USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=22 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 Single : A 13 SER OG : rot -20:sc= 0.119 USER MOD Single : A 18 THR OG1 : rot 87:sc= 0.915 USER MOD Single : A 20 SER OG : rot -111:sc= 0.882 USER MOD Single : A 21 SER OG : rot 180:sc= -0.671 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0256 USER MOD Single : A 30 ASN : amide:sc= -0.0711 K(o=-0.071,f=-1.6) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.447 USER MOD Single : A 33 THR OG1 : rot -70:sc= -1.46 USER MOD Single : A 37 TYR OH : rot 124:sc= -0.314 USER MOD Single : A 40 THR OG1 : rot 68:sc= -0.159 USER MOD Single : A 57 SER OG : rot -140:sc= -2.61! 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 -158:sc= -1.59! 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= -0.872 USER MOD Single : A 76 SER OG : rot -160:sc= -0.525 USER MOD Single : A 79 THR OG1 : rot -129:sc= 0.483 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -38:sc= 0.936 USER MOD Single : B 213 ASN : amide:sc= -1.47 X(o=-1.5,f=-1.9!) USER MOD Single : B 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 0.531 0.242 -9.178 1.00 0.00 N ATOM 115 CA ASP A 11 0.391 -0.106 -10.593 1.00 0.00 C ATOM 116 C ASP A 11 0.745 -1.566 -10.820 1.00 0.00 C ATOM 117 O ASP A 11 1.638 -2.112 -10.174 1.00 0.00 O ATOM 118 CB ASP A 11 1.311 0.775 -11.441 1.00 0.00 C ATOM 119 CG ASP A 11 2.765 0.542 -11.048 1.00 0.00 C ATOM 120 OD1 ASP A 11 2.995 -0.186 -10.096 1.00 0.00 O ATOM 121 OD2 ASP A 11 3.630 1.096 -11.705 1.00 0.00 O ATOM 0 HA ASP A 11 -0.646 0.058 -10.886 1.00 0.00 H new ATOM 0 HB2 ASP A 11 1.171 0.549 -12.498 1.00 0.00 H new ATOM 0 HB3 ASP A 11 1.052 1.825 -11.302 1.00 0.00 H new ATOM 126 N LEU A 12 0.038 -2.195 -11.746 1.00 0.00 N ATOM 127 CA LEU A 12 0.284 -3.592 -12.055 1.00 0.00 C ATOM 128 C LEU A 12 1.658 -3.767 -12.683 1.00 0.00 C ATOM 129 O LEU A 12 2.114 -2.911 -13.443 1.00 0.00 O ATOM 130 CB LEU A 12 -0.789 -4.111 -13.016 1.00 0.00 C ATOM 131 CG LEU A 12 -0.484 -5.580 -13.421 1.00 0.00 C ATOM 132 CD1 LEU A 12 -1.773 -6.412 -13.410 1.00 0.00 C ATOM 133 CD2 LEU A 12 0.125 -5.628 -14.833 1.00 0.00 C ATOM 0 H LEU A 12 -0.706 -1.762 -12.293 1.00 0.00 H new ATOM 0 HA LEU A 12 0.247 -4.162 -11.127 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.769 -4.053 -12.543 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.826 -3.482 -13.905 1.00 0.00 H new ATOM 0 HG LEU A 12 0.225 -5.991 -12.702 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -1.546 -7.439 -13.696 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -2.205 -6.401 -12.409 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -2.486 -5.988 -14.117 1.00 0.00 H new ATOM 0 HD21 LEU A 12 0.334 -6.663 -15.104 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -0.579 -5.201 -15.547 1.00 0.00 H new ATOM 0 HD23 LEU A 12 1.052 -5.055 -14.849 1.00 0.00 H new ATOM 145 N SER A 13 2.315 -4.880 -12.368 1.00 0.00 N ATOM 146 CA SER A 13 3.642 -5.164 -12.915 1.00 0.00 C ATOM 147 C SER A 13 3.785 -6.645 -13.243 1.00 0.00 C ATOM 148 O SER A 13 3.090 -7.486 -12.682 1.00 0.00 O ATOM 149 CB SER A 13 4.714 -4.762 -11.911 1.00 0.00 C ATOM 150 OG SER A 13 4.652 -5.627 -10.784 1.00 0.00 O ATOM 0 H SER A 13 1.954 -5.598 -11.740 1.00 0.00 H new ATOM 0 HA SER A 13 3.764 -4.588 -13.832 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.700 -4.818 -12.373 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.566 -3.728 -11.599 1.00 0.00 H new ATOM 0 HG SER A 13 3.774 -6.062 -10.753 1.00 0.00 H new ATOM 156 N PHE A 14 4.694 -6.960 -14.165 1.00 0.00 N ATOM 157 CA PHE A 14 4.926 -8.347 -14.573 1.00 0.00 C ATOM 158 C PHE A 14 6.311 -8.805 -14.130 1.00 0.00 C ATOM 159 O PHE A 14 7.223 -7.994 -13.980 1.00 0.00 O ATOM 160 CB PHE A 14 4.811 -8.460 -16.091 1.00 0.00 C ATOM 161 CG PHE A 14 3.685 -7.577 -16.563 1.00 0.00 C ATOM 162 CD1 PHE A 14 3.888 -6.196 -16.690 1.00 0.00 C ATOM 163 CD2 PHE A 14 2.444 -8.133 -16.901 1.00 0.00 C ATOM 164 CE1 PHE A 14 2.854 -5.376 -17.151 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.410 -7.312 -17.360 1.00 0.00 C ATOM 166 CZ PHE A 14 1.614 -5.934 -17.488 1.00 0.00 C ATOM 0 H PHE A 14 5.281 -6.276 -14.643 1.00 0.00 H new ATOM 0 HA PHE A 14 4.177 -8.983 -14.101 1.00 0.00 H new ATOM 0 HB2 PHE A 14 5.747 -8.162 -16.563 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.625 -9.495 -16.379 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.844 -5.765 -16.432 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.286 -9.197 -16.807 1.00 0.00 H new ATOM 0 HE1 PHE A 14 3.011 -4.312 -17.247 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.453 -7.742 -17.616 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.816 -5.301 -17.846 1.00 0.00 H new ATOM 176 N VAL A 15 6.462 -10.109 -13.926 1.00 0.00 N ATOM 177 CA VAL A 15 7.742 -10.670 -13.507 1.00 0.00 C ATOM 178 C VAL A 15 7.920 -12.071 -14.081 1.00 0.00 C ATOM 179 O VAL A 15 6.945 -12.780 -14.325 1.00 0.00 O ATOM 180 CB VAL A 15 7.811 -10.726 -11.979 1.00 0.00 C ATOM 181 CG1 VAL A 15 7.982 -9.309 -11.424 1.00 0.00 C ATOM 182 CG2 VAL A 15 6.513 -11.326 -11.436 1.00 0.00 C ATOM 0 H VAL A 15 5.717 -10.796 -14.043 1.00 0.00 H new ATOM 0 HA VAL A 15 8.542 -10.031 -13.881 1.00 0.00 H new ATOM 0 HB VAL A 15 8.657 -11.342 -11.675 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.031 -9.348 -10.336 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.903 -8.874 -11.814 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.134 -8.695 -11.727 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.559 -11.367 -10.348 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.670 -10.706 -11.740 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.384 -12.333 -11.832 1.00 0.00 H new ATOM 192 N ASP A 16 9.169 -12.456 -14.294 1.00 0.00 N ATOM 193 CA ASP A 16 9.470 -13.773 -14.841 1.00 0.00 C ATOM 194 C ASP A 16 8.890 -13.917 -16.248 1.00 0.00 C ATOM 195 O ASP A 16 8.422 -14.986 -16.629 1.00 0.00 O ATOM 196 CB ASP A 16 8.887 -14.860 -13.935 1.00 0.00 C ATOM 197 CG ASP A 16 9.551 -16.203 -14.225 1.00 0.00 C ATOM 198 OD1 ASP A 16 10.116 -16.344 -15.296 1.00 0.00 O ATOM 199 OD2 ASP A 16 9.482 -17.072 -13.370 1.00 0.00 O ATOM 0 H ASP A 16 9.988 -11.880 -14.098 1.00 0.00 H new ATOM 0 HA ASP A 16 10.553 -13.884 -14.893 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.037 -14.591 -12.890 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.811 -14.937 -14.093 1.00 0.00 H new ATOM 204 N ILE A 17 8.933 -12.832 -17.015 1.00 0.00 N ATOM 205 CA ILE A 17 8.414 -12.854 -18.380 1.00 0.00 C ATOM 206 C ILE A 17 9.112 -13.942 -19.187 1.00 0.00 C ATOM 207 O ILE A 17 10.338 -14.065 -19.153 1.00 0.00 O ATOM 208 CB ILE A 17 8.645 -11.493 -19.039 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.622 -10.495 -18.509 1.00 0.00 C ATOM 210 CG2 ILE A 17 8.515 -11.590 -20.568 1.00 0.00 C ATOM 211 CD1 ILE A 17 8.045 -9.076 -18.897 1.00 0.00 C ATOM 0 H ILE A 17 9.318 -11.935 -16.720 1.00 0.00 H new ATOM 0 HA ILE A 17 7.345 -13.065 -18.351 1.00 0.00 H new ATOM 0 HB ILE A 17 9.655 -11.161 -18.798 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.636 -10.717 -18.918 1.00 0.00 H new ATOM 0 HG13 ILE A 17 7.544 -10.579 -17.425 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.684 -10.608 -21.011 1.00 0.00 H new ATOM 0 HG22 ILE A 17 9.254 -12.293 -20.952 1.00 0.00 H new ATOM 0 HG23 ILE A 17 7.515 -11.937 -20.827 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.314 -8.362 -18.518 1.00 0.00 H new ATOM 0 HD12 ILE A 17 9.022 -8.857 -18.467 1.00 0.00 H new ATOM 0 HD13 ILE A 17 8.101 -8.997 -19.983 1.00 0.00 H new ATOM 223 N THR A 18 8.324 -14.728 -19.915 1.00 0.00 N ATOM 224 CA THR A 18 8.871 -15.810 -20.734 1.00 0.00 C ATOM 225 C THR A 18 8.193 -15.831 -22.104 1.00 0.00 C ATOM 226 O THR A 18 7.436 -14.923 -22.451 1.00 0.00 O ATOM 227 CB THR A 18 8.675 -17.166 -20.019 1.00 0.00 C ATOM 228 OG1 THR A 18 8.457 -16.936 -18.633 1.00 0.00 O ATOM 229 CG2 THR A 18 9.921 -18.043 -20.196 1.00 0.00 C ATOM 0 H THR A 18 7.309 -14.638 -19.956 1.00 0.00 H new ATOM 0 HA THR A 18 9.938 -15.639 -20.877 1.00 0.00 H new ATOM 0 HB THR A 18 7.816 -17.677 -20.453 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.502 -16.789 -18.472 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.771 -18.996 -19.688 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.093 -18.221 -21.258 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.786 -17.536 -19.769 1.00 0.00 H new ATOM 237 N ASP A 19 8.472 -16.880 -22.870 1.00 0.00 N ATOM 238 CA ASP A 19 7.885 -17.020 -24.195 1.00 0.00 C ATOM 239 C ASP A 19 6.428 -17.454 -24.101 1.00 0.00 C ATOM 240 O ASP A 19 5.553 -16.863 -24.733 1.00 0.00 O ATOM 241 CB ASP A 19 8.662 -18.050 -25.017 1.00 0.00 C ATOM 242 CG ASP A 19 8.852 -19.330 -24.207 1.00 0.00 C ATOM 243 OD1 ASP A 19 8.480 -19.334 -23.044 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.369 -20.288 -24.758 1.00 0.00 O ATOM 0 H ASP A 19 9.096 -17.640 -22.598 1.00 0.00 H new ATOM 0 HA ASP A 19 7.936 -16.048 -24.685 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.125 -18.270 -25.940 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.632 -17.643 -25.302 1.00 0.00 H new ATOM 249 N SER A 20 6.170 -18.500 -23.317 1.00 0.00 N ATOM 250 CA SER A 20 4.812 -19.023 -23.144 1.00 0.00 C ATOM 251 C SER A 20 4.410 -19.011 -21.672 1.00 0.00 C ATOM 252 O SER A 20 3.463 -19.691 -21.275 1.00 0.00 O ATOM 253 CB SER A 20 4.757 -20.459 -23.666 1.00 0.00 C ATOM 254 OG SER A 20 5.110 -20.466 -25.046 1.00 0.00 O ATOM 0 H SER A 20 6.883 -19.004 -22.790 1.00 0.00 H new ATOM 0 HA SER A 20 4.121 -18.390 -23.701 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.440 -21.092 -23.100 1.00 0.00 H new ATOM 0 HB3 SER A 20 3.757 -20.870 -23.531 1.00 0.00 H new ATOM 0 HG SER A 20 4.320 -20.681 -25.585 1.00 0.00 H new ATOM 260 N SER A 21 5.138 -18.245 -20.862 1.00 0.00 N ATOM 261 CA SER A 21 4.849 -18.168 -19.430 1.00 0.00 C ATOM 262 C SER A 21 5.139 -16.764 -18.907 1.00 0.00 C ATOM 263 O SER A 21 6.215 -16.214 -19.145 1.00 0.00 O ATOM 264 CB SER A 21 5.724 -19.176 -18.679 1.00 0.00 C ATOM 265 OG SER A 21 5.833 -20.367 -19.446 1.00 0.00 O ATOM 0 H SER A 21 5.925 -17.673 -21.168 1.00 0.00 H new ATOM 0 HA SER A 21 3.796 -18.398 -19.270 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.713 -18.754 -18.499 1.00 0.00 H new ATOM 0 HB3 SER A 21 5.290 -19.396 -17.704 1.00 0.00 H new ATOM 0 HG SER A 21 6.394 -21.013 -18.968 1.00 0.00 H new ATOM 271 N ILE A 22 4.178 -16.186 -18.191 1.00 0.00 N ATOM 272 CA ILE A 22 4.341 -14.847 -17.631 1.00 0.00 C ATOM 273 C ILE A 22 3.917 -14.850 -16.167 1.00 0.00 C ATOM 274 O ILE A 22 2.968 -15.540 -15.796 1.00 0.00 O ATOM 275 CB ILE A 22 3.485 -13.853 -18.426 1.00 0.00 C ATOM 276 CG1 ILE A 22 1.992 -14.215 -18.302 1.00 0.00 C ATOM 277 CG2 ILE A 22 3.903 -13.914 -19.896 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.143 -13.182 -19.056 1.00 0.00 C ATOM 0 H ILE A 22 3.280 -16.623 -17.985 1.00 0.00 H new ATOM 0 HA ILE A 22 5.387 -14.548 -17.696 1.00 0.00 