 -0.885 1.00 0.00 H new ATOM 0 HG22 THR A 33 -13.299 -8.379 -0.447 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.898 -6.939 0.410 1.00 0.00 H new ATOM 461 N ILE A 34 -10.755 -8.284 -0.286 1.00 0.00 N ATOM 462 CA ILE A 34 -9.924 -9.484 -0.361 1.00 0.00 C ATOM 463 C ILE A 34 -10.759 -10.696 -0.764 1.00 0.00 C ATOM 464 O ILE A 34 -11.323 -11.387 0.082 1.00 0.00 O ATOM 465 CB ILE A 34 -9.278 -9.747 1.002 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.676 -8.444 1.544 1.00 0.00 C ATOM 467 CG2 ILE A 34 -8.182 -10.804 0.854 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.750 -7.809 0.498 1.00 0.00 C ATOM 0 H ILE A 34 -11.228 -8.149 0.608 1.00 0.00 H new ATOM 0 HA ILE A 34 -9.153 -9.323 -1.114 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.033 -10.110 1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.473 -7.748 1.804 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.118 -8.646 2.458 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.723 -10.990 1.825 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.617 -11.729 0.475 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.424 -10.447 0.157 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.330 -6.885 0.897 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.943 -8.501 0.259 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.319 -7.589 -0.406 1.00 0.00 H new ATOM 480 N ILE A 35 -10.826 -10.943 -2.072 1.00 0.00 N ATOM 481 CA ILE A 35 -11.588 -12.075 -2.602 1.00 0.00 C ATOM 482 C ILE A 35 -10.899 -12.657 -3.830 1.00 0.00 C ATOM 483 O ILE A 35 -10.550 -11.941 -4.767 1.00 0.00 O ATOM 484 CB ILE A 35 -13.011 -11.629 -2.947 1.00 0.00 C ATOM 485 CG1 ILE A 35 -12.973 -10.404 -3.875 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.761 -11.266 -1.665 1.00 0.00 C ATOM 487 CD1 ILE A 35 -14.397 -9.973 -4.247 1.00 0.00 C ATOM 0 H ILE A 35 -10.363 -10.377 -2.783 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.637 -12.853 -1.840 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.522 -12.447 -3.454 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -12.454 -9.582 -3.382 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -12.410 -10.641 -4.778 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.774 -10.949 -1.913 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.804 -12.136 -1.010 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -13.241 -10.454 -1.157 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -14.354 -9.105 -4.904 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -14.903 -10.791 -4.759 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -14.948 -9.716 -3.342 1.00 0.00 H new ATOM 499 N GLY A 36 -10.695 -13.969 -3.819 1.00 0.00 N ATOM 500 CA GLY A 36 -10.034 -14.629 -4.939 1.00 0.00 C ATOM 501 C GLY A 36 -10.545 -14.093 -6.270 1.00 0.00 C ATOM 502 O GLY A 36 -11.748 -14.083 -6.528 1.00 0.00 O ATOM 0 H GLY A 36 -10.973 -14.590 -3.059 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.957 -14.476 -4.871 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.207 -15.704 -4.886 1.00 0.00 H new ATOM 506 N TYR A 37 -9.616 -13.644 -7.110 1.00 0.00 N ATOM 507 CA TYR A 37 -9.973 -13.102 -8.417 1.00 0.00 C ATOM 508 C TYR A 37 -9.967 -14.207 -9.457 1.00 0.00 C ATOM 509 O TYR A 37 -9.686 -15.366 -9.146 1.00 0.00 O ATOM 510 CB TYR A 37 -8.971 -12.021 -8.827 1.00 0.00 C ATOM 511 CG TYR A 37 -8.778 -11.058 -7.682 1.00 0.00 C ATOM 512 CD1 TYR A 37 -9.777 -10.133 -7.370 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.596 -11.094 -6.928 1.00 0.00 C ATOM 514 CE1 TYR A 37 -9.600 -9.242 -6.307 1.00 0.00 C ATOM 515 CE2 TYR A 37 -7.419 -10.204 -5.863 1.00 0.00 C ATOM 516 CZ TYR A 37 -8.421 -9.278 -5.553 1.00 0.00 C ATOM 517 OH TYR A 37 -8.246 -8.401 -4.501 1.00 0.00 O ATOM 0 H TYR A 37 -8.616 -13.645 -6.910 1.00 0.00 H new ATOM 0 HA TYR A 37 -10.971 -12.668 -8.353 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -8.019 -12.476 -9.098 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -9.332 -11.489 -9.707 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -10.687 -10.106 -7.951 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -6.823 -11.808 -7.169 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -10.373 -8.526 -6.068 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -6.510 -10.232 -5.281 1.00 0.00 H new ATOM 0 HH TYR A 37 -9.078 -8.335 -3.988 1.00 0.00 H new ATOM 527 N ARG A 38 -10.275 -13.846 -10.699 1.00 0.00 N ATOM 528 CA ARG A 38 -10.299 -14.815 -11.791 1.00 0.00 C ATOM 529 C ARG A 38 -9.525 -14.289 -12.988 1.00 0.00 C ATOM 530 O ARG A 38 -9.843 -13.232 -13.534 1.00 0.00 O ATOM 531 CB ARG A 38 -11.749 -15.088 -12.203 1.00 0.00 C ATOM 532 CG ARG A 38 -11.798 -16.087 -13.391 1.00 0.00 C ATOM 533 CD ARG A 38 -11.978 -15.352 -14.730 1.00 0.00 C ATOM 534 NE ARG A 38 -12.374 -16.299 -15.767 1.00 0.00 N ATOM 535 CZ ARG A 38 -13.650 -16.648 -15.924 1.00 0.00 C ATOM 536 NH1 ARG A 38 -14.564 -16.147 -15.138 1.00 0.00 N ATOM 537 NH2 ARG A 38 -13.986 -17.491 -16.862 1.00 0.00 N ATOM 0 H ARG A 38 -10.511 -12.893 -10.974 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.832 -15.738 -11.448 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.304 -15.493 -11.357 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.235 -14.154 -12.485 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.879 -16.672 -13.415 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.619 -16.789 -13.245 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -12.734 -14.573 -14.629 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.048 -14.859 -15.012 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.664 -16.699 -16.380 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -14.301 -15.489 -14.404 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -15.541 -16.414 -15.257 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -13.271 -17.883 -17.475 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -14.963 -17.758 -16.982 1.00 0.00 H new ATOM 551 N ILE A 39 -8.505 -15.038 -13.398 1.00 0.00 N ATOM 552 CA ILE A 39 -7.684 -14.649 -14.537 1.00 0.00 C ATOM 553 C ILE A 39 -8.188 -15.349 -15.799 1.00 0.00 C ATOM 554 O ILE A 39 -8.298 -16.575 -15.835 1.00 0.00 O ATOM 555 CB ILE A 39 -6.222 -15.034 -14.273 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.058 -16.557 -14.420 1.00 0.00 C ATOM 557 CG2 ILE A 39 -5.826 -14.595 -12.850 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.782 -17.017 -13.733 1.00 0.00 C ATOM 0 H ILE A 39 -8.229 -15.916 -12.958 1.00 0.00 H new ATOM 0 HA ILE A 39 -7.750 -13.570 -14.679 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.574 -14.535 -14.994 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.918 -17.066 -13.985 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -6.029 -16.827 -15.476 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.788 -14.868 -12.661 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -5.940 -13.515 -12.757 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.470 -15.091 -12.124 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.678 -18.096 -13.844 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.925 -16.521 -14.188 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.828 -16.764 -12.674 1.00 0.00 H new ATOM 570 N THR A 40 -8.506 -14.563 -16.822 1.00 0.00 N ATOM 571 CA THR A 40 -9.013 -15.118 -18.078 1.00 0.00 C ATOM 572 C THR A 40 -7.945 -15.038 -19.164 1.00 0.00 C ATOM 573 O THR A 40 -7.312 -14.000 -19.351 1.00 0.00 O ATOM 574 CB THR A 40 -10.255 -14.337 -18.526 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.090 -14.097 -17.402 1.00 0.00 O ATOM 576 CG2 THR A 40 -11.027 -15.153 -19.563 1.00 0.00 C ATOM 0 H THR A 40 -8.424 -13.546 -16.810 1.00 0.00 H new ATOM 0 HA THR A 40 -9.276 -16.163 -17.916 1.00 0.00 H new ATOM 0 HB THR A 40 -9.948 -13.388 -18.966 1.00 0.00 H new ATOM 0 HG1 THR A 40 -11.884 -13.597 -17.685 1.00 0.00 H new ATOM 0 HG21 THR A 40 -11.909 -14.597 -19.880 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.388 -15.343 -20.425 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.335 -16.102 -19.124 1.00 0.00 H new ATOM 584 N VAL A 41 -7.750 -16.147 -19.880 1.00 0.00 N ATOM 585 CA VAL A 41 -6.755 -16.209 -20.954 1.00 0.00 C ATOM 586 C VAL A 41 -7.382 -16.777 -22.224 1.00 0.00 C ATOM 587 O VAL A 41 -8.145 -17.742 -22.172 1.00 0.00 O ATOM 588 CB VAL A 41 -5.567 -17.075 -20.518 1.00 0.00 C ATOM 589 CG1 VAL A 41 -6.074 -18.388 -19.912 1.00 0.00 C ATOM 590 CG2 VAL A 41 -4.671 -17.376 -21.730 1.00 0.00 C ATOM 0 H VAL A 41 -8.267 -17.014 -19.736 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.400 -15.200 -21.163 