H new ATOM 0 HB ILE A 22 3.635 -12.848 -18.031 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.815 -15.211 -18.708 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.701 -14.242 -17.252 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.302 -13.212 -20.474 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.957 -13.650 -19.986 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.748 -14.924 -20.277 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.088 -13.442 -18.966 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.311 -12.193 -18.630 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.426 -13.177 -20.109 1.00 0.00 H new ATOM 290 N GLY A 23 4.627 -14.095 -15.339 1.00 0.00 N ATOM 291 CA GLY A 23 4.318 -14.031 -13.910 1.00 0.00 C ATOM 292 C GLY A 23 3.554 -12.758 -13.572 1.00 0.00 C ATOM 293 O GLY A 23 4.145 -11.749 -13.190 1.00 0.00 O ATOM 0 H GLY A 23 5.418 -13.519 -15.627 1.00 0.00 H new ATOM 0 HA2 GLY A 23 3.727 -14.901 -13.623 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.242 -14.069 -13.333 1.00 0.00 H new ATOM 297 N LEU A 24 2.233 -12.806 -13.720 1.00 0.00 N ATOM 298 CA LEU A 24 1.403 -11.645 -13.425 1.00 0.00 C ATOM 299 C LEU A 24 1.384 -11.390 -11.923 1.00 0.00 C ATOM 300 O LEU A 24 0.935 -12.237 -11.151 1.00 0.00 O ATOM 301 CB LEU A 24 -0.025 -11.885 -13.915 1.00 0.00 C ATOM 302 CG LEU A 24 0.006 -12.309 -15.384 1.00 0.00 C ATOM 303 CD1 LEU A 24 -1.422 -12.561 -15.879 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.672 -11.212 -16.228 1.00 0.00 C ATOM 0 H LEU A 24 1.720 -13.628 -14.039 1.00 0.00 H new ATOM 0 HA LEU A 24 1.819 -10.777 -13.936 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.503 -12.657 -13.312 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.618 -10.978 -13.799 1.00 0.00 H new ATOM 0 HG LEU A 24 0.583 -13.229 -15.482 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.396 -12.863 -16.926 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.879 -13.352 -15.284 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.008 -11.647 -15.779 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.692 -11.519 -17.274 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.106 -10.285 -16.132 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.692 -11.052 -15.878 1.00 0.00 H new ATOM 316 N ARG A 25 1.872 -10.221 -11.513 1.00 0.00 N ATOM 317 CA ARG A 25 1.907 -9.861 -10.096 1.00 0.00 C ATOM 318 C ARG A 25 1.614 -8.380 -9.897 1.00 0.00 C ATOM 319 O ARG A 25 2.182 -7.527 -10.572 1.00 0.00 O ATOM 320 CB ARG A 25 3.283 -10.190 -9.518 1.00 0.00 C ATOM 321 CG ARG A 25 3.369 -9.689 -8.073 1.00 0.00 C ATOM 322 CD ARG A 25 4.538 -10.366 -7.361 1.00 0.00 C ATOM 323 NE ARG A 25 4.417 -11.818 -7.448 1.00 0.00 N ATOM 324 CZ ARG A 25 5.347 -12.617 -6.937 1.00 0.00 C ATOM 325 NH1 ARG A 25 6.394 -12.110 -6.346 1.00 0.00 N ATOM 326 NH2 ARG A 25 5.212 -13.911 -7.032 1.00 0.00 N ATOM 0 H ARG A 25 2.248 -9.509 -12.139 1.00 0.00 H new ATOM 0 HA ARG A 25 1.138 -10.435 -9.579 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.454 -11.266 -9.551 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.062 -9.725 -10.121 1.00 0.00 H new ATOM 0 HG2 ARG A 25 3.501 -8.607 -8.061 1.00 0.00 H new ATOM 0 HG3 ARG A 25 2.438 -9.903 -7.548 1.00 0.00 H new ATOM 0 HD2 ARG A 25 5.479 -10.046 -7.809 1.00 0.00 H new ATOM 0 HD3 ARG A 25 4.562 -10.059 -6.315 1.00 0.00 H new ATOM 0 HE ARG A 25 3.604 -12.226 -7.909 1.00 0.00 H new ATOM 0 HH11 ARG A 25 6.500 -11.098 -6.276 1.00 0.00 H new ATOM 0 HH12 ARG A 25 7.107 -12.726 -5.954 1.00 0.00 H new ATOM 0 HH21 ARG A 25 4.395 -14.306 -7.497 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.924 -14.528 -6.641 1.00 0.00 H new ATOM 340 N TRP A 26 0.726 -8.078 -8.960 1.00 0.00 N ATOM 341 CA TRP A 26 0.373 -6.692 -8.677 1.00 0.00 C ATOM 342 C TRP A 26 0.043 -6.537 -7.207 1.00 0.00 C ATOM 343 O TRP A 26 -0.687 -7.350 -6.645 1.00 0.00 O ATOM 344 CB TRP A 26 -0.816 -6.264 -9.530 1.00 0.00 C ATOM 345 CG TRP A 26 -2.015 -7.073 -9.168 1.00 0.00 C ATOM 346 CD1 TRP A 26 -2.840 -6.817 -8.127 1.00 0.00 C ATOM 347 CD2 TRP A 26 -2.544 -8.259 -9.827 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.840 -7.770 -8.105 1.00 0.00 N ATOM 349 CE2 TRP A 26 -3.702 -8.679 -9.134 1.00 0.00 C ATOM 350 CE3 TRP A 26 -2.134 -9.003 -10.950 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -4.430 -9.797 -9.539 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -2.865 -10.130 -11.359 1.00 0.00 C ATOM 353 CH2 TRP A 26 -4.012 -10.526 -10.656 1.00 0.00 C ATOM 0 H TRP A 26 0.240 -8.767 -8.386 1.00 0.00 H new ATOM 0 HA TRP A 26 1.222 -6.054 -8.921 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -1.022 -5.204 -9.378 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -0.583 -6.395 -10.587 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.734 -6.001 -7.427 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -4.589 -7.798 -7.413 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -1.253 -8.705 -11.499 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -5.312 -10.098 -8.993 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -2.542 -10.695 -12.221 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.571 -11.392 -10.977 1.00 0.00 H new ATOM 364 N THR A 27 0.590 -5.499 -6.589 1.00 0.00 N ATOM 365 CA THR A 27 0.348 -5.280 -5.167 1.00 0.00 C ATOM 366 C THR A 27 -1.112 -4.891 -4.904 1.00 0.00 C ATOM 367 O THR A 27 -1.552 -3.828 -5.334 1.00 0.00 O ATOM 368 CB THR A 27 1.251 -4.154 -4.651 1.00 0.00 C ATOM 369 OG1 THR A 27 2.516 -4.241 -5.291 1.00 0.00 O ATOM 370 CG2 THR A 27 1.425 -4.294 -3.128 1.00 0.00 C ATOM 0 H THR A 27 1.192 -4.808 -7.037 1.00 0.00 H new ATOM 0 HA THR A 27 0.567 -6.213 -4.648 1.00 0.00 H new ATOM 0 HB THR A 27 0.799 -3.187 -4.871 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.097 -3.522 -4.966 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.067 -3.494 -2.760 1.00 0.00 H new ATOM 0 HG22 THR A 27 0.451 -4.230 -2.643 1.00 0.00 H new ATOM 0 HG23 THR A 27 1.880 -5.258 -2.901 1.00 0.00 H new ATOM 378 N PRO A 28 -1.856 -5.701 -4.190 1.00 0.00 N ATOM 379 CA PRO A 28 -3.275 -5.386 -3.852 1.00 0.00 C ATOM 380 C PRO A 28 -3.435 -4.011 -3.189 1.00 0.00 C ATOM 381 O PRO A 28 -2.503 -3.492 -2.573 1.00 0.00 O ATOM 382 CB PRO A 28 -3.696 -6.517 -2.897 1.00 0.00 C ATOM 383 CG PRO A 28 -2.763 -7.644 -3.188 1.00 0.00 C ATOM 384 CD PRO A 28 -1.453 -7.009 -3.633 1.00 0.00 C ATOM 0 HA PRO A 28 -3.896 -5.332 -4.746 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.620 -6.202 -1.856 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.732 -6.810 -3.067 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -2.614 -8.264 -2.304 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -3.166 -8.291 -3.967 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.763 -6.891 -2.797 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.947 -7.621 -4.380 1.00 0.00 H new ATOM 392 N LEU A 29 -4.629 -3.430 -3.331 1.00 0.00 N ATOM 393 CA LEU A 29 -4.922 -2.116 -2.748 1.00 0.00 C ATOM 394 C LEU A 29 -5.562 -2.262 -1.375 1.00 0.00 C ATOM 395 O LEU A 29 -6.498 -3.036 -1.170 1.00 0.00 O ATOM 396 CB LEU A 29 -5.859 -1.328 -3.670 1.00 0.00 C ATOM 397 CG LEU A 29 -5.236 -1.218 -5.067 1.00 0.00 C ATOM 398 CD1 LEU A 29 -6.213 -0.500 -6.007 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.915 -0.435 -4.982 1.00 0.00 C ATOM 0 H LEU A 29 -5.407 -3.846 -3.843 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.981 -1.576 -2.639 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.827 -1.825 -3.731 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -6.036 -0.333 -3.261 1.00 0.00 H new ATOM 0 HG LEU A 29 -5.033 -2.216 -5.457 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -5.771 -0.421 -7.000 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -7.142 -1.066 -6.067 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -6.421 0.498 -5.622 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -3.473 -0.358 -5.976 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -4.109 0.564 -4.592 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -3.225 -0.956 -4.318 1.00 0.00 H new ATOM 411 N ASN A 30 -5.041 -1.511 -0.428 1.00 0.00 N ATOM 412 CA ASN A 30 -5.557 -1.552 0.928 1.00 0.00 C ATOM 413 C ASN A 30 -7.083 -1.566 0.919 1.00 0.00 C ATOM 414 O ASN A 30 -7.712 -2.171 1.785 1.00 0.00 O ATOM 415 CB ASN A 30 -5.063 -0.333 1.679 1.00 0.00 C ATOM 416 CG ASN A 30 -5.616 -0.350 3.110 1.00 0.00 C ATOM 417 OD1 ASN A 30 -5.870 -1.420 3.660 1.00 0.00 O ATOM 418 ND2 ASN A 30 -5.831 0.773 3.744 1.00 0.00 N ATOM 0 H ASN A 30 -4.263 -0.866 -0.569 1.00 0.00 H new ATOM 0 HA ASN A 30 -5.206 -2.460 1.418 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.973 -0.323 1.700 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -5.380 0.575 1.167 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -6.208 0.760 4.692 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -5.622 1.663 3.291 1.00 0.00 H new ATOM 425 N SER A 31 -7.664 -0.905 -0.080 1.00 0.00 N ATOM 426 CA SER A 31 -9.117 -0.851 -0.214 1.00 0.00 C ATOM 427 C SER A 31 -9.632 -2.056 -1.001 1.00 0.00 C ATOM 428 O SER A 31 -10.752 -2.518 -0.782 1.00 0.00 O ATOM 429 CB SER A 31 -9.525 0.438 -0.928 1.00 0.00 C ATOM 430 OG SER A 31 -9.404 1.527 -0.024 1.00 0.00 O ATOM 0 H SER A 31 -7.153 -0.402 -0.805 1.00 0.00 H new ATOM 0 HA SER A 31 -9.556 -0.871 0.784 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.892 0.601 -1.801 1.00 0.00 H new ATOM 0 HB3 SER A 31 -10.551 0.360 -1.288 1.00 0.00 H new ATOM 0 HG SER A 31 -9.662 2.357 -0.476 1.00 0.00 H new ATOM 436 N SER A 32 -8.807 -2.562 -1.924 1.00 0.00 N ATOM 437 CA SER A 32 -9.202 -3.711 -2.736 1.00 0.00 C ATOM 438 C SER A 32 -9.727 -4.840 -1.848 1.00 0.00 C ATOM 439 O SER A 32 -8.976 -5.455 -1.090 1.00 0.00 O ATOM 440 CB SER A 32 -8.016 -4.208 -3.590 1.00 0.00 C ATOM 441 OG SER A 32 -8.013 -3.513 -4.828 1.00 0.00 O ATOM 0 H SER A 32 -7.875 -2.198 -2.124 1.00 0.00 H new ATOM 0 HA SER A 32 -10.002 -3.396 -3.406 1.00 0.00 H new ATOM 0 HB2 SER A 32 -7.077 -4.041 -3.063 1.00 0.00 H new ATOM 0 HB3 SER A 32 -8.099 -5.281 -3.761 1.00 0.00 H new ATOM 0 HG SER A 32 -7.261 -3.822 -5.375 1.00 0.00 H new ATOM 447 N THR A 33 -11.022 -5.093 -1.952 1.00 0.00 N ATOM 448 CA THR A 33 -11.645 -6.141 -1.152 1.00 0.00 C ATOM 449 C THR A 33 -10.853 -7.432 -1.307 1.00 0.00 C ATOM 450 O THR A 33 -10.258 -7.678 -2.357 1.00 0.00 O ATOM 451 CB THR A 33 -13.082 -6.365 -1.613 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.724 -5.112 -1.775 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.835 -7.199 -0.574 1.00 0.00 C ATOM 0 H THR A 33 -11.658 -4.595 -2.574 1.00 0.00 H new ATOM 0 HA THR A 33 -11.651 -5.838 -0.105 1.00 0.00 H new ATOM 0 HB THR A 33 -13.079 -6.898 -2.564 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.870 -4.703 -0.896 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.861 -7.356 -0.908 1.00 0.00 H new ATOM 0 HG22 THR A 33 -13.341 -8.163 -0.454 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.841 -6.673 