1.00 0.00 H new ATOM 0 HB VAL A 41 -4.989 -16.535 -19.768 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.225 -18.998 -19.604 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.698 -18.171 -19.045 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.660 -18.929 -20.655 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -3.828 -17.992 -21.415 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.248 -17.909 -22.485 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.301 -16.441 -22.150 1.00 0.00 H new ATOM 600 N VAL A 42 -7.055 -16.174 -23.372 1.00 0.00 N ATOM 601 CA VAL A 42 -7.589 -16.636 -24.650 1.00 0.00 C ATOM 602 C VAL A 42 -6.460 -16.789 -25.652 1.00 0.00 C ATOM 603 O VAL A 42 -5.638 -15.888 -25.822 1.00 0.00 O ATOM 604 CB VAL A 42 -8.627 -15.633 -25.175 1.00 0.00 C ATOM 605 CG1 VAL A 42 -8.946 -15.918 -26.649 1.00 0.00 C ATOM 606 CG2 VAL A 42 -9.908 -15.758 -24.344 1.00 0.00 C ATOM 0 H VAL A 42 -6.428 -15.372 -23.439 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.072 -17.603 -24.509 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.223 -14.624 -25.092 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.683 -15.199 -27.007 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.036 -15.830 -27.242 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.346 -16.927 -26.746 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.650 -15.049 -24.711 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.300 -16.771 -24.431 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.686 -15.543 -23.299 1.00 0.00 H new ATOM 616 N ALA A 43 -6.430 -17.928 -26.328 1.00 0.00 N ATOM 617 CA ALA A 43 -5.408 -18.192 -27.329 1.00 0.00 C ATOM 618 C ALA A 43 -5.956 -17.892 -28.718 1.00 0.00 C ATOM 619 O ALA A 43 -7.120 -18.181 -29.004 1.00 0.00 O ATOM 620 CB ALA A 43 -5.000 -19.662 -27.250 1.00 0.00 C ATOM 0 H ALA A 43 -7.102 -18.684 -26.201 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.542 -17.557 -27.142 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.234 -19.868 -27.998 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.605 -19.877 -26.257 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.870 -20.292 -27.439 1.00 0.00 H new ATOM 626 N ALA A 44 -5.128 -17.317 -29.585 1.00 0.00 N ATOM 627 CA ALA A 44 -5.569 -16.995 -30.944 1.00 0.00 C ATOM 628 C ALA A 44 -5.077 -18.051 -31.936 1.00 0.00 C ATOM 629 O ALA A 44 -5.659 -18.231 -33.007 1.00 0.00 O ATOM 630 CB ALA A 44 -5.045 -15.619 -31.351 1.00 0.00 C ATOM 0 H ALA A 44 -4.161 -17.066 -29.378 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.659 -16.985 -30.959 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.378 -15.388 -32.363 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.427 -14.866 -30.662 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.955 -15.620 -31.319 1.00 0.00 H new ATOM 636 N GLY A 45 -4.001 -18.746 -31.570 1.00 0.00 N ATOM 637 CA GLY A 45 -3.428 -19.786 -32.429 1.00 0.00 C ATOM 638 C GLY A 45 -4.039 -21.145 -32.113 1.00 0.00 C ATOM 639 O GLY A 45 -3.383 -22.179 -32.250 1.00 0.00 O ATOM 0 H GLY A 45 -3.508 -18.610 -30.687 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.604 -19.537 -33.476 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.348 -19.826 -32.288 1.00 0.00 H new ATOM 643 N GLU A 46 -5.299 -21.137 -31.687 1.00 0.00 N ATOM 644 CA GLU A 46 -5.991 -22.378 -31.347 1.00 0.00 C ATOM 645 C GLU A 46 -7.494 -22.233 -31.565 1.00 0.00 C ATOM 646 O GLU A 46 -8.048 -21.142 -31.445 1.00 0.00 O ATOM 647 CB GLU A 46 -5.726 -22.762 -29.890 1.00 0.00 C ATOM 648 CG GLU A 46 -4.228 -23.018 -29.679 1.00 0.00 C ATOM 649 CD GLU A 46 -3.986 -23.596 -28.288 1.00 0.00 C ATOM 650 OE1 GLU A 46 -4.573 -23.087 -27.348 1.00 0.00 O ATOM 651 OE2 GLU A 46 -3.216 -24.533 -28.187 1.00 0.00 O ATOM 0 H GLU A 46 -5.859 -20.292 -31.569 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.608 -23.163 -32.000 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.064 -21.965 -29.228 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.296 -23.654 -29.631 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.859 -23.708 -30.437 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -3.672 -22.088 -29.797 1.00 0.00 H new ATOM 658 N GLY A 47 -8.140 -23.347 -31.881 1.00 0.00 N ATOM 659 CA GLY A 47 -9.577 -23.350 -32.108 1.00 0.00 C ATOM 660 C GLY A 47 -10.332 -23.174 -30.796 1.00 0.00 C ATOM 661 O GLY A 47 -11.515 -22.832 -30.799 1.00 0.00 O ATOM 0 H GLY A 47 -7.692 -24.258 -31.986 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.843 -22.548 -32.796 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.873 -24.287 -32.581 1.00 0.00 H new ATOM 665 N ILE A 48 -9.648 -23.412 -29.670 1.00 0.00 N ATOM 666 CA ILE A 48 -10.279 -23.273 -28.350 1.00 0.00 C ATOM 667 C ILE A 48 -9.358 -22.489 -27.390 1.00 0.00 C ATOM 668 O ILE A 48 -8.149 -22.720 -27.361 1.00 0.00 O ATOM 669 CB ILE A 48 -10.611 -24.684 -27.769 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.116 -24.951 -27.882 1.00 0.00 C ATOM 671 CG2 ILE A 48 -10.217 -24.809 -26.283 1.00 0.00 C ATOM 672 CD1 ILE A 48 -12.388 -26.442 -27.681 1.00 0.00 C ATOM 0 H ILE A 48 -8.669 -23.698 -29.644 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.208 -22.713 -28.459 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.037 -25.408 -28.347 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -12.656 -24.368 -27.136 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -12.480 -24.633 -28.859 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.467 -25.807 -25.923 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.145 -24.642 -26.175 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -10.760 -24.066 -25.699 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -13.459 -26.631 -27.762 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.860 -27.014 -28.444 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -12.039 -26.746 -26.694 1.00 0.00 H new ATOM 684 N PRO A 49 -9.911 -21.601 -26.592 1.00 0.00 N ATOM 685 CA PRO A 49 -9.124 -20.811 -25.597 1.00 0.00 C ATOM 686 C PRO A 49 -8.702 -21.661 -24.397 1.00 0.00 C ATOM 687 O PRO A 49 -9.272 -22.722 -24.147 1.00 0.00 O ATOM 688 CB PRO A 49 -10.090 -19.697 -25.173 1.00 0.00 C ATOM 689 CG PRO A 49 -11.452 -20.283 -25.356 1.00 0.00 C ATOM 690 CD PRO A 49 -11.344 -21.240 -26.541 1.00 0.00 C ATOM 0 HA PRO A 49 -8.192 -20.432 -26.015 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -9.923 -19.401 -24.137 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.958 -18.805 -25.785 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.774 -20.810 -24.458 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.189 -19.504 -25.550 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -11.971 -22.120 -26.399 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.667 -20.764 -27.467 1.00 0.00 H new ATOM 698 N ILE A 50 -7.709 -21.178 -23.659 1.00 0.00 N ATOM 699 CA ILE A 50 -7.231 -21.894 -22.485 1.00 0.00 C ATOM 700 C ILE A 50 -8.213 -21.729 -21.324 1.00 0.00 C ATOM 701 O ILE A 50 -9.016 -20.797 -21.305 1.00 0.00 O ATOM 702 CB ILE A 50 -5.850 -21.377 -22.069 1.00 0.00 C ATOM 703 CG1 ILE A 50 -4.819 -21.751 -23.138 1.00 0.00 C ATOM 704 CG2 ILE A 50 -5.445 -22.001 -20.726 1.00 0.00 C ATOM 705 CD1 ILE A 50 -3.501 -21.034 -22.852 1.00 0.00 C ATOM 0 H ILE A 50 -7.224 -20.302 -23.851 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.153 -22.951 -22.738 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.889 -20.293 -21.965 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.663 -22.830 -23.146 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.188 -21.475 -24.126 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.462 -21.630 -20.434 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.176 -21.730 -19.964 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.409 -23.086 -20.825 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.769 -21.301 -23.614 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.663 -19.956 -22.866 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.130 -21.332 -21.871 1.00 0.00 H new ATOM 717 N PHE A 51 -8.138 -22.644 -20.360 1.00 0.00 N ATOM 718 CA PHE A 51 -9.021 -22.591 -19.199 1.00 0.00 C ATOM 719 C PHE A 51 -8.535 -21.541 -18.196 1.00 0.00 C ATOM 720 O PHE A 51 -7.334 -21.381 -17.982 1.00 0.00 O ATOM 721 CB PHE A 51 -9.090 -23.975 -18.523 1.00 0.00 C ATOM 722 CG PHE A 51 -8.869 -25.060 -19.553 1.00 0.00 C ATOM 723 CD1 PHE A 51 -9.905 -25.424 -20.422 1.00 0.00 C ATOM 724 CD2 PHE A 51 -7.625 -25.698 -19.640 1.00 0.00 C ATOM 725 CE1 PHE A 51 -9.699 -26.427 -21.377 1.00 0.00 C ATOM 726 CE2 PHE A 51 -7.418 -26.701 -20.595 1.00 0.00 C ATOM 727 CZ PHE A 51 -8.455 -27.065 -21.463 1.00 0.00 C ATOM 0 H PHE A 51 -7.481 -23.424 -20.360 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.018 -22.309 -19.538 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.335 -24.045 -17.740 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.060 -24.108 -18.044 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -10.863 -24.931 -20.356 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -6.826 -25.416 -18.971 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -10.498 -26.708 -22.047 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -6.459 -27.194 -20.662 1.00 0.00 H new ATOM 0 HZ PHE A 51 -8.295 -27.839 -22.200 1.00 0.00 H new ATOM 737 N GLU A 52 -9.483 -20.845 -17.582 1.00 0.00 N ATOM 738 CA GLU A 52 -9.160 -19.821 -16.593 1.00 0.00 C ATOM 739 C GLU A 52 -8.641 -20.461 -15.320 1.00 0.00 C ATOM 740 O GLU A 52 -8.517 -21.683 -15.229 1.00 0.00 O ATOM 741 CB GLU A 52 -10.406 -18.974 -16.298 1.00 0.00 C ATOM 742 CG GLU A 52 -11.388 -19.757 -15.416 1.00 0.00 C ATOM 743 CD GLU A 52 -11.651 -21.129 -16.029 1.00 0.00 C ATOM 744 OE1 GLU A 52 -12.237 -21.178 -17.100 1.00 0.00 O ATOM 745 OE2 GLU A 52 -11.265 -22.114 -15.420 1.00 0.00 O ATOM 0 H GLU A 52 -10.481 -20.970 -17.750 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.379 -19.174 -16.993 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.115 -18.050 -15.798 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -10.892 -18.692 -17.232 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -10.979 -19.869 -14.412 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.324 -19.206 -15.320 1.00 0.00 H new ATOM 752 N ASP A 53 -8.341 -19.628 -14.329 1.00 0.00 N ATOM 753 CA ASP A 53 -7.839 -20.125 -13.056 1.00 0.00 C ATOM 754 C ASP A 53 -8.297 -19.212 -11.916 1.00 0.00 C ATOM 755 O ASP A 53 -8.309 -17.989 -12.054 1.00 0.00 O ATOM 756 CB ASP A 53 -6.293 -20.210 -13.111 1.00 0.00 C ATOM 757 CG ASP A 53 -5.819 -21.661 -12.994 1.00 0.00 C ATOM 758 OD1 ASP A 53 -6.055 -22.261 -11.959 1.00 0.00 O ATOM 759 OD2 ASP A 53 -5.227 -22.147 -13.944 1.00 0.00 O ATOM 0 H ASP A 53 -8.436 -18.614 -14.383 1.00 0.00 H new ATOM 0 HA ASP A 53 -8.238 -21.122 -12.870 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.935 -19.781 -14.047 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.864 -19.617 -12.303 1.00 0.00 H new ATOM 764 N PHE A 54 -8.677 -19.819 -10.790 1.00 0.00 N ATOM 765 CA PHE A 54 -9.138 -19.062 -9.625 1.00 0.00 C ATOM 766 C PHE A 54 -8.107 -19.128 -8.504 1.00 0.00 C ATOM 767 O PHE A 54 -7.725 -20.213 -8.063 1.00 0.00 O ATOM 768 CB PHE A 54 -10.460 -19.648 -9.124 1.00 0.00 C ATOM 769 CG PHE A 54 -11.528 -19.430 -10.164 1.00 0.00 C ATOM 770 CD1 PHE A 54 -11.733 -20.385 -11.167 1.00 0.00 C ATOM 771 CD2 PHE A 54 -12.316 -18.272 -10.130 1.00 0.00 C ATOM 772 CE1 PHE A 54 -12.723 -20.183 -12.134 1.00 0.00 C ATOM 773 CE2 PHE A 54 -13.308 -18.071 -11.095 1.00 0.00 C ATOM 774 CZ PHE A 54 -13.512 -19.025 -12.098 1.00 0.00 C ATOM 0 H PHE A 54 -8.675 -20.831 -10.660 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.278 -18.022 -9.919 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -10.345 -20.713 -8.922 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.748 -19.175 -8.185 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -11.126 -21.278 -11.194 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.157 -17.534 -9.358 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.880 -20.919 -12.908 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.917 -17.179 -11.066 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.277 -18.869 -12.844 1.00 0.00 H new ATOM 784 N VAL A 55 -7.657 -17.960 -8.048 1.00 0.00 N ATOM 785 CA VAL A 55 -6.665 -17.886 -6.974 1.00 0.00 C ATOM 786 C VAL A 55 -7.116 -16.892 -5.907 1.00 0.00 C ATOM 787 O VAL A 55 -7.682 -15.847 -6.222 1.00 0.00 O ATOM 788 CB VAL A 55 -5.303 -17.461 -7.548 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.303 -15.962 -7.875 1.00 0.00 C ATOM 790 CG2 VAL A 55 -4.202 -17.756 -6.523 1.00 0.00 C ATOM 0 H VAL A 55 -7.962 -17.054 -8.404 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.567 -18.870 -6.516 1.00 0.00 H new ATOM 0 HB VAL A 55 -5.118 -18.023 -8.464 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.332 -15.678 -8.280 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -6.079 -15.750 -8.610 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.498 -15.392 -6.967 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.236 -17.455 -6.929 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.399 -17.200 -5.607 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.186 -18.823 -6.303 1.00 0.00 H new ATOM 800 N ASP A 56 -6.868 -17.231 -4.646 1.00 0.00 N ATOM 801 CA ASP A 56 -7.256 -16.365 -3.537 1.00 0.00 C ATOM 802 C ASP A 56 -6.594 -14.993 -3.669 1.00 0.00 C ATOM 803 O ASP A 56 -5.508 -14.871 -4.234 1.00 0.00 O ATOM 804 CB ASP A 56 -6.845 -17.007 -2.212 1.00 0.00 C ATOM 805 CG ASP A 56 -7.730 -18.212 -1.915 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.857 -18.225 -2.379 1.00 0.00 O ATOM 807 OD2 ASP A 56 -7.266 -19.104 -1.223 1.00 0.00 O ATOM 0 H ASP A 56 -6.403 -18.095 -4.367 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.338 -16.235 -3.560 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.801 -17.316 -2.257 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.927 -16.278 -1.405 1.00 0.00 H new ATOM 812 N SER A 57 -7.258 -13.963 -3.144 1.00 0.00 N ATOM 813 CA SER A 57 -6.723 -12.605 -3.206 1.00 0.00 C ATOM 814 C SER A 57 -5.395 -12.511 -2.464 1.00 0.00 C ATOM 815 O SER A 57 -4.502 -11.761 -2.865 1.00 0.00 O ATOM 816 CB SER A 57 -7.727 -11.618 -2.594 1.00 0.00 C ATOM 817 OG SER A 57 -8.690 -11.268 -3.571 1.00 0.00 O ATOM 0 H SER A 57 -8.160 -14.043 -2.675 1.00 0.00 H new ATOM 0 HA SER A 57 -6.555 -12.351 -4.253 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.215 -12.067 -1.729 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.209 -10.726 -2.241 1.00 0.00 H new ATOM 0 HG SER A 57 -8.410 -10.447 -4.027 1.00 0.00 H new ATOM 823 N SER A 58 -5.269 -13.271 -1.385 1.00 0.00 N ATOM 824 CA SER A 58 -4.047 -13.254 -0.598 1.00 0.00 C ATOM 825 C SER A 58 -2.850 -13.521 -1.494 1.00 0.00 C ATOM 826 O SER A 58 -1.765 -12.979 -1.277 1.00 0.00 O ATOM 827 CB SER A 58 -4.110 -14.324 0.493 1.00 0.00 C ATOM 828 OG SER A 58 -5.163 -14.008 1.393 1.00 0.00 O ATOM 0 H SER A 58 -5.992 -13.901 -1.038 1.00 0.00 H new ATOM 0 HA SER A 58 -3.943 -12.272 -0.135 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.277 -15.305 0.048 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.161 -14.373 1.027 1.00 0.00 H new ATOM 0 HG SER A 58 -5.210 -14.691 2.094 1.00 0.00 H new ATOM 834 N VAL A 59 -3.051 -14.360 -2.497 1.00 0.00 N ATOM 835 CA VAL A 59 -1.975 -14.692 -3.416 1.00 0.00 C ATOM 836 C VAL A 59 -1.844 -13.633 -4.503 1.00 0.00 C ATOM 837 O VAL A 59 -2.285 -13.844 -5.634 1.00 0.00 O ATOM 838 CB VAL A 59 -2.232 -16.051 -4.076 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.937 -16.566 -4.728 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.714 -17.052 -3.019 1.00 0.00 C ATOM 0 H VAL A 59 -3.940 -14.820 -2.694 1.00 0.00 H new ATOM 0 HA VAL A 59 -1.050 -14.733 -2.840 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.998 -15.940 -4.843 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -1.125 -17.532 -5.196 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.603 -15.856 -5.484 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.165 -16.675 -3.967 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.897 -18.018 -3.489 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.952 -17.162 -2.248 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.637 -16.688 -2.567 1.00 0.00 H new ATOM 850 N GLY A 60 -1.264 -12.487 -4.146 1.00 0.00 N ATOM 851 CA GLY A 60 -1.081 -11.379 -5.092 1.00 0.00 C ATOM 852 C GLY A 60 -0.243 -11.808 -6.310 1.00 0.00 C ATOM 853 O GLY A 60 0.421 -10.984 -6.939 1.00 0.00 O ATOM 0 H GLY A 60 -0.911 -12.299 -3.208 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.055 -11.021 -5.427 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.591 -10.546 -4.588 1.00 0.00 H new ATOM 857 N TYR A 61 -0.281 -13.099 -6.625 1.00 0.00 N ATOM 858 CA TYR A 61 0.463 -13.636 -7.751 1.00 0.00 C ATOM 859 C TYR A 61 -0.088 -14.987 -8.195 1.00 0.00 C ATOM 860 O TYR A 61 -0.614 -15.753 -7.392 1.00 0.00 O ATOM 861 CB TYR A 61 1.934 -13.779 -7.353 1.00 0.00 C ATOM 862 CG TYR A 61 2.015 -14.584 -6.075 1.00 0.00 C ATOM 863 CD1 TYR A 61 2.013 -15.982 -6.125 1.00 0.00 C ATOM 864 CD2 TYR A 61 2.071 -13.925 -4.841 1.00 0.00 C ATOM 865 CE1 TYR A 61 2.068 -16.726 -4.941 1.00 0.00 C ATOM 866 CE2 TYR A 61 2.123 -14.672 -3.654 1.00 0.00 C ATOM 867 CZ TYR A 61 2.123 -16.071 -3.704 1.00 0.00 C ATOM 868 OH TYR A 61 2.170 -16.805 -2.535 1.00 0.00 O ATOM 0 H TYR A 61 -0.823 -13.793 -6.111 1.00 0.00 H new ATOM 0 HA TYR A 61 0.364 -12.948 -8.591 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.494 -14.273 -8.147 1.00 0.00 H new ATOM 0 HB3 TYR A 61 2.384 -12.797 -7.210 1.00 0.00 H new ATOM 0 HD1 TYR A 61 1.969 -16.488 -7.078 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.074 -12.846 -4.803 1.00 0.00 H new ATOM 0 HE1 TYR A 61 2.068 -17.805 -4.981 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.163 -14.167 -2.700 1.00 0.00 H new ATOM 0 HH TYR A 61 2.206 -16.196 -1.768 1.00 0.00 H new ATOM 878 N TYR A 62 0.061 -15.274 -9.481 1.00 0.00 N ATOM 879 CA TYR A 62 -0.402 -16.539 -10.034 1.00 0.00 C ATOM 880 C TYR A 62 0.425 -16.891 -11.270 1.00 0.00 C ATOM 881 O TYR A 62 0.877 -16.001 -11.992 1.00 0.00 O ATOM 882 CB TYR A 62 -1.889 -16.458 -10.399 1.00 0.00 C ATOM 883 CG TYR A 62 -2.416 -17.855 -10.622 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.644 -18.704 -9.532 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.674 -18.300 -11.917 1.00 0.00 C ATOM 886 CE1 TYR A 62 -3.129 -19.998 -9.742 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.160 -19.594 -12.131 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.389 -20.444 -11.043 1.00 0.00 C ATOM 889 OH TYR A 62 -3.864 -21.722 -11.250 1.00 0.00 O ATOM 0 H TYR A 62 0.498 -14.650 -10.159 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.277 -17.318 -9.282 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.447 -15.968 -9.601 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.024 -15.856 -11.298 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.445 -18.359 -8.528 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.498 -17.644 -12.757 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.303 -20.653 -8.901 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.358 -19.937 -13.136 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.803 -21.770 -10.975 1.00 0.00 H new ATOM 899 N THR A 63 0.629 -18.188 -11.506 1.00 0.00 N ATOM 900 CA THR A 63 1.418 -18.645 -12.651 1.00 0.00 C ATOM 901 C THR A 63 0.520 -19.284 -13.697 1.00 0.00 C ATOM 902 O THR A 63 -0.318 -20.131 -13.383 1.00 0.00 O ATOM 903 CB THR A 63 2.462 -19.666 -12.185 1.00 0.00 C ATOM 904 OG1 THR A 63 3.428 -19.016 -11.375 1.00 0.00 O ATOM 905 CG2 THR A 63 3.148 -20.295 -13.400 1.00 0.00 C ATOM 0 H THR A 63 0.260 -18.938 -10.922 1.00 0.00 H new ATOM 0 HA THR A 63 1.918 -17.783 -13.094 1.00 0.00 H new ATOM 0 HB THR A 63 1.970 -20.449 -11.607 1.00 0.00 H new ATOM 0 HG1 THR A 63 4.095 -19.668 -11.075 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.889 -21.020 -13.064 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.404 -20.797 -14.019 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.640 -19.517 -13.983 1.00 0.00 H new ATOM 913 N VAL A 64 0.715 -18.888 -14.950 1.00 0.00 N ATOM 914 CA VAL A 64 -0.053 -19.436 -16.063 1.00 0.00 C ATOM 915 C VAL A 64 0.891 -19.831 -17.195 1.00 0.00 C ATOM 916 O VAL A 64 1.417 -18.970 -17.900 1.00 0.00 O ATOM 917 CB VAL A 64 -1.075 -18.397 -16.559 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.383 -18.524 -15.762 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.497 -16.990 -16.363 1.00 0.00 C ATOM 0 H VAL A 64 1.403 -18.185 -15.222 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.591 -20.322 -15.726 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.282 -18.571 -17.615 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.100 -17.785 -16.120 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.795 -19.524 -15.896 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.183 -18.353 -14.704 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.216 -16.249 -16.712 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.291 -16.825 -15.305 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.428 -16.894 -16.932 1.00 0.00 H new ATOM 929 N THR A 65 1.099 -21.136 -17.369 1.00 0.00 N ATOM 930 CA THR A 65 1.984 -21.635 -18.424 1.00 0.00 C ATOM 931 C THR A 65 1.194 -22.422 -19.454 1.00 0.00 C ATOM 932 O THR A 65 0.070 -22.854 -19.196 1.00 0.00 O ATOM 933 CB THR A 65 3.061 -22.543 -17.823 1.00 0.00 C ATOM 934 OG1 THR A 65 2.534 -23.856 -17.677 1.00 0.00 O ATOM 935 CG2 THR A 65 3.489 -22.018 -16.451 1.00 0.00 C ATOM 0 H THR A 65 0.670 -21.864 -16.797 1.00 0.00 H new ATOM 0 HA THR A 65 2.453 -20.778 -18.907 1.00 0.00 H new ATOM 0 HB THR A 65 3.927 -22.557 -18.485 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.219 -24.443 -17.294 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.255 -22.672 -16.034 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.890 -21.010 -16.556 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.627 -21.998 -15.784 1.00 0.00 H new ATOM 943 N GLY A 66 1.795 -22.605 -20.625 1.00 0.00 N ATOM 944 CA GLY A 66 1.151 -23.342 -21.707 1.00 0.00 C ATOM 945 C GLY A 66 0.728 -22.409 -22.836 1.00 0.00 C ATOM 946 O GLY A 66 -0.354 -22.560 -23.405 1.00 0.00 O ATOM 0 H GLY A 66 2.726 -22.254 -20.849 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.835 -24.097 -22.093 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.278 -23.870 -21.322 1.00 0.00 H new ATOM 950 N LEU A 67 1.592 -21.447 -23.161 1.00 0.00 N ATOM 951 CA LEU A 67 1.310 -20.492 -24.237 1.00 0.00 C ATOM 952 C LEU A 67 2.320 -20.691 -25.362 1.00 0.00 C ATOM 953 O LEU A 67 3.501 -20.390 -25.210 1.00 0.00 O ATOM 954 CB LEU A 67 1.407 -19.059 -23.711 1.00 0.00 C ATOM 955 CG LEU A 67 0.744 -18.961 -22.333 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.904 -17.543 -21.796 1.00 0.00 C ATOM 957 CD2 LEU A 67 -0.743 -19.296 -22.455 1.00 0.00 C ATOM 0 H LEU A 67 2.490 -21.307 -22.698 1.00 0.00 H new ATOM 0 HA LEU A 67 0.300 -20.662 -24.611 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.452 -18.758 -23.643 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.922 -18.374 -24.407 1.00 0.00 H new ATOM 0 HG LEU A 67 1.218 -19.666 -21.650 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.433 -17.470 -20.816 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.964 -17.305 -21.708 1.00 0.00 H new ATOM 0 HD13 LEU A 67 0.429 -16.839 -22.480 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.213 -19.226 -21.474 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.220 -18.592 -23.137 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.857 -20.309 -22.841 1.00 0.00 H new ATOM 969 N GLU A 68 1.861 -21.227 -26.479 1.00 0.00 N ATOM 970 CA GLU A 68 2.759 -21.490 -27.603 1.00 0.00 C ATOM 971 C GLU A 68 3.426 -20.201 -28.115 1.00 0.00 C ATOM 972 O GLU A 68 2.778 -19.160 -28.200 1.00 0.00 O ATOM 973 CB GLU A 68 1.991 -22.150 -28.750 1.00 0.00 C ATOM 974 CG GLU A 68 1.098 -23.260 -28.201 1.00 0.00 C ATOM 975 CD GLU A 68 1.925 -24.244 -27.377 1.00 0.00 C ATOM 976 OE1 GLU A 68 3.011 -24.590 -27.814 1.00 0.00 O ATOM 977 OE2 GLU A 68 1.459 -24.638 -26.320 1.00 0.00 O ATOM 0 H GLU A 68 0.888 -21.487 -26.637 1.00 0.00 H new ATOM 0 HA GLU A 68 3.540 -22.160 -27.244 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.386 -21.407 -29.270 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.689 -22.560 -29.480 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.309 -22.830 -27.583 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.609 -23.783 -29.023 1.00 0.00 H new ATOM 984 N PRO A 69 4.687 -20.251 -28.480 1.00 0.00 N ATOM 985 CA PRO A 69 5.421 -19.062 -29.016 1.00 0.00 C ATOM 986 C PRO A 69 5.009 -18.743 -30.443 1.00 0.00 C ATOM 987 O PRO A 69 4.555 -19.615 -31.181 1.00 0.00 O ATOM 988 CB PRO A 69 6.891 -19.479 -28.928 1.00 0.00 C ATOM 989 CG PRO A 69 6.862 -20.961 -29.103 1.00 0.00 C ATOM 990 CD PRO A 69 5.570 -21.437 -28.430 1.00 0.00 C ATOM 0 HA PRO A 69 5.209 -18.150 -28.458 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.488 -18.998 -29.703 1.00 0.00 H new ATOM 0 HB3 PRO A 69 7.328 -19.200 -27.969 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.875 -21.230 -30.159 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.735 -21.426 -28.645 1.00 0.00 H new ATOM 0 HD2 PRO A 69 5.132 -22.284 -28.959 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.749 -21.759 -27.404 1.00 0.00 H new ATOM 998 N GLY A 70 5.191 -17.492 -30.824 1.00 0.00 N ATOM 999 CA GLY A 70 4.858 -17.059 -32.164 1.00 0.00 C ATOM 1000 C GLY A 70 3.349 -17.000 -32.377 1.00 0.00 C ATOM 1001 O GLY A 70 2.878 -16.790 -33.498 1.00 0.00 O ATOM 0 H GLY A 70 5.568 -16.759 -30.223 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.290 -16.075 -32.347 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.302 -17.742 -32.888 1.00 0.00 H new ATOM 1005 N ILE A 71 2.593 -17.191 -31.297 1.00 0.00 N ATOM 1006 CA ILE A 71 1.126 -17.163 -31.354 1.00 0.00 C ATOM 1007 C ILE A 71 0.608 -16.002 -30.517 1.00 0.00 C ATOM 1008 O ILE A 71 1.160 -15.670 -29.469 1.00 0.00 O ATOM 1009 CB ILE A 71 0.547 -18.507 -30.830 1.00 0.00 C ATOM 1010 CG1 ILE A 71 0.561 -19.584 -31.938 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -0.906 -18.324 -30.358 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.967 -20.172 -32.099 1.00 0.00 C ATOM 0 H ILE A 71 2.971 -17.368 -30.366 1.00 0.00 H new ATOM 0 HA ILE A 71 0.807 -17.028 -32.387 1.00 0.00 H new ATOM 0 HB ILE A 71 1.174 -18.826 -29.997 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.145 -20.377 -31.691 1.00 0.00 H new ATOM 0 HG13 ILE A 71 0.233 -19.148 -32.881 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.293 -19.276 -29.995 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -0.937 -17.589 -29.554 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.518 -17.977 -31.191 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.957 -20.929 -32.884 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.664 -19.379 -32.368 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.281 -20.627 -31.160 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.463 -15.395 -31.000 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.079 -14.271 -30.319 1.00 0.00 C ATOM 1026 C ASP A 72 -2.052 -14.752 -29.247 1.00 0.00 C ATOM 1027 O ASP A 72 -3.076 -15.363 -29.546 1.00 0.00 O ATOM 1028 CB ASP A 72 -1.812 -13.416 -31.350 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.685 -12.370 -30.665 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.613 -12.760 -29.975 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.411 -11.195 -30.834 1.00 0.00 O ATOM 0 H ASP A 72 -0.926 -15.665 -31.868 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.306 -13.681 -29.827 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.089 -12.923 -32.000 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.429 -14.052 -31.984 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.722 -14.474 -27.994 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.570 -14.876 -26.871 1.00 0.00 C ATOM 1038 C TYR A 73 -3.287 -13.668 -26.293 1.00 0.00 C ATOM 1039 O TYR A 73 -2.665 -12.702 -25.872 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.698 -15.521 -25.776 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.498 -16.991 -26.055 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -0.462 -17.421 -26.889 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.356 -17.924 -25.468 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -0.290 -18.789 -27.136 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.180 -19.287 -25.716 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.150 -19.719 -26.549 1.00 0.00 C ATOM 1047 OH TYR A 73 -0.983 -21.065 -26.792 1.00 0.00 O ATOM 0 H TYR A 73 -0.875 -13.973 -27.725 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.310 -15.592 -27.227 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.732 -15.019 -25.730 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.171 -15.391 -24.803 1.00 0.00 H new ATOM 0 HD1 TYR A 73 0.204 -16.701 -27.341 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.155 -17.591 -24.822 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.509 -19.125 -27.781 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -2.844 -20.008 -25.261 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.666 -21.572 -26.305 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.606 -13.747 -26.285 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.438 -12.678 -25.758 1.00 0.00 C ATOM 1059 C ASP A 74 -5.713 -12.931 -24.281 1.00 0.00 C ATOM 1060 O ASP A 74 -6.316 -13.938 -23.921 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.751 -12.629 -26.544 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.594 -11.778 -27.804 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -5.928 -10.758 -27.728 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -7.136 -12.163 -28.827 1.00 0.00 O ATOM 0 H ASP A 74 -5.128 -14.548 -26.641 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.926 -11.721 -25.861 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.055 -13.639 -26.817 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.541 -12.217 -25.917 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.252 -12.019 -23.429 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.432 -12.155 -21.979 1.00 0.00 C ATOM 1071 C ILE A 75 -6.321 -11.038 -21.451 1.00 0.00 C ATOM 1072 O ILE A 75 -6.560 -10.043 -22.134 1.00 0.00 O ATOM 1073 CB ILE A 75 -4.053 -12.150 -21.267 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -3.030 -11.366 -22.122 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.560 -13.595 -21.050 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.395 -12.281 -23.182 1.00 0.00 C ATOM 0 H ILE A 75 -4.751 -11.177 -23.713 1.00 0.00 H new ATOM 0 HA ILE A 75 -5.922 -13.106 -21.770 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.156 -11.667 -20.296 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.524 -10.525 -22.609 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.253 -10.951 -21.480 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.592 -13.578 -20.550 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.278 -14.136 -20.433 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.462 -14.094 -22.014 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.678 -11.711 -23.773 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -1.883 -13.108 -22.689 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.173 -12.675 -23.836 1.00 0.00 H new ATOM 1088 N SER A 76 -6.793 -11.211 -20.223 1.00 0.00 N ATOM 1089 CA SER A 76 -7.642 -10.212 -19.589 1.00 0.00 C ATOM 1090 C SER A 76 -7.538 -10.313 -18.067 1.00 0.00 C ATOM 1091 O SER A 76 -7.835 -11.355 -17.484 1.00 0.00 O ATOM 1092 CB SER A 76 -9.101 -10.405 -20.057 1.00 0.00 C ATOM 1093 OG SER A 76 -9.211 -11.659 -20.721 1.00 0.00 O ATOM 0 H SER A 76 -6.603 -12.032 -19.648 1.00 0.00 H new ATOM 0 HA SER A 76 -7.308 -9.216 -19.881 1.00 0.00 H new ATOM 0 HB2 SER A 76 -9.778 -10.370 -19.204 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.392 -9.597 -20.728 1.00 0.00 H new ATOM 0 HG SER A 76 -10.135 -11.791 -21.020 1.00 0.00 H new ATOM 1099 N VAL A 77 -7.138 -9.217 -17.427 1.00 0.00 N ATOM 1100 CA VAL A 77 -7.023 -9.192 -15.969 1.00 0.00 C ATOM 1101 C VAL A 77 -8.241 -8.487 -15.378 1.00 0.00 C ATOM 1102 O VAL A 77 -8.333 -7.259 -15.408 1.00 0.00 O ATOM 1103 CB VAL A 77 -5.756 -8.449 -15.552 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -5.660 -8.436 -14.026 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -4.536 -9.165 -16.135 1.00 0.00 C ATOM 0 H VAL A 77 -6.890 -8.342 -17.888 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.972 -10.216 -15.599 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.789 -7.425 -15.924 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.757 -7.907 -13.723 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.533 -7.932 -13.611 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.622 -9.460 -13.655 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.629 -8.638 -15.840 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.500 -10.187 -15.759 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.609 -9.181 -17.222 1.00 0.00 H new ATOM 1115 N ILE A 78 -9.178 -9.271 -14.848 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.397 -8.716 -14.258 1.00 0.00 C ATOM 1117 C ILE A 78 -10.223 -8.517 -12.759 1.00 0.00 C ATOM 1118 O ILE A 78 -9.785 -9.422 -12.050 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.574 -9.661 -14.510 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -11.843 -9.752 -16.013 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -12.823 -9.127 -13.803 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -12.810 -10.903 -16.289 1.00 0.00 C ATOM 0 H ILE A 78 -9.118 -10.289 -14.814 1.00 0.00 H new ATOM 0 HA ILE A 78 -10.596 -7.750 -14.723 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.331 -10.650 -14.121 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.264 -8.814 -16.375 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -10.909 -9.911 -16.551 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.660 -9.802 -13.984 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.635 -9.062 -12.731 