0.380 1.00 0.00 H new ATOM 461 N ILE A 34 -10.838 -8.249 -0.256 1.00 0.00 N ATOM 462 CA ILE A 34 -10.087 -9.506 -0.285 1.00 0.00 C ATOM 463 C ILE A 34 -10.968 -10.662 -0.734 1.00 0.00 C ATOM 464 O ILE A 34 -11.620 -11.325 0.076 1.00 0.00 O ATOM 465 CB ILE A 34 -9.540 -9.806 1.115 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.594 -8.675 1.573 1.00 0.00 C ATOM 467 CG2 ILE A 34 -8.793 -11.151 1.101 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.171 -8.895 1.034 1.00 0.00 C ATOM 0 H ILE A 34 -11.331 -8.068 0.618 1.00 0.00 H new ATOM 0 HA ILE A 34 -9.268 -9.398 -0.996 1.00 0.00 H new ATOM 0 HB ILE A 34 -10.372 -9.867 1.817 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.974 -7.715 1.225 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.572 -8.633 2.662 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -8.405 -11.362 2.097 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -9.478 -11.945 0.803 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.966 -11.100 0.393 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -6.525 -8.084 1.371 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.785 -9.845 1.404 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.193 -8.912 -0.056 1.00 0.00 H new ATOM 480 N ILE A 35 -10.967 -10.901 -2.043 1.00 0.00 N ATOM 481 CA ILE A 35 -11.754 -11.982 -2.624 1.00 0.00 C ATOM 482 C ILE A 35 -11.054 -12.554 -3.852 1.00 0.00 C ATOM 483 O ILE A 35 -10.704 -11.827 -4.782 1.00 0.00 O ATOM 484 CB ILE A 35 -13.149 -11.473 -2.991 1.00 0.00 C ATOM 485 CG1 ILE A 35 -13.034 -10.272 -3.940 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.890 -11.044 -1.724 1.00 0.00 C ATOM 487 CD1 ILE A 35 -14.417 -9.648 -4.188 1.00 0.00 C ATOM 0 H ILE A 35 -10.430 -10.360 -2.720 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.853 -12.779 -1.887 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.700 -12.274 -3.485 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -12.363 -9.526 -3.513 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -12.597 -10.589 -4.887 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.883 -10.682 -1.989 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.982 -11.896 -1.050 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -13.334 -10.248 -1.229 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -14.317 -8.798 -4.863 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -15.076 -10.391 -4.636 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -14.840 -9.312 -3.241 1.00 0.00 H new ATOM 499 N GLY A 36 -10.853 -13.862 -3.851 1.00 0.00 N ATOM 500 CA GLY A 36 -10.189 -14.511 -4.969 1.00 0.00 C ATOM 501 C GLY A 36 -10.768 -14.035 -6.293 1.00 0.00 C ATOM 502 O GLY A 36 -11.980 -14.093 -6.513 1.00 0.00 O ATOM 0 H GLY A 36 -11.136 -14.489 -3.098 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -9.121 -14.297 -4.937 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -10.301 -15.592 -4.886 1.00 0.00 H new ATOM 506 N TYR A 37 -9.888 -13.567 -7.172 1.00 0.00 N ATOM 507 CA TYR A 37 -10.305 -13.080 -8.484 1.00 0.00 C ATOM 508 C TYR A 37 -10.155 -14.184 -9.514 1.00 0.00 C ATOM 509 O TYR A 37 -9.656 -15.266 -9.209 1.00 0.00 O ATOM 510 CB TYR A 37 -9.453 -11.880 -8.901 1.00 0.00 C ATOM 511 CG TYR A 37 -7.989 -12.229 -8.782 1.00 0.00 C ATOM 512 CD1 TYR A 37 -7.356 -12.954 -9.798 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.264 -11.826 -7.654 1.00 0.00 C ATOM 514 CE1 TYR A 37 -5.997 -13.272 -9.684 1.00 0.00 C ATOM 515 CE2 TYR A 37 -5.908 -12.145 -7.542 1.00 0.00 C ATOM 516 CZ TYR A 37 -5.275 -12.869 -8.558 1.00 0.00 C ATOM 517 OH TYR A 37 -3.936 -13.186 -8.447 1.00 0.00 O ATOM 0 H TYR A 37 -8.884 -13.514 -7.001 1.00 0.00 H new ATOM 0 HA TYR A 37 -11.349 -12.773 -8.425 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -9.687 -11.595 -9.927 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -9.684 -11.021 -8.271 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -7.914 -13.267 -10.668 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -7.753 -11.268 -6.869 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -5.506 -13.830 -10.468 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -5.349 -11.833 -6.672 1.00 0.00 H new ATOM 0 HH TYR A 37 -3.415 -12.365 -8.325 1.00 0.00 H new ATOM 527 N ARG A 38 -10.593 -13.908 -10.740 1.00 0.00 N ATOM 528 CA ARG A 38 -10.509 -14.887 -11.821 1.00 0.00 C ATOM 529 C ARG A 38 -9.796 -14.295 -13.030 1.00 0.00 C ATOM 530 O ARG A 38 -10.211 -13.267 -13.567 1.00 0.00 O ATOM 531 CB ARG A 38 -11.917 -15.323 -12.231 1.00 0.00 C ATOM 532 CG ARG A 38 -11.859 -16.280 -13.452 1.00 0.00 C ATOM 533 CD ARG A 38 -12.358 -15.561 -14.711 1.00 0.00 C ATOM 534 NE ARG A 38 -13.779 -15.271 -14.579 1.00 0.00 N ATOM 535 CZ ARG A 38 -14.392 -14.446 -15.417 1.00 0.00 C ATOM 536 NH1 ARG A 38 -13.714 -13.877 -16.371 1.00 0.00 N ATOM 537 NH2 ARG A 38 -15.666 -14.201 -15.283 1.00 0.00 N ATOM 0 H ARG A 38 -11.009 -13.016 -11.009 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.943 -15.747 -11.464 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.407 -15.821 -11.395 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.518 -14.447 -12.477 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.837 -16.627 -13.603 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.470 -17.162 -13.262 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.800 -14.636 -14.859 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -12.184 -16.182 -15.590 1.00 0.00 H new ATOM 0 HE ARG A 38 -14.312 -15.710 -13.829 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.717 -14.067 -16.471 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -14.180 -13.242 -17.019 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -16.194 -14.645 -14.532 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -16.134 -13.566 -15.930 1.00 0.00 H new ATOM 551 N ILE A 39 -8.719 -14.952 -13.454 1.00 0.00 N ATOM 552 CA ILE A 39 -7.943 -14.491 -14.599 1.00 0.00 C ATOM 553 C ILE A 39 -8.427 -15.192 -15.859 1.00 0.00 C ATOM 554 O ILE A 39 -8.400 -16.416 -15.953 1.00 0.00 O ATOM 555 CB ILE A 39 -6.451 -14.798 -14.366 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.203 -16.314 -14.539 1.00 0.00 C ATOM 557 CG2 ILE A 39 -6.049 -14.358 -12.947 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.902 -16.726 -13.847 1.00 0.00 C ATOM 0 H ILE A 39 -8.365 -15.805 -13.021 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.073 -13.415 -14.718 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.849 -14.252 -15.092 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -7.038 -16.875 -14.120 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -6.152 -16.562 -15.599 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -4.994 -14.576 -12.784 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.220 -13.287 -12.836 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.648 -14.899 -12.215 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.743 -17.796 -13.979 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -4.068 -16.178 -14.285 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.967 -16.497 -12.783 1.00 0.00 H new ATOM 570 N THR A 40 -8.887 -14.403 -16.821 1.00 0.00 N ATOM 571 CA THR A 40 -9.395 -14.949 -18.073 1.00 0.00 C ATOM 572 C THR A 40 -8.307 -14.929 -19.132 1.00 0.00 C ATOM 573 O THR A 40 -7.680 -13.899 -19.371 1.00 0.00 O ATOM 574 CB THR A 40 -10.584 -14.124 -18.561 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.479 -13.900 -17.484 1.00 0.00 O ATOM 576 CG2 THR A 40 -11.308 -14.883 -19.673 1.00 0.00 C ATOM 0 H THR A 40 -8.919 -13.385 -16.759 1.00 0.00 H new ATOM 0 HA THR A 40 -9.712 -15.977 -17.898 1.00 0.00 H new ATOM 0 HB THR A 40 -10.229 -13.167 -18.944 1.00 0.00 H new ATOM 0 HG1 THR A 40 -11.058 -13.308 -16.826 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.157 -14.295 -20.022 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.622 -15.056 -20.502 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.663 -15.840 -19.289 1.00 0.00 H new ATOM 584 N VAL A 41 -8.088 -16.077 -19.767 1.00 0.00 N ATOM 585 CA VAL A 41 -7.067 -16.197 -20.811 1.00 0.00 C ATOM 586 C VAL A 41 -7.703 -16.688 -22.102 1.00 0.00 C ATOM 587 O VAL A 41 -8.497 -17.629 -22.089 1.00 0.00 O ATOM 588 CB VAL A 41 -5.966 -17.177 -20.365 1.00 0.00 C ATOM 589 CG1 VAL A 41 -6.597 -18.436 -19.766 1.00 0.00 C ATOM 590 CG2 VAL A 41 -5.089 -17.562 -21.573 1.00 0.00 C ATOM 0 H VAL A 41 -8.602 -16.938 -19.579 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.620 -15.218 -20.982 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.347 -16.694 -19.609 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.811 -19.123 -19.453 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -7.205 -18.163 -18.903 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.225 -18.919 -20.514 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.312 -18.255 -21.252 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.707 -18.037 -22.335 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.627 -16.666 -21.988 1.00 0.00 H new ATOM 600 N VAL A 42 -7.358 -16.046 -23.220 1.00 0.00 N ATOM 601 CA VAL A 42 -7.906 -16.437 -24.513 1.00 0.00 C ATOM 602 C VAL A 42 -6.784 -16.624 -25.522 1.00 0.00 C ATOM 603 O VAL A 42 -5.945 -15.742 -25.703 1.00 0.00 O ATOM 604 CB VAL A 42 -8.875 -15.350 -25.008 1.00 0.00 C ATOM 605 CG1 VAL A 42 -9.151 -15.525 -26.509 1.00 0.00 C ATOM 606 CG2 VAL A 42 -10.193 -15.449 -24.231 1.00 0.00 C ATOM 0 H VAL A 42 -6.708 -15.261 -23.253 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.442 -17.380 -24.404 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.423 -14.372 -24.844 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.838 -14.749 -26.845 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.215 -15.446 -27.063 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.595 -16.505 -26.685 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.880 -14.679 -24.581 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.637 -16.432 -24.391 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -10.000 -15.307 -23.168 1.00 0.00 H new ATOM 616 N ALA A 43 -6.780 -17.771 -26.187 1.00 0.00 N ATOM 617 CA ALA A 43 -5.767 -18.061 -27.187 1.00 0.00 C ATOM 618 C ALA A 43 -6.327 -17.743 -28.570 1.00 0.00 C ATOM 619 O ALA A 43 -7.418 -18.194 -28.920 1.00 0.00 O ATOM 620 CB ALA A 43 -5.393 -19.537 -27.117 1.00 0.00 C ATOM 0 H ALA A 43 -7.466 -18.513 -26.051 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.881 -17.455 -27.001 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.633 -19.756 -27.867 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.002 -19.767 -26.126 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.277 -20.146 -27.308 1.00 0.00 H new ATOM 626 N ALA A 44 -5.586 -16.970 -29.346 1.00 0.00 N ATOM 627 CA ALA A 44 -6.027 -16.595 -30.685 1.00 0.00 C ATOM 628 C ALA A 44 -5.587 -17.636 -31.719 1.00 0.00 C ATOM 629 O ALA A 44 -6.192 -17.764 -32.783 1.00 0.00 O ATOM 630 CB ALA A 44 -5.446 -15.229 -31.050 1.00 0.00 C ATOM 0 H ALA A 44 -4.679 -16.589 -29.076 1.00 0.00 H new ATOM 0 HA ALA A 44 -7.116 -16.547 -30.690 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.776 -14.949 -32.051 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.790 -14.484 -30.333 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.357 -15.279 -31.027 1.00 0.00 H new ATOM 636 N GLY A 45 -4.527 -18.376 -31.402 1.00 0.00 N ATOM 637 CA GLY A 45 -4.013 -19.396 -32.314 1.00 0.00 C ATOM 638 C GLY A 45 -4.732 -20.720 -32.119 1.00 0.00 C ATOM 639 O GLY A 45 -4.218 -21.776 -32.486 1.00 0.00 O ATOM 0 H GLY A 45 -4.010 -18.290 -30.527 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -4.135 -19.061 -33.344 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.944 -19.531 -32.147 1.00 0.00 H new ATOM 643 N GLU A 46 -5.925 -20.666 -31.526 1.00 0.00 N ATOM 644 CA GLU A 46 -6.707 -21.875 -31.279 1.00 0.00 C ATOM 645 C GLU A 46 -8.194 -21.585 -31.438 1.00 0.00 C ATOM 646 O GLU A 46 -8.653 -20.466 -31.197 1.00 0.00 O ATOM 647 CB GLU A 46 -6.437 -22.405 -29.866 1.00 0.00 C ATOM 648 CG GLU A 46 -4.966 -22.823 -29.720 1.00 0.00 C ATOM 649 CD GLU A 46 -4.655 -23.973 -30.670 1.00 0.00 C ATOM 650 OE1 GLU A 46 -5.590 -24.641 -31.076 1.00 0.00 O ATOM 651 OE2 GLU A 46 -3.491 -24.165 -30.982 1.00 0.00 O ATOM 0 H GLU A 46 -6.368 -19.803 -31.210 1.00 0.00 H new ATOM 0 HA GLU A 46 -6.410 -22.630 -32.007 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -6.678 -21.637 -29.131 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -7.085 -23.257 -29.661 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -4.315 -21.976 -29.936 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -4.765 -23.125 -28.692 1.00 0.00 H new ATOM 658 N GLY A 47 -8.938 -22.604 -31.849 1.00 0.00 N ATOM 659 CA GLY A 47 -10.370 -22.467 -32.046 1.00 0.00 C ATOM 660 C GLY A 47 -11.076 -22.294 -30.721 1.00 0.00 C ATOM 661 O GLY A 47 -12.200 -21.798 -30.673 1.00 0.00 O ATOM 0 H GLY A 47 -8.571 -23.534 -32.052 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -10.574 -21.609 -32.687 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -10.758 -23.347 -32.558 1.00 0.00 H new ATOM 665 N ILE A 48 -10.407 -22.705 -29.639 1.00 0.00 N ATOM 666 CA ILE A 48 -10.991 -22.580 -28.297 1.00 0.00 C ATOM 667 C ILE A 48 -9.983 -21.944 -27.328 1.00 0.00 C ATOM 668 O ILE A 48 -8.801 -22.290 -27.342 1.00 0.00 O ATOM 669 CB ILE A 48 -11.443 -23.981 -27.782 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.969 -24.100 -27.889 1.00 0.00 C ATOM 671 CG2 ILE A 48 -11.045 -24.215 -26.304 1.00 0.00 C ATOM 672 CD1 ILE A 48 -13.378 -25.569 -27.764 1.00 0.00 C ATOM 0 H ILE A 48 -9.476 -23.121 -29.662 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.864 -21.929 -28.351 1.00 0.00 H new ATOM 0 HB ILE A 48 -10.944 -24.727 -28.400 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -13.446 -23.511 -27.105 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -13.310 -23.697 -28.843 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -11.380 -25.203 -25.989 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.961 -24.151 -26.204 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -11.513 -23.456 -25.677 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -14.462 -25.653 -27.840 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -12.913 -26.146 -28.563 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -13.051 -25.957 -26.799 1.00 0.00 H new ATOM 684 N PRO A 49 -10.433 -21.057 -26.475 1.00 0.00 N ATOM 685 CA PRO A 49 -9.563 -20.408 -25.452 1.00 0.00 C ATOM 686 C PRO A 49 -9.241 -21.351 -24.291 1.00 0.00 C ATOM 687 O PRO A 49 -9.885 -22.389 -24.118 1.00 0.00 O ATOM 688 CB PRO A 49 -10.396 -19.212 -24.982 1.00 0.00 C ATOM 689 CG PRO A 49 -11.817 -19.624 -25.184 1.00 0.00 C ATOM 690 CD PRO A 49 -11.820 -20.551 -26.396 1.00 0.00 C ATOM 0 HA PRO A 49 -8.591 -20.121 -25.855 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -10.198 -18.980 -23.936 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -10.160 -18.317 -25.557 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -12.204 -20.134 -24.302 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.454 -18.756 -25.355 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -12.534 -21.365 -26.272 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -12.101 -20.017 -27.304 1.00 0.00 H new ATOM 698 N ILE A 50 -8.241 -20.976 -23.503 1.00 0.00 N ATOM 699 CA ILE A 50 -7.838 -21.780 -22.354 1.00 0.00 C ATOM 700 C ILE A 50 -8.783 -21.535 -21.181 1.00 0.00 C ATOM 701 O ILE A 50 -9.490 -20.528 -21.140 1.00 0.00 O ATOM 702 CB ILE A 50 -6.403 -21.441 -21.938 1.00 0.00 C ATOM 703 CG1 ILE A 50 -5.429 -21.862 -23.048 1.00 0.00 C ATOM 704 CG2 ILE A 50 -6.056 -22.173 -20.637 1.00 0.00 C ATOM 705 CD1 ILE A 50 -4.034 -21.323 -22.729 1.00 0.00 C ATOM 0 H ILE A 50 -7.696 -20.124 -23.637 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.884 -22.831 -22.639 1.00 0.00 H new ATOM 0 HB ILE A 50 -6.319 -20.366 -21.777 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -5.401 -22.949 -23.130 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.768 -21.478 -24.010 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -5.035 -21.930 -20.344 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.743 -21.862 -19.850 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -6.143 -23.249 -20.790 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -3.340 -21.620 -23.515 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -4.069 -20.235 -22.669 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.697 -21.729 -21.775 1.00 0.00 H new ATOM 717 N PHE A 51 -8.792 -22.467 -20.232 1.00 0.00 N ATOM 718 CA PHE A 51 -9.653 -22.342 -19.061 1.00 0.00 C ATOM 719 C PHE A 51 -9.105 -21.294 -18.097 1.00 0.00 C ATOM 720 O PHE A 51 -7.894 -21.182 -17.910 1.00 0.00 O ATOM 721 CB PHE A 51 -9.748 -23.684 -18.340 1.00 0.00 C ATOM 722 CG PHE A 51 -10.496 -24.672 -19.210 1.00 0.00 C ATOM 723 CD1 PHE A 51 -11.898 -24.641 -19.256 1.00 0.00 C ATOM 724 CD2 PHE A 51 -9.791 -25.612 -19.970 1.00 0.00 C ATOM 725 CE1 PHE A 51 -12.589 -25.554 -20.065 1.00 0.00 C ATOM 726 CE2 PHE A 51 -10.484 -26.524 -20.776 1.00 0.00 C ATOM 727 CZ PHE A 51 -11.883 -26.494 -20.825 1.00 0.00 C ATOM 0 H PHE A 51 -8.218 -23.310 -20.250 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.642 -22.032 -19.397 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.750 -24.061 -18.118 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -10.261 -23.561 -17.386 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -12.443 -23.916 -18.670 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.712 -25.634 -19.935 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -13.668 -25.532 -20.102 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.939 -27.251 -21.360 1.00 0.00 H new ATOM 0 HZ PHE A 51 -12.417 -27.196 -21.449 1.00 0.00 H new ATOM 737 N GLU A 52 -10.005 -20.535 -17.482 1.00 0.00 N ATOM 738 CA GLU A 52 -9.608 -19.504 -16.530 1.00 0.00 C ATOM 739 C GLU A 52 -9.246 -20.134 -15.198 1.00 0.00 C ATOM 740 O GLU A 52 -9.885 -21.091 -14.764 1.00 0.00 O ATOM 741 CB GLU A 52 -10.755 -18.502 -16.340 1.00 0.00 C ATOM 742 CG GLU A 52 -11.847 -19.107 -15.446 1.00 0.00 C ATOM 743 CD GLU A 52 -12.273 -20.461 -16.005 1.00 0.00 C ATOM 744 OE1 GLU A 52 -12.680 -20.501 -17.155 1.00 0.00 O ATOM 745 OE2 GLU A 52 -12.182 -21.438 -15.280 1.00 0.00 O ATOM 0 H GLU A 52 -11.012 -20.614 -17.625 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.736 -18.980 -16.920 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.375 -17.584 -15.891 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.176 -18.233 -17.309 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -11.475 -19.223 -14.428 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.705 -18.436 -15.397 1.00 0.00 H new ATOM 752 N ASP A 53 -8.221 -19.594 -14.550 1.00 0.00 N ATOM 753 CA ASP A 53 -7.785 -20.122 -13.264 1.00 0.00 C ATOM 754 C ASP A 53 -8.320 -19.249 -12.131 1.00 0.00 C ATOM 755 O ASP A 53 -8.546 -18.051 -12.306 1.00 0.00 O ATOM 756 CB ASP A 53 -6.245 -20.171 -13.231 1.00 0.00 C ATOM 757 CG ASP A 53 -5.754 -21.564 -12.830 1.00 0.00 C ATOM 758 OD1 ASP A 53 -6.381 -22.167 -11.976 1.00 0.00 O ATOM 759 OD2 ASP A 53 -4.761 -22.003 -13.387 1.00 0.00 O ATOM 0 H ASP A 53 -7.681 -18.798 -14.890 1.00 0.00 H new ATOM 0 HA ASP A 53 -8.176 -21.131 -13.131 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.847 -19.909 -14.211 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.868 -19.431 -12.525 1.00 0.00 H new ATOM 764 N PHE A 54 -8.524 -19.866 -10.966 1.00 0.00 N ATOM 765 CA PHE A 54 -9.028 -19.150 -9.796 1.00 0.00 C ATOM 766 C PHE A 54 -7.977 -19.131 -8.693 1.00 0.00 C ATOM 767 O PHE A 54 -7.517 -20.181 -8.241 1.00 0.00 O ATOM 768 CB PHE A 54 -10.289 -19.835 -9.277 1.00 0.00 C ATOM 769 CG PHE A 54 -11.406 -19.635 -10.267 1.00 0.00 C ATOM 770 CD1 PHE A 54 -11.587 -20.554 -11.309 1.00 0.00 C ATOM 771 CD2 PHE A 54 -12.261 -18.532 -10.150 1.00 0.00 C ATOM 772 CE1 PHE A 54 -12.622 -20.371 -12.232 1.00 0.00 C ATOM 773 CE2 PHE A 54 -13.297 -18.350 -11.074 1.00 0.00 C ATOM 774 CZ PHE A 54 -13.479 -19.269 -12.115 1.00 0.00 C ATOM 0 H PHE A 54 -8.348 -20.858 -10.809 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.258 -18.125 -10.087 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -10.104 -20.899 -9.129 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.568 -19.422 -8.308 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -10.927 -21.404 -11.400 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -12.121 -17.823 -9.348 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -12.760 -21.080 -13.035 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -13.957 -17.500 -10.984 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.279 -19.128 -12.827 1.00 0.00 H new ATOM 784 N VAL A 55 -7.596 -17.928 -8.267 1.00 0.00 N ATOM 785 CA VAL A 55 -6.593 -17.764 -7.212 1.00 0.00 C ATOM 786 C VAL A 55 -7.083 -16.770 -6.162 1.00 0.00 C ATOM 787 O VAL A 55 -7.719 -15.768 -6.487 1.00 0.00 O ATOM 788 CB VAL A 55 -5.270 -17.266 -7.813 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.421 -15.808 -8.257 1.00 0.00 C ATOM 790 CG2 VAL A 55 -4.153 -17.367 -6.759 1.00 0.00 C ATOM 0 H VAL A 55 -7.966 -17.052 -8.635 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.431 -18.732 -6.737 1.00 0.00 H new ATOM 0 HB VAL A 55 -5.013 -17.882 -8.675 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.481 -15.458 -8.683 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -6.208 -15.736 -9.007 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.682 -15.191 -7.397 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.215 -17.013 -7.188 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.411 -16.754 -5.895 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -4.040 -18.405 -6.447 1.00 0.00 H new ATOM 800 N ASP A 56 -6.772 -17.058 -4.905 1.00 0.00 N ATOM 801 CA ASP A 56 -7.175 -16.186 -3.809 1.00 0.00 C ATOM 802 C ASP A 56 -6.507 -14.819 -3.944 1.00 