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.065 -8.137 -14.190 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.002 -10.968 -17.360 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.371 -11.838 -15.941 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.748 -10.725 -15.763 1.00 0.00 H new ATOM 1134 N THR A 79 -10.579 -7.328 -12.282 1.00 0.00 N ATOM 1135 CA THR A 79 -10.474 -7.013 -10.858 1.00 0.00 C ATOM 1136 C THR A 79 -11.864 -6.922 -10.243 1.00 0.00 C ATOM 1137 O THR A 79 -12.624 -6.001 -10.539 1.00 0.00 O ATOM 1138 CB THR A 79 -9.749 -5.678 -10.672 1.00 0.00 C ATOM 1139 OG1 THR A 79 -8.419 -5.790 -11.163 1.00 0.00 O ATOM 1140 CG2 THR A 79 -9.715 -5.316 -9.186 1.00 0.00 C ATOM 0 H THR A 79 -10.942 -6.568 -12.857 1.00 0.00 H new ATOM 0 HA THR A 79 -9.910 -7.804 -10.363 1.00 0.00 H new ATOM 0 HB THR A 79 -10.277 -4.899 -11.222 1.00 0.00 H new ATOM 0 HG1 THR A 79 -7.954 -4.935 -11.046 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.198 -4.365 -9.055 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.734 -5.230 -8.809 1.00 0.00 H new ATOM 0 HG23 THR A 79 -9.188 -6.094 -8.634 1.00 0.00 H new ATOM 1148 N LEU A 80 -12.190 -7.887 -9.380 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.496 -7.915 -8.717 1.00 0.00 C ATOM 1150 C LEU A 80 -13.333 -7.759 -7.212 1.00 0.00 C ATOM 1151 O LEU A 80 -12.676 -8.572 -6.562 1.00 0.00 O ATOM 1152 CB LEU A 80 -14.210 -9.238 -9.017 1.00 0.00 C ATOM 1153 CG LEU A 80 -15.647 -9.203 -8.468 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -16.481 -8.130 -9.198 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -16.287 -10.584 -8.665 1.00 0.00 C ATOM 0 H LEU A 80 -11.571 -8.656 -9.125 1.00 0.00 H new ATOM 0 HA LEU A 80 -14.092 -7.086 -9.098 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -14.228 -9.414 -10.093 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -13.661 -10.066 -8.568 1.00 0.00 H new ATOM 0 HG LEU A 80 -15.621 -8.952 -7.408 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -17.494 -8.121 -8.796 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -16.023 -7.152 -9.052 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -16.516 -8.359 -10.263 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -17.306 -10.571 -8.279 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -16.304 -10.829 -9.727 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -15.706 -11.334 -8.129 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.948 -6.714 -6.662 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.881 -6.459 -5.226 1.00 0.00 C ATOM 1169 C ILE A 81 -15.218 -5.922 -4.721 1.00 0.00 C ATOM 1170 O ILE A 81 -15.982 -5.326 -5.478 1.00 0.00 O ATOM 1171 CB ILE A 81 -12.759 -5.462 -4.907 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -12.878 -4.203 -5.791 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -11.412 -6.131 -5.173 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -13.992 -3.267 -5.287 1.00 0.00 C ATOM 0 H ILE A 81 -14.496 -6.033 -7.187 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.664 -7.400 -4.720 1.00 0.00 H new ATOM 0 HB ILE A 81 -12.840 -5.164 -3.861 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -11.927 -3.670 -5.797 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -13.085 -4.497 -6.820 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -10.607 -5.431 -4.949 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -11.312 -7.013 -4.540 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -11.354 -6.428 -6.220 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -14.050 -2.390 -5.932 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -14.946 -3.794 -5.305 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -13.770 -2.954 -4.267 1.00 0.00 H new ATOM 1186 N ASN A 82 -15.498 -6.142 -3.440 1.00 0.00 N ATOM 1187 CA ASN A 82 -16.747 -5.674 -2.846 1.00 0.00 C ATOM 1188 C ASN A 82 -16.802 -4.150 -2.823 1.00 0.00 C ATOM 1189 O ASN A 82 -17.822 -3.546 -3.160 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.870 -6.204 -1.421 1.00 0.00 C ATOM 1191 CG ASN A 82 -18.127 -5.645 -0.761 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.044 -4.985 0.274 1.00 0.00 O ATOM 1193 ND2 ASN A 82 -19.290 -5.866 -1.307 1.00 0.00 N ATOM 0 H ASN A 82 -14.882 -6.638 -2.796 1.00 0.00 H new ATOM 0 HA ASN A 82 -17.573 -6.044 -3.453 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.909 -7.293 -1.432 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -15.990 -5.922 -0.843 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -20.135 -5.491 -0.876 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -19.355 -6.414 -2.165 1.00 0.00 H new ATOM 1457 N GLY B 207 2.146 -0.319 -20.232 1.00 0.00 N ATOM 1458 CA GLY B 207 0.772 0.076 -20.545 1.00 0.00 C ATOM 1459 C GLY B 207 0.261 1.108 -19.551 1.00 0.00 C ATOM 1460 O GLY B 207 1.004 1.981 -19.106 1.00 0.00 O ATOM 0 HA2 GLY B 207 0.729 0.485 -21.554 1.00 0.00 H new ATOM 0 HA3 GLY B 207 0.125 -0.801 -20.529 1.00 0.00 H new ATOM 1464 N SER B 208 -1.015 0.996 -19.210 1.00 0.00 N ATOM 1465 CA SER B 208 -1.626 1.918 -18.265 1.00 0.00 C ATOM 1466 C SER B 208 -2.959 1.375 -17.767 1.00 0.00 C ATOM 1467 O SER B 208 -3.469 0.384 -18.290 1.00 0.00 O ATOM 1468 CB SER B 208 -1.824 3.281 -18.920 1.00 0.00 C ATOM 1469 OG SER B 208 -2.748 3.157 -19.992 1.00 0.00 O ATOM 0 H SER B 208 -1.644 0.279 -19.572 1.00 0.00 H new ATOM 0 HA SER B 208 -0.960 2.028 -17.409 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.193 3.999 -18.188 1.00 0.00 H new ATOM 0 HB3 SER B 208 -0.871 3.662 -19.288 1.00 0.00 H new ATOM 0 HG SER B 208 -2.879 4.032 -20.414 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.521 2.036 -16.762 1.00 0.00 N ATOM 1476 CA TRP B 209 -4.804 1.615 -16.205 1.00 0.00 C ATOM 1477 C TRP B 209 -5.952 2.257 -16.976 1.00 0.00 C ATOM 1478 O TRP B 209 -5.953 3.466 -17.213 1.00 0.00 O ATOM 1479 CB TRP B 209 -4.889 2.012 -14.728 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.070 1.069 -13.909 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -2.751 1.203 -13.666 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -4.495 -0.146 -13.226 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -2.333 0.150 -12.873 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -3.374 -0.706 -12.573 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -5.732 -0.807 -13.112 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -3.477 -1.883 -11.830 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -5.836 -1.991 -12.365 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -4.711 -2.526 -11.724 1.00 0.00 C ATOM 0 H TRP B 209 -3.114 2.859 -16.318 1.00 0.00 H new ATOM 0 HA TRP B 209 -4.882 0.531 -16.291 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.530 3.032 -14.594 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -5.927 1.993 -14.395 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.123 2.002 -14.031 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -1.374 0.022 -12.550 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -6.605 -0.402 -13.601 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -2.607 -2.294 -11.340 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -6.789 -2.493 -12.284 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -4.799 -3.435 -11.148 1.00 0.00 H new ATOM 1499 N THR B 210 -6.932 1.439 -17.366 1.00 0.00 N ATOM 1500 CA THR B 210 -8.090 1.934 -18.115 1.00 0.00 C ATOM 1501 C THR B 210 -9.345 1.885 -17.248 1.00 0.00 C ATOM 1502 O THR B 210 -9.619 0.880 -16.593 1.00 0.00 O ATOM 1503 CB THR B 210 -8.305 1.075 -19.363 1.00 0.00 C ATOM 1504 OG1 THR B 210 -8.636 -0.251 -18.973 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.024 1.056 -20.200 1.00 0.00 C ATOM 0 H THR B 210 -6.948 0.437 -17.177 1.00 0.00 H new ATOM 0 HA THR B 210 -7.899 2.966 -18.407 1.00 0.00 H new ATOM 0 HB THR B 210 -9.118 1.494 -19.956 1.00 0.00 H new ATOM 0 HG1 THR B 210 -8.216 -0.453 -18.111 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.179 0.444 -21.088 1.00 0.00 H new ATOM 0 HG22 THR B 210 -6.770 2.073 -20.500 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.209 0.638 -19.609 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.107 2.977 -17.254 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.339 3.056 -16.469 1.00 0.00 C ATOM 1515 C TRP B 211 -12.539 2.677 -17.337 1.00 0.00 C ATOM 1516 O TRP B 211 -12.841 3.349 -18.322 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.512 4.476 -15.913 1.00 0.00 C ATOM 1518 CG TRP B 211 -12.905 4.650 -15.392 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -13.840 5.456 -15.942 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -13.539 