0.00 C ATOM 803 O ASP A 56 -5.405 -14.710 -4.479 1.00 0.00 O ATOM 804 CB ASP A 56 -6.788 -16.813 -2.470 1.00 0.00 C ATOM 805 CG ASP A 56 -7.702 -17.995 -2.161 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.706 -18.135 -2.841 1.00 0.00 O ATOM 807 OD2 ASP A 56 -7.389 -18.739 -1.245 1.00 0.00 O ATOM 0 H ASP A 56 -6.245 -17.883 -4.620 1.00 0.00 H new ATOM 0 HA ASP A 56 -8.257 -16.059 -3.849 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.750 -17.144 -2.501 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.861 -16.069 -1.677 1.00 0.00 H new ATOM 812 N SER A 57 -7.182 -13.781 -3.458 1.00 0.00 N ATOM 813 CA SER A 57 -6.645 -12.424 -3.527 1.00 0.00 C ATOM 814 C SER A 57 -5.377 -12.297 -2.685 1.00 0.00 C ATOM 815 O SER A 57 -4.459 -11.557 -3.035 1.00 0.00 O ATOM 816 CB SER A 57 -7.698 -11.417 -3.048 1.00 0.00 C ATOM 817 OG SER A 57 -8.597 -11.154 -4.109 1.00 0.00 O ATOM 0 H SER A 57 -8.098 -13.852 -3.014 1.00 0.00 H new ATOM 0 HA SER A 57 -6.390 -12.209 -4.565 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.236 -11.815 -2.188 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.217 -10.494 -2.724 1.00 0.00 H new ATOM 0 HG SER A 57 -8.820 -10.200 -4.120 1.00 0.00 H new ATOM 823 N SER A 58 -5.340 -13.012 -1.568 1.00 0.00 N ATOM 824 CA SER A 58 -4.191 -12.954 -0.676 1.00 0.00 C ATOM 825 C SER A 58 -2.904 -13.189 -1.456 1.00 0.00 C ATOM 826 O SER A 58 -1.871 -12.583 -1.167 1.00 0.00 O ATOM 827 CB SER A 58 -4.330 -14.013 0.417 1.00 0.00 C ATOM 828 OG SER A 58 -5.477 -13.727 1.205 1.00 0.00 O ATOM 0 H SER A 58 -6.087 -13.635 -1.260 1.00 0.00 H new ATOM 0 HA SER A 58 -4.152 -11.965 -0.219 1.00 0.00 H new ATOM 0 HB2 SER A 58 -4.419 -15.003 -0.029 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.438 -14.025 1.043 1.00 0.00 H new ATOM 0 HG SER A 58 -5.570 -14.406 1.906 1.00 0.00 H new ATOM 834 N VAL A 59 -2.972 -14.072 -2.445 1.00 0.00 N ATOM 835 CA VAL A 59 -1.805 -14.377 -3.262 1.00 0.00 C ATOM 836 C VAL A 59 -1.376 -13.139 -4.047 1.00 0.00 C ATOM 837 O VAL A 59 -0.187 -12.841 -4.152 1.00 0.00 O ATOM 838 CB VAL A 59 -2.120 -15.519 -4.229 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.844 -15.960 -4.957 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.692 -16.702 -3.444 1.00 0.00 C ATOM 0 H VAL A 59 -3.816 -14.586 -2.699 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.991 -14.683 -2.605 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.848 -15.175 -4.964 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -1.079 -16.774 -5.643 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.436 -15.119 -5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.109 -16.301 -4.228 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.918 -17.519 -4.130 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.961 -17.038 -2.708 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.605 -16.393 -2.934 1.00 0.00 H new ATOM 850 N GLY A 60 -2.352 -12.418 -4.598 1.00 0.00 N ATOM 851 CA GLY A 60 -2.053 -11.213 -5.365 1.00 0.00 C ATOM 852 C GLY A 60 -1.419 -11.563 -6.714 1.00 0.00 C ATOM 853 O GLY A 60 -1.722 -10.942 -7.739 1.00 0.00 O ATOM 0 H GLY A 60 -3.344 -12.645 -4.528 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.969 -10.644 -5.526 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -1.377 -10.574 -4.796 1.00 0.00 H new ATOM 857 N TYR A 61 -0.530 -12.560 -6.703 1.00 0.00 N ATOM 858 CA TYR A 61 0.176 -12.996 -7.912 1.00 0.00 C ATOM 859 C TYR A 61 -0.289 -14.373 -8.349 1.00 0.00 C ATOM 860 O TYR A 61 -0.866 -15.123 -7.570 1.00 0.00 O ATOM 861 CB TYR A 61 1.685 -13.032 -7.653 1.00 0.00 C ATOM 862 CG TYR A 61 2.010 -14.146 -6.690 1.00 0.00 C ATOM 863 CD1 TYR A 61 2.137 -15.457 -7.160 1.00 0.00 C ATOM 864 CD2 TYR A 61 2.182 -13.869 -5.330 1.00 0.00 C ATOM 865 CE1 TYR A 61 2.434 -16.495 -6.271 1.00 0.00 C ATOM 866 CE2 TYR A 61 2.481 -14.904 -4.438 1.00 0.00 C ATOM 867 CZ TYR A 61 2.607 -16.220 -4.908 1.00 0.00 C ATOM 868 OH TYR A 61 2.898 -17.242 -4.030 1.00 0.00 O ATOM 0 H TYR A 61 -0.281 -13.084 -5.864 1.00 0.00 H new ATOM 0 HA TYR A 61 -0.046 -12.283 -8.706 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.221 -13.181 -8.590 1.00 0.00 H new ATOM 0 HB3 TYR A 61 2.016 -12.077 -7.245 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.006 -15.668 -8.211 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.084 -12.856 -4.969 1.00 0.00 H new ATOM 0 HE1 TYR A 61 2.530 -17.507 -6.635 1.00 0.00 H new ATOM 0 HE2 TYR A 61 2.615 -14.690 -3.388 1.00 0.00 H new ATOM 0 HH TYR A 61 2.987 -16.879 -3.124 1.00 0.00 H new ATOM 878 N TYR A 62 -0.028 -14.703 -9.606 1.00 0.00 N ATOM 879 CA TYR A 62 -0.416 -16.002 -10.136 1.00 0.00 C ATOM 880 C TYR A 62 0.471 -16.366 -11.323 1.00 0.00 C ATOM 881 O TYR A 62 1.136 -15.503 -11.901 1.00 0.00 O ATOM 882 CB TYR A 62 -1.881 -15.978 -10.573 1.00 0.00 C ATOM 883 CG TYR A 62 -2.363 -17.395 -10.768 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.511 -18.238 -9.661 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.665 -17.863 -12.048 1.00 0.00 C ATOM 886 CE1 TYR A 62 -2.962 -19.549 -9.836 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.116 -19.176 -12.223 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.264 -20.019 -11.114 1.00 0.00 C ATOM 889 OH TYR A 62 -3.704 -21.314 -11.281 1.00 0.00 O ATOM 0 H TYR A 62 0.447 -14.095 -10.273 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.293 -16.751 -9.354 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.489 -15.474 -9.822 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.988 -15.414 -11.500 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.277 -17.875 -8.671 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.551 -17.212 -12.902 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.077 -20.199 -8.981 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.350 -19.539 -13.213 1.00 0.00 H new ATOM 0 HH TYR A 62 -3.537 -21.600 -12.203 1.00 0.00 H new ATOM 899 N THR A 63 0.475 -17.647 -11.687 1.00 0.00 N ATOM 900 CA THR A 63 1.284 -18.130 -12.812 1.00 0.00 C ATOM 901 C THR A 63 0.397 -18.743 -13.886 1.00 0.00 C ATOM 902 O THR A 63 -0.465 -19.574 -13.599 1.00 0.00 O ATOM 903 CB THR A 63 2.280 -19.185 -12.329 1.00 0.00 C ATOM 904 OG1 THR A 63 3.197 -18.588 -11.420 1.00 0.00 O ATOM 905 CG2 THR A 63 3.039 -19.767 -13.527 1.00 0.00 C ATOM 0 H THR A 63 -0.072 -18.371 -11.221 1.00 0.00 H new ATOM 0 HA THR A 63 1.822 -17.280 -13.232 1.00 0.00 H new ATOM 0 HB THR A 63 1.743 -19.988 -11.825 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.835 -19.263 -11.108 1.00 0.00 H new ATOM 0 HG21 THR A 63 3.748 -20.518 -13.179 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.332 -20.228 -14.217 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.578 -18.970 -14.039 1.00 0.00 H new ATOM 913 N VAL A 64 0.628 -18.333 -15.130 1.00 0.00 N ATOM 914 CA VAL A 64 -0.137 -18.847 -16.266 1.00 0.00 C ATOM 915 C VAL A 64 0.809 -19.204 -17.415 1.00 0.00 C ATOM 916 O VAL A 64 1.370 -18.318 -18.063 1.00 0.00 O ATOM 917 CB VAL A 64 -1.174 -17.799 -16.721 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.519 -18.069 -16.031 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.673 -16.401 -16.337 1.00 0.00 C ATOM 0 H VAL A 64 1.339 -17.646 -15.379 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.668 -19.749 -15.962 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.307 -17.860 -17.801 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.249 -17.327 -16.354 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.871 -19.065 -16.298 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.392 -18.006 -14.950 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.400 -15.654 -16.655 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.544 -16.345 -15.256 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.282 -16.209 -16.827 1.00 0.00 H new ATOM 929 N THR A 65 0.973 -20.498 -17.667 1.00 0.00 N ATOM 930 CA THR A 65 1.851 -20.958 -18.741 1.00 0.00 C ATOM 931 C THR A 65 1.120 -21.929 -19.643 1.00 0.00 C ATOM 932 O THR A 65 0.036 -22.411 -19.311 1.00 0.00 O ATOM 933 CB THR A 65 3.084 -21.656 -18.150 1.00 0.00 C ATOM 934 OG1 THR A 65 2.797 -23.036 -17.985 1.00 0.00 O ATOM 935 CG2 THR A 65 3.417 -21.053 -16.782 1.00 0.00 C ATOM 0 H THR A 65 0.513 -21.245 -17.146 1.00 0.00 H new ATOM 0 HA THR A 65 2.162 -20.090 -19.323 1.00 0.00 H new ATOM 0 HB THR A 65 3.932 -21.523 -18.822 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.580 -23.490 -17.609 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.293 -21.552 -16.368 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.625 -19.989 -16.894 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.570 -21.188 -16.109 1.00 0.00 H new ATOM 943 N GLY A 66 1.726 -22.212 -20.797 1.00 0.00 N ATOM 944 CA GLY A 66 1.136 -23.126 -21.763 1.00 0.00 C ATOM 945 C GLY A 66 0.623 -22.386 -22.990 1.00 0.00 C ATOM 946 O GLY A 66 -0.274 -22.871 -23.681 1.00 0.00 O ATOM 0 H GLY A 66 2.624 -21.820 -21.081 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.878 -23.865 -22.066 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.316 -23.671 -21.296 1.00 0.00 H new ATOM 950 N LEU A 67 1.186 -21.206 -23.263 1.00 0.00 N ATOM 951 CA LEU A 67 0.761 -20.404 -24.410 1.00 0.00 C ATOM 952 C LEU A 67 1.739 -20.609 -25.552 1.00 0.00 C ATOM 953 O LEU A 67 2.867 -20.116 -25.524 1.00 0.00 O ATOM 954 CB LEU A 67 0.726 -18.924 -24.024 1.00 0.00 C ATOM 955 CG LEU A 67 0.308 -18.778 -22.556 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.275 -17.299 -22.192 1.00 0.00 C ATOM 957 CD2 LEU A 67 -1.085 -19.376 -22.351 1.00 0.00 C ATOM 0 H LEU A 67 1.933 -20.788 -22.708 1.00 0.00 H new ATOM 0 HA LEU A 67 -0.237 -20.715 -24.720 1.00 0.00 H new ATOM 0 HB2 LEU A 67 1.707 -18.476 -24.178 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.026 -18.388 -24.666 1.00 0.00 H new ATOM 0 HG LEU A 67 1.023 -19.303 -21.923 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.022 -17.188 -21.149 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.265 -16.867 -22.336 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.442 -16.783 -22.830 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.377 -19.269 -21.306 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.802 -18.853 -22.983 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -1.070 -20.433 -22.617 1.00 0.00 H new ATOM 969 N GLU A 68 1.305 -21.345 -26.546 1.00 0.00 N ATOM 970 CA GLU A 68 2.174 -21.645 -27.689 1.00 0.00 C ATOM 971 C GLU A 68 2.859 -20.363 -28.220 1.00 0.00 C ATOM 972 O GLU A 68 2.225 -19.312 -28.314 1.00 0.00 O ATOM 973 CB GLU A 68 1.371 -22.329 -28.825 1.00 0.00 C ATOM 974 CG GLU A 68 -0.076 -22.524 -28.393 1.00 0.00 C ATOM 975 CD GLU A 68 -0.849 -23.287 -29.457 1.00 0.00 C ATOM 976 OE1 GLU A 68 -1.215 -22.675 -30.445 1.00 0.00 O ATOM 977 OE2 GLU A 68 -1.075 -24.470 -29.262 1.00 0.00 O ATOM 0 H GLU A 68 0.370 -21.749 -26.600 1.00 0.00 H new ATOM 0 HA GLU A 68 2.948 -22.331 -27.345 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.411 -21.720 -29.728 