4.002 -14.253 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -15.009 5.348 -15.211 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -14.872 4.465 -14.157 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.089 3.069 -13.300 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -15.729 4.018 -13.153 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -13.952 2.619 -12.289 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.269 3.092 -12.216 1.00 0.00 C ATOM 0 H TRP B 211 -9.895 3.817 -17.792 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.277 2.356 -15.636 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -10.791 4.655 -15.116 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.312 5.209 -16.694 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -13.698 6.082 -16.810 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -15.867 5.857 -15.424 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.076 2.698 -13.347 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -16.743 4.386 -13.101 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -13.599 1.903 -11.562 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -15.927 2.740 -11.435 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.232 1.609 -16.948 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.409 1.172 -17.688 1.00 0.00 C ATOM 1539 C GLU B 212 -15.233 0.190 -16.861 1.00 0.00 C ATOM 1540 O GLU B 212 -14.769 -0.327 -15.850 1.00 0.00 O ATOM 1541 CB GLU B 212 -13.966 0.535 -19.028 1.00 0.00 C ATOM 1542 CG GLU B 212 -13.982 -1.005 -18.954 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.190 -1.590 -20.119 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -11.972 -1.505 -20.080 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -13.810 -2.110 -21.028 1.00 0.00 O ATOM 0 H GLU B 212 -13.001 1.038 -16.135 1.00 0.00 H new ATOM 0 HA GLU B 212 -15.041 2.035 -17.899 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.628 0.869 -19.827 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -12.963 0.878 -19.281 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.553 -1.337 -18.008 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.009 -1.368 -18.983 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.421 -0.128 -17.348 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.244 -1.120 -16.682 1.00 0.00 C ATOM 1554 C ASN B 213 -17.349 -0.849 -15.182 1.00 0.00 C ATOM 1555 O ASN B 213 -17.386 -1.781 -14.381 1.00 0.00 O ATOM 1556 CB ASN B 213 -16.630 -2.506 -16.925 1.00 0.00 C ATOM 1557 CG ASN B 213 -16.948 -2.989 -18.338 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -16.053 -3.423 -19.065 1.00 0.00 O ATOM 1559 ND2 ASN B 213 -18.176 -2.950 -18.767 1.00 0.00 N ATOM 0 H ASN B 213 -16.831 0.279 -18.188 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.253 -1.073 -17.091 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.550 -2.462 -16.783 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.019 -3.216 -16.195 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -18.399 -3.279 -19.706 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -18.916 -2.590 -18.164 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.399 0.424 -14.803 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.507 0.785 -13.391 1.00 0.00 C ATOM 1568 C GLY B 214 -16.433 0.093 -12.551 1.00 0.00 C ATOM 1569 O GLY B 214 -16.517 0.073 -11.323 1.00 0.00 O ATOM 0 H GLY B 214 -17.367 1.216 -15.445 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.415 1.866 -13.283 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.494 0.511 -13.019 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.426 -0.471 -13.216 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.341 -1.158 -12.520 1.00 0.00 C ATOM 1575 C LYS B 215 -13.010 -0.913 -13.225 1.00 0.00 C ATOM 1576 O LYS B 215 -12.961 -0.715 -14.436 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.625 -2.656 -12.481 1.00 0.00 C ATOM 1578 CG LYS B 215 -15.899 -2.894 -11.690 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.098 -4.398 -11.500 1.00 0.00 C ATOM 1580 CE LYS B 215 -17.450 -4.645 -10.836 1.00 0.00 C ATOM 1581 NZ LYS B 215 -17.476 -3.993 -9.496 1.00 0.00 N ATOM 0 H LYS B 215 -15.339 -0.466 -14.232 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.278 -0.767 -11.504 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -14.731 -3.046 -13.493 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -13.791 -3.186 -12.021 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -15.838 -2.398 -10.721 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -16.753 -2.465 -12.215 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -16.054 -4.907 -12.463 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -15.297 -4.808 -10.885 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -18.251 -4.248 -11.460 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -17.626 -5.716 -10.734 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -18.256 -4.388 -8.933 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -16.574 -4.166 -9.008 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -17.617 -2.969 -9.611 1.00 0.00 H new ATOM 1595 N TRP B 216 -11.923 -0.934 -12.458 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.598 -0.715 -13.028 1.00 0.00 C ATOM 1597 C TRP B 216 -10.043 -2.025 -13.577 1.00 0.00 C ATOM 1598 O TRP B 216 -9.852 -2.987 -12.832 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.655 -0.166 -11.961 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.116 1.192 -11.550 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.174 1.437 -10.748 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -9.560 2.491 -11.899 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.305 2.803 -10.583 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.331 3.499 -11.274 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.471 2.889 -12.691 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.032 4.852 -11.429 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.166 4.251 -12.852 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -8.946 5.230 -12.219 1.00 0.00 C ATOM 0 H TRP B 216 -11.933 -1.099 -11.451 1.00 0.00 H new ATOM 0 HA TRP B 216 -10.680 0.008 -13.840 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.635 -0.833 -11.099 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -8.638 -0.116 -12.349 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -11.814 0.687 -10.307 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.032 3.244 -10.020 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -7.863 2.142 -13.180 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -10.637 5.602 -10.941 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.327 4.545 -13.466 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -8.706 6.276 -12.343 1.00 0.00 H new ATOM 1619 N THR B 217 -9.797 -2.059 -14.889 1.00 0.00 N ATOM 1620 CA THR B 217 -9.275 -3.264 -15.538 1.00 0.00 C ATOM 1621 C THR B 217 -8.029 -2.934 -16.350 1.00 0.00 C ATOM 1622 O THR B 217 -7.960 -1.903 -17.024 1.00 0.00 O ATOM 1623 CB THR B 217 -10.342 -3.861 -16.465 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.570 -3.969 -15.759 1.00 0.00 O ATOM 1625 CG2 THR B 217 -9.913 -5.259 -16.934 1.00 0.00 C ATOM 0 H THR B 217 -9.950 -1.272 -15.519 1.00 0.00 H new ATOM 0 HA THR B 217 -9.015 -3.988 -14.765 1.00 0.00 H new ATOM 0 HB THR B 217 -10.462 -3.211 -17.331 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.254 -4.349 -16.349 1.00 0.00 H new ATOM 0 HG21 THR B 217 -10.678 -5.673 -17.591 1.00 0.00 H new ATOM 0 HG22 THR B 217 -8.969 -5.188 -17.475 1.00 0.00 H new ATOM 0 HG23 THR B 217 -9.787 -5.910 -16.069 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.042 -3.831 -16.292 1.00 0.00 N ATOM 1634 CA TRP B 218 -5.796 -3.655 -17.032 1.00 0.00 C ATOM 1635 C TRP B 218 -5.760 -4.607 -18.223 1.00 0.00 C ATOM 1636 O TRP B 218 -5.776 -5.826 -18.053 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.601 -3.936 -16.120 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.338 -3.730 -16.892 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -2.834 -4.600 -17.796 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.414 -2.604 -16.843 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.661 -4.077 -18.311 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.359 -2.851 -17.753 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.389 -1.404 -16.109 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.317 -1.941 -17.927 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.341 -0.487 -16.281 