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.819 -23.292 -29.070 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.110 -23.068 -27.449 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -0.544 -21.555 -28.219 1.00 0.00 H new ATOM 984 N PRO A 69 4.122 -20.440 -28.596 1.00 0.00 N ATOM 985 CA PRO A 69 4.879 -19.274 -29.160 1.00 0.00 C ATOM 986 C PRO A 69 4.440 -18.956 -30.579 1.00 0.00 C ATOM 987 O PRO A 69 3.929 -19.815 -31.296 1.00 0.00 O ATOM 988 CB PRO A 69 6.341 -19.735 -29.113 1.00 0.00 C ATOM 989 CG PRO A 69 6.274 -21.221 -29.222 1.00 0.00 C ATOM 990 CD PRO A 69 4.974 -21.645 -28.529 1.00 0.00 C ATOM 0 HA PRO A 69 4.710 -18.354 -28.601 1.00 0.00 H new ATOM 0 HB2 PRO A 69 6.919 -19.304 -29.931 1.00 0.00 H new ATOM 0 HB3 PRO A 69 6.823 -19.427 -28.185 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.278 -21.535 -30.266 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.138 -21.685 -28.746 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.509 -22.491 -29.036 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.153 -21.950 -27.498 1.00 0.00 H new ATOM 998 N GLY A 70 4.658 -17.719 -30.978 1.00 0.00 N ATOM 999 CA GLY A 70 4.300 -17.291 -32.316 1.00 0.00 C ATOM 1000 C GLY A 70 2.793 -17.107 -32.465 1.00 0.00 C ATOM 1001 O GLY A 70 2.301 -16.717 -33.526 1.00 0.00 O ATOM 0 H GLY A 70 5.080 -16.994 -30.397 1.00 0.00 H new ATOM 0 HA2 GLY A 70 4.806 -16.353 -32.546 1.00 0.00 H new ATOM 0 HA3 GLY A 70 4.650 -18.027 -33.040 1.00 0.00 H new ATOM 1005 N ILE A 71 2.062 -17.400 -31.396 1.00 0.00 N ATOM 1006 CA ILE A 71 0.604 -17.287 -31.395 1.00 0.00 C ATOM 1007 C ILE A 71 0.183 -16.130 -30.502 1.00 0.00 C ATOM 1008 O ILE A 71 0.752 -15.900 -29.433 1.00 0.00 O ATOM 1009 CB ILE A 71 -0.027 -18.614 -30.899 1.00 0.00 C ATOM 1010 CG1 ILE A 71 -0.181 -19.618 -32.061 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -1.420 -18.373 -30.289 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.188 -20.163 -32.474 1.00 0.00 C ATOM 0 H ILE A 71 2.456 -17.720 -30.512 1.00 0.00 H new ATOM 0 HA ILE A 71 0.253 -17.094 -32.409 1.00 0.00 H new ATOM 0 HB ILE A 71 0.643 -19.019 -30.141 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.831 -20.439 -31.758 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.658 -19.131 -32.911 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.838 -19.321 -29.950 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.334 -17.691 -29.443 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -2.076 -17.936 -31.042 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.066 -20.870 -33.294 1.00 0.00 H new ATOM 0 HD12 ILE A 71 1.825 -19.340 -32.797 1.00 0.00 H new ATOM 0 HD13 ILE A 71 1.650 -20.668 -31.626 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.821 -15.409 -30.964 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.346 -14.275 -30.227 1.00 0.00 C ATOM 1026 C ASP A 72 -2.296 -14.751 -29.127 1.00 0.00 C ATOM 1027 O ASP A 72 -3.285 -15.433 -29.397 1.00 0.00 O ATOM 1028 CB ASP A 72 -2.088 -13.349 -31.185 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.890 -12.303 -30.404 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.794 -12.695 -29.682 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.577 -11.131 -30.524 1.00 0.00 O ATOM 0 H ASP A 72 -1.291 -15.590 -31.851 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.519 -13.736 -29.765 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.377 -12.853 -31.845 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.757 -13.931 -31.818 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.982 -14.375 -27.893 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.799 -14.750 -26.737 1.00 0.00 C ATOM 1038 C TYR A 73 -3.426 -13.521 -26.097 1.00 0.00 C ATOM 1039 O TYR A 73 -2.728 -12.597 -25.686 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.926 -15.466 -25.683 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.917 -16.948 -25.920 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -1.051 -17.509 -26.853 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.791 -17.756 -25.199 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -1.063 -18.892 -27.068 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.804 -19.129 -25.407 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.944 -19.701 -26.342 1.00 0.00 C ATOM 1047 OH TYR A 73 -1.974 -21.062 -26.546 1.00 0.00 O ATOM 0 H TYR A 73 -1.165 -13.809 -27.663 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.588 -15.417 -27.085 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.907 -15.080 -25.724 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.307 -15.255 -24.684 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.372 -16.880 -27.409 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.461 -17.314 -24.476 1.00 0.00 H new ATOM 0 HE1 TYR A 73 -0.394 -19.333 -27.792 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.481 -19.754 -24.844 1.00 0.00 H new ATOM 0 HH TYR A 73 -2.644 -21.466 -25.956 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.747 -13.531 -26.014 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.491 -12.438 -25.401 1.00 0.00 C ATOM 1059 C ASP A 74 -5.747 -12.784 -23.940 1.00 0.00 C ATOM 1060 O ASP A 74 -6.521 -13.690 -23.641 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.818 -12.239 -26.134 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.613 -11.392 -27.388 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -5.499 -10.943 -27.610 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -7.575 -11.213 -28.124 1.00 0.00 O ATOM 0 H ASP A 74 -5.331 -14.289 -26.366 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.917 -11.513 -25.466 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.239 -13.207 -26.406 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.536 -11.754 -25.473 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.093 -12.060 -23.030 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.264 -12.305 -21.607 1.00 0.00 C ATOM 1071 C ILE A 75 -5.649 -11.031 -20.870 1.00 0.00 C ATOM 1072 O ILE A 75 -4.840 -10.109 -20.752 1.00 0.00 O ATOM 1073 CB ILE A 75 -3.929 -12.835 -21.041 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -2.745 -12.100 -21.720 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.816 -14.343 -21.295 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.312 -12.819 -23.009 1.00 0.00 C ATOM 0 H ILE A 75 -4.445 -11.305 -23.256 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.064 -13.032 -21.467 1.00 0.00 H new ATOM 0 HB ILE A 75 -3.899 -12.651 -19.967 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.034 -11.075 -21.951 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -1.903 -12.046 -21.030 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.872 -14.710 -20.893 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.643 -14.857 -20.806 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.853 -14.535 -22.367 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.480 -12.281 -23.464 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.000 -13.836 -22.771 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.149 -12.850 -23.707 1.00 0.00 H new ATOM 1088 N SER A 76 -6.878 -10.973 -20.361 1.00 0.00 N ATOM 1089 CA SER A 76 -7.341 -9.807 -19.624 1.00 0.00 C ATOM 1090 C SER A 76 -7.381 -10.126 -18.140 1.00 0.00 C ATOM 1091 O SER A 76 -8.007 -11.104 -17.725 1.00 0.00 O ATOM 1092 CB SER A 76 -8.744 -9.431 -20.086 1.00 0.00 C ATOM 1093 OG SER A 76 -9.275 -8.444 -19.215 1.00 0.00 O ATOM 0 H SER A 76 -7.567 -11.720 -20.447 1.00 0.00 H new ATOM 0 HA SER A 76 -6.659 -8.977 -19.806 1.00 0.00 H new ATOM 0 HB2 SER A 76 -8.714 -9.053 -21.108 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.386 -10.312 -20.091 1.00 0.00 H new ATOM 0 HG SER A 76 -10.251 -8.427 -19.297 1.00 0.00 H new ATOM 1099 N VAL A 77 -6.713 -9.305 -17.340 1.00 0.00 N ATOM 1100 CA VAL A 77 -6.690 -9.516 -15.899 1.00 0.00 C ATOM 1101 C VAL A 77 -7.867 -8.803 -15.248 1.00 0.00 C ATOM 1102 O VAL A 77 -7.824 -7.597 -15.013 1.00 0.00 O ATOM 1103 CB VAL A 77 -5.382 -8.975 -15.324 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -5.384 -9.139 -13.803 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -4.203 -9.751 -15.917 1.00 0.00 C ATOM 0 H VAL A 77 -6.184 -8.494 -17.661 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.764 -10.584 -15.694 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.287 -7.919 -15.576 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.450 -8.753 -13.394 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -6.222 -8.586 -13.379 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.481 -10.195 -13.551 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -3.270 -9.365 -15.507 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.300 -10.807 -15.667 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.199 -9.634 -17.001 1.00 0.00 H new ATOM 1115 N ILE A 78 -8.916 -9.566 -14.954 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.109 -9.009 -14.326 1.00 0.00 C ATOM 1117 C ILE A 78 -9.914 -8.902 -12.822 1.00 0.00 C ATOM 1118 O ILE A 78 -9.407 -9.826 -12.183 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.332 -9.885 -14.618 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -11.599 -9.892 -16.126 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -12.555 -9.324 -13.883 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -12.716 -10.888 -16.438 1.00 0.00 C ATOM 0 H ILE A 78 -8.964 -10.568 -15.140 1.00 0.00 H new ATOM 0 HA ILE A 78 -10.276 -8.015 -14.741 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.142 -10.902 -14.275 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -11.882 -8.894 -16.461 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -10.692 -10.164 -16.666 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.423 -9.949 -14.092 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.363 -9.317 -12.810 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -12.749 -8.307 -14.223 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -12.908 -10.895 -17.511 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.415 -11.885 -16.117 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -13.623 -10.595 -15.909 1.00 0.00 H new ATOM 1134 N THR A 79 -10.322 -7.768 -12.259 1.00 0.00 N ATOM 1135 CA THR A 79 -10.201 -7.536 -10.817 1.00 0.00 C ATOM 1136 C THR A 79 -11.581 -7.462 -10.178 1.00 0.00 C ATOM 1137 O THR A 79 -12.375 -6.580 -10.501 1.00 0.00 O ATOM 1138 CB THR A 79 -9.455 -6.230 -10.556 1.00 0.00 C ATOM 1139 OG1 THR A 79 -10.052 -5.184 -11.306 1.00 0.00 O ATOM 1140 CG2 THR A 79 -7.995 -6.395 -10.970 1.00 0.00 C ATOM 0 H THR A 79 -10.739 -6.994 -12.776 1.00 0.00 H new ATOM 0 HA THR A 79 -9.645 -8.365 -10.380 1.00 0.00 H new ATOM 0 HB THR A 79 -9.506 -5.983 -9.496 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.361 -4.710 -11.814 1.00 0.00 H new ATOM 0 HG21 THR A 79 -7.457 -5.465 -10.786 1.00 0.00 H new ATOM 0 HG22 THR A 79 -7.541 -7.198 -10.390 1.00 0.00 H new ATOM 0 HG23 THR A 79 -7.943 -6.640 -12.031 1.00 0.00 H new ATOM 1148 N LEU A 80 -11.856 -8.397 -9.267 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.150 -8.443 -8.578 1.00 0.00 C ATOM 1150 C LEU A 80 -12.994 -8.052 -7.119 1.00 0.00 C ATOM 1151 O LEU A 80 -12.403 -8.784 -6.321 1.00 0.00 O ATOM 1152 CB LEU A 80 -13.755 -9.867 -8.682 1.00 0.00 C ATOM 1153 CG LEU A 80 -14.971 -9.876 -9.617 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -14.505 -9.681 -11.057 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -15.699 -11.213 -9.483 1.00 0.00 C ATOM 0 H LEU A 80 -11.204 -9.130 -8.989 1.00 0.00 H new ATOM 0 HA LEU A 80 -13.822 -7.731 -9.057 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -13.001 -10.561 -9.053 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.049 -10.215 -7.692 1.00 0.00 H new ATOM 0 HG LEU A 80 -15.650 -9.067 -9.348 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -15.368 -9.687 -11.723 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -13.985 -8.727 -11.145 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -13.828 -10.490 -11.333 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.564 -11.224 -10.146 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -15.023 -12.024 -9.755 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -16.029 -11.346 -8.453 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.531 -6.890 -6.774 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.465 -6.407 -5.404 1.00 0.00 C ATOM 1169 C ILE A 81 -14.720 -5.612 -5.065 1.00 0.00 C ATOM 1170 O ILE A 81 -15.256 -4.893 -5.908 1.00 0.00 O ATOM 1171 CB ILE A 81 -12.222 -5.533 -5.217 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -12.351 -4.234 -6.056 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -10.979 -6.324 -5.661 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -12.764 -3.061 -5.163 1.00 0.00 C ATOM 0 H ILE A 81 -14.015 -6.268 -7.421 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.401 -7.263 -4.732 1.00 0.00 H new ATOM 0 HB ILE A 81 -12.126 -5.259 -4.166 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -11.401 -4.012 -6.543 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -13.089 -4.375 -6.846 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -10.090 -5.707 -5.531 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -10.887 -7.226 -5.057 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -11.079 -6.599 -6.711 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -12.850 -2.157 -5.766 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.725 -3.279 -4.697 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -12.011 -2.910 -4.389 1.00 0.00 H new ATOM 1186 N ASN A 82 -15.185 -5.737 -3.827 1.00 0.00 N ATOM 1187 CA ASN A 82 -16.379 -5.018 -3.392 1.00 0.00 C ATOM 1188 C ASN A 82 -16.137 -3.508 -3.366 1.00 0.00 C ATOM 1189 O ASN A 82 -16.924 -2.733 -3.908 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.777 -5.489 -1.996 1.00 0.00 C ATOM 1191 CG ASN A 82 -18.128 -4.891 -1.612 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.188 -3.782 -1.080 1.00 0.00 O ATOM 1193 ND2 ASN A 82 -19.220 -5.563 -1.856 1.00 0.00 N ATOM 0 H ASN A 82 -14.758 -6.325 -3.111 1.00 0.00 H new ATOM 0 HA ASN A 82 -17.180 -5.226 -4.102 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.831 -6.577 -1.971 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -16.019 -5.191 -1.272 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -20.127 -5.170 -1.606 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -19.166 -6.481 -2.297 1.00 0.00 H new ATOM 1457 N GLY B 207 2.234 -1.673 -19.430 1.00 0.00 N ATOM 1458 CA GLY B 207 1.016 -1.093 -20.004 1.00 0.00 C ATOM 1459 C GLY B 207 0.457 0.000 -19.108 1.00 0.00 C ATOM 1460 O GLY B 207 1.184 0.889 -18.666 1.00 0.00 O ATOM 0 HA2 GLY B 207 1.234 -0.683 -20.990 1.00 0.00 H new ATOM 0 HA3 GLY B 207 0.268 -1.873 -20.142 1.00 0.00 H new ATOM 1464 N SER B 208 -0.843 -0.079 -18.839 1.00 0.00 N ATOM 1465 CA SER B 208 -1.497 0.905 -17.988 1.00 0.00 C ATOM 1466 C SER B 208 -2.886 0.424 -17.580 1.00 0.00 C ATOM 1467 O SER B 208 -3.385 -0.574 -18.099 1.00 0.00 O ATOM 1468 CB SER B 208 -1.600 2.235 -18.720 1.00 0.00 C ATOM 1469 OG SER B 208 -2.438 2.084 -19.859 1.00 0.00 O ATOM 0 H SER B 208 -1.459 -0.809 -19.196 1.00 0.00 H new ATOM 0 HA SER B 208 -0.899 1.037 -17.086 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.005 2.998 -18.055 1.00 0.00 H new ATOM 0 HB3 SER B 208 -0.610 2.572 -19.026 1.00 0.00 H new ATOM 0 HG SER B 208 -2.507 2.940 -20.330 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.507 1.147 -16.653 1.00 0.00 N ATOM 1476 CA TRP B 209 -4.844 0.794 -16.183 1.00 0.00 C ATOM 1477 C TRP B 209 -5.907 1.422 -17.079 1.00 0.00 C ATOM 1478 O TRP B 209 -5.657 2.431 -17.738 1.00 0.00 O ATOM 1479 CB TRP B 209 -5.043 1.275 -14.746 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.243 0.415 -13.826 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -2.938 0.595 -13.541 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -4.670 -0.756 -13.071 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -2.533 -0.386 -12.656 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -3.567 -1.241 -12.332 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -5.895 -1.430 -12.957 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -3.679 -2.361 -11.507 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -6.012 -2.557 -12.127 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -4.905 -3.020 -11.403 1.00 0.00 C ATOM 0 H TRP B 209 -3.109 1.977 -16.214 1.00 0.00 H new ATOM 0 HA TRP B 209 -4.943 -0.291 -16.218 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.733 2.316 -14.652 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -6.099 1.231 -14.478 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.311 1.379 -13.940 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -1.586 -0.468 -12.287 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -6.754 -1.080 -13.511 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -2.823 -2.716 -10.953 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -6.959 -3.069 -12.046 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -5.000 -3.886 -10.765 1.00 0.00 H new ATOM 1499 N THR B 210 -7.097 0.821 -17.099 1.00 0.00 N ATOM 1500 CA THR B 210 -8.199 1.332 -17.915 1.00 0.00 C ATOM 1501 C THR B 210 -9.487 1.379 -17.100 1.00 0.00 C ATOM 1502 O THR B 210 -9.829 0.418 -16.409 1.00 0.00 O ATOM 1503 CB THR B 210 -8.401 0.434 -19.135 1.00 0.00 C ATOM 1504 OG1 THR B 210 -8.917 -0.822 -18.712 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.060 0.226 -19.838 1.00 0.00 C ATOM 0 H THR B 210 -7.322 -0.017 -16.562 1.00 0.00 H new ATOM 0 HA THR B 210 -7.950 2.341 -18.242 1.00 0.00 H new ATOM 0 HB THR B 210 -9.103 0.902 -19.825 1.00 0.00 H new ATOM 0 HG1 THR B 210 -8.501 -1.077 -17.862 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.201 -0.414 -20.709 1.00 0.00 H new ATOM 0 HG22 THR B 210 -6.663 1.190 -20.157 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.358 -0.246 -19.150 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.199 2.502 -17.187 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.454 2.672 -16.454 1.00 0.00 C ATOM 1515 C TRP B 211 -12.645 2.327 -17.341 1.00 0.00 C ATOM 1516 O TRP B 211 -12.924 3.018 -18.321 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.580 4.120 -15.965 1.00 0.00 C ATOM 1518 CG TRP B 211 -12.967 4.356 -15.451 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -13.891 5.143 -16.049 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -13.606 3.798 -14.267 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -15.053 5.111 -15.302 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -14.929 4.297 -14.195 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.171 2.921 -13.258 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -15.790 3.937 -13.159 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -14.035 2.556 -12.214 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.341 3.064 -12.164 1.00 0.00 C ATOM 0 H TRP B 211 -9.930 3.305 -17.755 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.448 1.997 -15.598 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -10.851 4.314 -15.178 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.360 4.810 -16.779 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -13.744 5.704 -16.960 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -15.900 5.627 -15.540 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.166 2.526 -13.286 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -16.796 4.329 -13.126 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -13.692 1.880 -11.445 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -16.000 2.781 -11.357 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.348 1.258 -16.985 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.513 0.837 -17.752 1.00 0.00 C ATOM 1539 C GLU B 212 -15.383 -0.111 -16.927 1.00 0.00 C ATOM 1540 O GLU B 212 -14.922 -0.698 -15.951 1.00 0.00 O ATOM 1541 CB GLU B 212 -14.054 0.146 -19.061 1.00 0.00 C ATOM 1542 CG GLU B 212 -14.293 -1.383 -19.012 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.609 -2.069 -20.186 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -13.129 -1.368 -21.061 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -13.570 -3.288 -20.190 1.00 0.00 O ATOM 0 H GLU B 212 -13.134 0.672 -16.178 1.00 0.00 H new ATOM 0 HA GLU B 212 -15.108 1.715 -18.002 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.594 0.572 -19.907 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -12.995 0.344 -19.226 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.910 -1.787 -18.075 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.363 -1.590 -19.035 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.622 -0.290 -17.359 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.517 -1.213 -16.685 1.00 0.00 C ATOM 1554 C ASN B 213 -17.562 -0.937 -15.187 1.00 0.00 C ATOM 1555 O ASN B 213 -17.702 -1.854 -14.379 1.00 0.00 O ATOM 1556 CB ASN B 213 -17.040 -2.649 -16.936 1.00 0.00 C ATOM 1557 CG ASN B 213 -17.364 -3.076 -18.363 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -16.498 -3.596 -19.070 1.00 0.00 O ATOM 1559 ND2 ASN B 213 -18.570 -2.910 -18.824 1.00 0.00 N ATOM 0 H ASN B 213 -17.026 0.187 -18.165 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.523 -1.079 -17.083 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.966 -2.717 -16.765 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.519 -3.327 -16.229 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -18.800 -3.210 -19.771 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -19.285 -2.480 -18.238 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.447 0.334 -14.824 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.479 0.724 -13.423 1.00 0.00 C ATOM 1568 C GLY B 214 -16.424 -0.027 -12.614 1.00 0.00 C ATOM 1569 O GLY B 214 -16.502 -0.100 -11.387 1.00 0.00 O ATOM 0 H GLY B 214 -17.331 1.108 -15.478 