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.306 -0.754 -17.189 1.00 0.00 C ATOM 0 H TRP B 218 -7.084 -4.687 -15.739 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.742 -2.627 -17.389 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -4.625 -3.274 -15.254 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -4.648 -4.957 -15.742 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.274 -5.547 -18.071 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.089 -4.541 -19.017 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.182 -1.187 -15.408 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.477 -2.152 -18.628 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.331 0.430 -15.711 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.498 -0.044 -17.318 1.00 0.00 H new ATOM 1657 N LYS B 219 -5.718 -4.044 -19.428 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.686 -4.852 -20.648 1.00 0.00 C ATOM 1659 C LYS B 219 -4.808 -4.200 -21.698 1.00 0.00 C ATOM 1660 O LYS B 219 -4.349 -3.070 -21.528 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.101 -5.025 -21.208 1.00 0.00 C ATOM 1662 CG LYS B 219 -7.926 -5.905 -20.262 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.290 -6.221 -20.888 1.00 0.00 C ATOM 1664 CE LYS B 219 -10.165 -4.964 -20.925 1.00 0.00 C ATOM 1665 NZ LYS B 219 -11.574 -5.352 -21.224 1.00 0.00 N ATOM 0 H LYS B 219 -5.705 -3.037 -19.587 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.274 -5.829 -20.395 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.578 -4.052 -21.324 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.058 -5.479 -22.198 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.390 -6.831 -20.054 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -8.065 -5.396 -19.308 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -9.153 -6.606 -21.898 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -9.789 -7.002 -20.314 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -10.114 -4.444 -19.969 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -9.797 -4.273 -21.684 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -12.171 -4.500 -21.250 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -11.614 -5.831 -22.146 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -11.921 -5.996 -20.485 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.577 -4.926 -22.781 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.746 -4.410 -23.852 1.00 0.00 C ATOM 1681 C GLY B 220 -3.693 -5.379 -25.028 1.00 0.00 C ATOM 1682 O GLY B 220 -4.571 -6.228 -25.181 1.00 0.00 O ATOM 0 H GLY B 220 -4.949 -5.863 -22.939 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -4.136 -3.449 -24.187 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.737 -4.232 -23.479 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.684 -5.221 -25.875 1.00 0.00 N ATOM 1687 CA ILE B 221 -2.565 -6.069 -27.057 1.00 0.00 C ATOM 1688 C ILE B 221 -2.578 -7.541 -26.660 1.00 0.00 C ATOM 1689 O ILE B 221 -3.571 -8.237 -26.869 1.00 0.00 O ATOM 1690 CB ILE B 221 -1.257 -5.754 -27.798 1.00 0.00 C ATOM 1691 CG1 ILE B 221 -1.112 -4.236 -27.967 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -1.274 -6.411 -29.186 1.00 0.00 C ATOM 1693 CD1 ILE B 221 0.181 -3.934 -28.724 1.00 0.00 C ATOM 0 H ILE B 221 -1.946 -4.525 -25.770 1.00 0.00 H new ATOM 0 HA ILE B 221 -3.413 -5.869 -27.712 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.420 -6.143 -27.219 1.00 0.00 H new ATOM 0 HG12 ILE B 221 -1.968 -3.836 -28.511 1.00 0.00 H new ATOM 0 HG13 ILE B 221 -1.098 -3.749 -26.992 1.00 0.00 H new ATOM 0 HG21 ILE B 221 -0.344 -6.184 -29.707 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -1.375 -7.491 -29.076 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -2.116 -6.025 -29.761 1.00 0.00 H new ATOM 0 HD11 ILE B 221 0.288 -2.856 -28.846 1.00 0.00 H new ATOM 0 HD12 ILE B 221 1.031 -4.321 -28.162 1.00 0.00 H new ATOM 0 HD13 ILE B 221 0.148 -4.409 -29.705 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.478 -8.010 -26.082 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.361 -9.400 -25.660 1.00 0.00 C ATOM 1707 C ILE B 222 -0.257 -9.535 -24.621 1.00 0.00 C ATOM 1708 O ILE B 222 0.198 -8.539 -24.058 1.00 0.00 O ATOM 1709 CB ILE B 222 -1.052 -10.302 -26.851 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.135 -9.724 -27.613 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -2.266 -10.402 -27.781 1.00 0.00 C ATOM 1712 CD1 ILE B 222 0.621 -10.753 -28.622 1.00 0.00 C ATOM 0 H ILE B 222 -0.650 -7.444 -25.894 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.312 -9.707 -25.225 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.813 -11.303 -26.491 1.00 0.00 H new ATOM 0 HG12 ILE B 222 -0.155 -8.805 -28.122 1.00 0.00 H new ATOM 0 HG13 ILE B 222 0.937 -9.466 -26.922 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -2.026 -11.049 -28.624 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -3.111 -10.819 -27.233 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -2.526 -9.409 -28.148 1.00 0.00 H new ATOM 0 HD11 ILE B 222 1.471 -10.349 -29.173 1.00 0.00 H new ATOM 0 HD12 ILE B 222 0.925 -11.660 -28.099 1.00 0.00 H new ATOM 0 HD13 ILE B 222 -0.184 -10.988 -29.318 1.00 0.00 H new ATOM 1724 N ARG B 223 0.168 -10.774 -24.375 1.00 0.00 N ATOM 1725 CA ARG B 223 1.235 -11.042 -23.422 1.00 0.00 C ATOM 1726 C ARG B 223 2.348 -10.008 -23.546 1.00 0.00 C ATOM 1727 O ARG B 223 2.350 -9.180 -24.457 1.00 0.00 O ATOM 1728 CB ARG B 223 1.795 -12.439 -23.644 1.00 0.00 C ATOM 1729 CG ARG B 223 2.375 -12.542 -25.048 1.00 0.00 C ATOM 1730 CD ARG B 223 2.903 -13.950 -25.250 1.00 0.00 C ATOM 1731 NE ARG B 223 3.503 -14.073 -26.571 1.00 0.00 N ATOM 1732 CZ ARG B 223 3.816 -15.257 -27.086 1.00 0.00 C ATOM 1733 NH1 ARG B 223 3.599 -16.347 -26.403 1.00 0.00 N ATOM 1734 NH2 ARG B 223 4.344 -15.326 -28.277 1.00 0.00 N ATOM 0 H ARG B 223 -0.213 -11.606 -24.825 1.00 0.00 H new ATOM 0 HA ARG B 223 0.819 -10.978 -22.417 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.567 -12.654 -22.905 1.00 0.00 H new ATOM 0 HB3 ARG B 223 1.009 -13.182 -23.509 1.00 0.00 H new ATOM 0 HG2 ARG B 223 1.611 -12.314 -25.791 1.00 0.00 H new ATOM 0 HG3 ARG B 223 3.176 -11.815 -25.181 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.642 -14.184 -24.483 1.00 0.00 H new ATOM 0 HD3 ARG B 223 2.092 -14.670 -25.142 1.00 0.00 H new ATOM 0 HE ARG B 223 3.687 -13.230 -27.114 1.00 0.00 H new ATOM 0 HH11 ARG B 223 3.188 -16.292 -25.471 1.00 0.00 H new ATOM 0 HH12 ARG B 223 3.840 -17.255 -26.801 1.00 0.00 H new ATOM 0 HH21 ARG B 223 4.515 -14.473 -28.809 1.00 0.00 H new ATOM 0 HH22 ARG B 223 4.586 -16.233 -28.676 1.00 0.00 H new ATOM 1748 N LEU B 224 3.287 -10.061 -22.623 1.00 0.00 N ATOM 1749 CA LEU B 224 4.390 -9.112 -22.627 1.00 0.00 C ATOM 1750 C LEU B 224 5.160 -9.192 -23.933 1.00 0.00 C ATOM 1751 O LEU B 224 5.249 -10.248 -24.556 1.00 0.00 O ATOM 1752 CB LEU B 224 5.333 -9.384 -21.447 1.00 0.00 C ATOM 1753 CG LEU B 224 4.532 -9.579 -20.138 1.00 0.00 C ATOM 1754 CD1 LEU B 224 3.454 -8.493 -20.025 1.00 0.00 C ATOM 1755 CD2 LEU B 224 3.874 -10.985 -20.075 1.00 0.00 C ATOM 0 H LEU B 224 3.312 -10.743 -21.865 1.00 0.00 H new ATOM 0 HA LEU B 224 3.976 -8.109 -22.526 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.929 -10.274 -21.650 1.00 0.00 H new ATOM 0 HB3 LEU B 224 6.029 -8.553 -21.333 1.00 0.00 H new ATOM 0 HG LEU B 224 5.227 -9.498 -19.302 1.00 0.00 H new ATOM 0 HD11 LEU B 224 2.892 -8.633 -19.102 1.00 0.00 H new ATOM 0 HD12 LEU B 224 3.927 -7.511 -20.016 1.00 0.00 H new ATOM 0 HD13 LEU B 224 2.777 -8.562 -20.876 1.00 0.00 H new ATOM 0 HD21 LEU B 224 3.320 -11.086 -19.142 1.00 0.00 H new ATOM 0 HD22 LEU B 224 3.192 -11.106 -20.917 1.00 0.00 H new ATOM 0 HD23 LEU B 224 4.648 -11.751 -20.122 1.00 0.00 H new ATOM 1767 N GLU B 225 5.695 -8.052 -24.353 1.00 0.00 N ATOM 1768 CA GLU B 225 6.439 -7.980 -25.603 1.00 0.00 C ATOM 1769 C GLU B 225 7.836 -8.537 -25.422 1.00 0.00 C ATOM 1770 O GLU B 225 8.418 -8.462 -24.338 1.00 0.00 O ATOM 1771 CB GLU B 225 6.513 -6.524 -26.079 1.00 0.00 C ATOM 1772 CG GLU B 225 6.831 -6.487 -27.575 1.00 0.00 C ATOM 1773 CD GLU B 225 5.598 -6.877 -28.382 1.00 0.00 C ATOM 1774 OE1 GLU B 225 4.547 -7.029 -27.782 1.00 0.00 O ATOM 1775 OE2 GLU B 225 5.722 -7.015 -29.586 1.00 0.00 O ATOM 0 H GLU B 225 5.628 -7.168 -23.848 1.00 0.00 H new ATOM 0 HA GLU B 225 5.922 -8.578 -26.353 1.00 0.00 H new ATOM 0 HB2 GLU B 225 5.566 -6.019 -25.886 1.00 0.00 H new ATOM 0 HB3 GLU B 225 7.280 -5.987 -25.521 1.00 0.00 H new ATOM 0 HG2 GLU B 225 7.161 -5.488 -27.860 1.00 0.00 H new ATOM 0 HG3 GLU B 225 7.652 -7.169 -27.797 1.00 0.00 H new