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.309 1.797 -13.338 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.468 0.524 -13.010 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.437 -0.591 -13.311 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.363 -1.336 -12.664 1.00 0.00 C ATOM 1575 C LYS B 215 -13.037 -1.105 -13.373 1.00 0.00 C ATOM 1576 O LYS B 215 -12.999 -0.881 -14.584 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.688 -2.825 -12.691 1.00 0.00 C ATOM 1578 CG LYS B 215 -15.950 -3.071 -11.869 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.214 -4.582 -11.753 1.00 0.00 C ATOM 1580 CE LYS B 215 -16.779 -5.123 -13.071 1.00 0.00 C ATOM 1581 NZ LYS B 215 -17.238 -6.526 -12.875 1.00 0.00 N ATOM 0 H LYS B 215 -15.362 -0.544 -14.327 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.276 -0.987 -11.635 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -14.836 -3.160 -13.718 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -13.856 -3.400 -12.285 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -15.838 -2.635 -10.876 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -16.802 -2.579 -12.339 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -15.289 -5.102 -11.505 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -16.916 -4.775 -10.942 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -17.609 -4.501 -13.406 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -16.017 -5.084 -13.849 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -17.622 -6.894 -13.769 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -16.435 -7.115 -12.574 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -17.978 -6.550 -12.145 1.00 0.00 H new ATOM 1595 N TRP B 216 -11.948 -1.170 -12.615 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.622 -0.976 -13.187 1.00 0.00 C ATOM 1597 C TRP B 216 -10.082 -2.306 -13.699 1.00 0.00 C ATOM 1598 O TRP B 216 -9.827 -3.223 -12.919 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.675 -0.419 -12.125 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.205 0.889 -11.641 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.285 1.035 -10.849 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -9.697 2.230 -11.898 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.479 2.382 -10.598 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.526 3.159 -11.225 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.613 2.724 -12.643 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.283 4.531 -11.288 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.368 4.105 -12.709 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -9.201 5.006 -12.032 1.00 0.00 C ATOM 0 H TRP B 216 -11.957 -1.354 -11.612 1.00 0.00 H new ATOM 0 HA TRP B 216 -10.692 -0.270 -14.014 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.586 -1.120 -11.295 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -8.676 -0.290 -12.542 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -11.900 0.231 -10.471 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.233 2.755 -10.021 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -7.965 2.038 -13.168 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -10.928 5.222 -10.765 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.533 4.475 -13.285 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -9.006 6.067 -12.086 1.00 0.00 H new ATOM 1619 N THR B 217 -9.920 -2.408 -15.017 1.00 0.00 N ATOM 1620 CA THR B 217 -9.422 -3.638 -15.639 1.00 0.00 C ATOM 1621 C THR B 217 -8.127 -3.368 -16.394 1.00 0.00 C ATOM 1622 O THR B 217 -8.018 -2.386 -17.131 1.00 0.00 O ATOM 1623 CB THR B 217 -10.466 -4.192 -16.619 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.732 -4.222 -15.982 1.00 0.00 O ATOM 1625 CG2 THR B 217 -10.082 -5.618 -17.038 1.00 0.00 C ATOM 0 H THR B 217 -10.125 -1.657 -15.675 1.00 0.00 H new ATOM 0 HA THR B 217 -9.234 -4.367 -14.851 1.00 0.00 H new ATOM 0 HB THR B 217 -10.506 -3.554 -17.502 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.403 -4.573 -16.604 1.00 0.00 H new ATOM 0 HG21 THR B 217 -10.826 -6.006 -17.733 1.00 0.00 H new ATOM 0 HG22 THR B 217 -9.106 -5.604 -17.522 1.00 0.00 H new ATOM 0 HG23 THR B 217 -10.041 -6.258 -16.156 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.152 -4.252 -16.208 1.00 0.00 N ATOM 1634 CA TRP B 218 -5.864 -4.121 -16.884 1.00 0.00 C ATOM 1635 C TRP B 218 -5.853 -4.973 -18.152 1.00 0.00 C ATOM 1636 O TRP B 218 -5.754 -6.199 -18.087 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.738 -4.581 -15.957 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.427 -4.426 -16.659 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -2.922 -5.298 -17.562 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.446 -3.356 -16.529 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.695 -4.828 -17.999 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.358 -3.636 -17.389 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.396 -2.180 -15.758 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.260 -2.782 -17.479 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.291 -1.320 -15.847 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.226 -1.620 -16.705 1.00 0.00 C ATOM 0 H TRP B 218 -7.228 -5.065 -15.597 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.711 -3.074 -17.148 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -4.744 -3.993 -15.039 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -4.889 -5.622 -15.670 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.398 -6.211 -17.888 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.112 -5.304 -18.687 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.213 -1.938 -15.094 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.559 -3.017 -18.143 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.262 -0.421 -15.250 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.621 -0.953 -16.768 1.00 0.00 H new ATOM 1657 N LYS B 219 -5.968 -4.313 -19.304 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.986 -5.005 -20.593 1.00 0.00 C ATOM 1659 C LYS B 219 -5.007 -4.369 -21.558 1.00 0.00 C ATOM 1660 O LYS B 219 -4.495 -3.276 -21.312 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.392 -4.950 -21.195 1.00 0.00 C ATOM 1662 CG LYS B 219 -8.344 -5.776 -20.332 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.750 -5.760 -20.955 1.00 0.00 C ATOM 1664 CE LYS B 219 -10.458 -4.402 -20.715 1.00 0.00 C ATOM 1665 NZ LYS B 219 -10.836 -3.811 -22.030 1.00 0.00 N ATOM 0 H LYS B 219 -6.050 -3.299 -19.371 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.696 -6.042 -20.426 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.736 -3.917 -21.250 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.379 -5.336 -22.214 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.982 -6.801 -20.252 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -8.379 -5.371 -19.321 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -9.678 -5.950 -22.026 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -10.348 -6.565 -20.528 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -11.345 -4.544 -20.098 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -9.798 -3.724 -20.174 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -11.312 -2.899 -21.877 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -9.981 -3.663 -22.603 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -11.480 -4.458 -22.529 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.757 -5.059 -22.658 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.847 -4.549 -23.664 1.00 0.00 C ATOM 1681 C GLY B 220 -3.751 -5.500 -24.851 1.00 0.00 C ATOM 1682 O GLY B 220 -4.620 -6.352 -25.049 1.00 0.00 O ATOM 0 H GLY B 220 -5.169 -5.967 -22.874 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -4.188 -3.571 -24.004 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.859 -4.408 -23.227 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.715 -5.324 -25.663 1.00 0.00 N ATOM 1687 CA ILE B 221 -2.552 -6.154 -26.850 1.00 0.00 C ATOM 1688 C ILE B 221 -2.540 -7.630 -26.465 1.00 0.00 C ATOM 1689 O ILE B 221 -3.517 -8.343 -26.702 1.00 0.00 O ATOM 1690 CB ILE B 221 -1.235 -5.806 -27.554 1.00 0.00 C ATOM 1691 CG1 ILE B 221 -1.112 -4.283 -27.699 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -1.195 -6.455 -28.951 1.00 0.00 C ATOM 1693 CD1 ILE B 221 0.195 -3.938 -28.414 1.00 0.00 C ATOM 0 H ILE B 221 -1.985 -4.625 -25.525 1.00 0.00 H new ATOM 0 HA ILE B 221 -3.388 -5.964 -27.523 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.406 -6.185 -26.957 1.00 0.00 H new ATOM 0 HG12 ILE B 221 -1.960 -3.892 -28.261 1.00 0.00 H new ATOM 0 HG13 ILE B 221 -1.136 -3.811 -26.717 1.00 0.00 H new ATOM 0 HG21 ILE B 221 -0.256 -6.202 -29.443 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -1.272 -7.538 -28.852 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -2.029 -6.085 -29.548 1.00 0.00 H new ATOM 0 HD11 ILE B 221 0.280 -2.856 -28.516 1.00 0.00 H new ATOM 0 HD12 ILE B 221 1.037 -4.315 -27.834 1.00 0.00 H new ATOM 0 HD13 ILE B 221 0.201 -4.397 -29.403 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.442 -8.071 -25.860 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.305 -9.461 -25.441 1.00 0.00 C ATOM 1707 C ILE B 222 -0.214 -9.594 -24.382 1.00 0.00 C ATOM 1708 O ILE B 222 0.247 -8.596 -23.825 1.00 0.00 O ATOM 1709 CB ILE B 222 -0.958 -10.340 -26.638 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.216 -9.718 -27.387 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -2.160 -10.468 -27.581 1.00 0.00 C ATOM 1712 CD1 ILE B 222 0.761 -10.741 -28.370 1.00 0.00 C ATOM 0 H ILE B 222 -0.634 -7.486 -25.649 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.255 -9.786 -25.017 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.691 -11.335 -26.283 1.00 0.00 H new ATOM 0 HG12 ILE B 222 -0.105 -8.820 -27.915 1.00 0.00 H new ATOM 0 HG13 ILE B 222 0.994 -9.415 -26.686 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -1.892 -11.099 -28.429 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -2.997 -10.916 -27.045 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -2.447 -9.480 -27.941 1.00 0.00 H new ATOM 0 HD11 ILE B 222 1.602 -10.311 -28.914 1.00 0.00 H new ATOM 0 HD12 ILE B 222 1.094 -11.626 -27.827 1.00 0.00 H new ATOM 0 HD13 ILE B 222 -0.022 -11.021 -29.075 1.00 0.00 H new ATOM 1724 N ARG B 223 0.195 -10.836 -24.118 1.00 0.00 N ATOM 1725 CA ARG B 223 1.245 -11.100 -23.142 1.00 0.00 C ATOM 1726 C ARG B 223 2.388 -10.106 -23.306 1.00 0.00 C ATOM 1727 O ARG B 223 2.403 -9.308 -24.243 1.00 0.00 O ATOM 1728 CB ARG B 223 1.764 -12.519 -23.304 1.00 0.00 C ATOM 1729 CG ARG B 223 2.202 -12.734 -24.743 1.00 0.00 C ATOM 1730 CD ARG B 223 2.646 -14.176 -24.905 1.00 0.00 C ATOM 1731 NE ARG B 223 3.110 -14.410 -26.271 1.00 0.00 N ATOM 1732 CZ ARG B 223 3.274 -15.641 -26.750 1.00 0.00 C ATOM 1733 NH1 ARG B 223 3.030 -16.676 -25.993 1.00 0.00 N ATOM 1734 NH2 ARG B 223 3.683 -15.815 -27.979 1.00 0.00 N ATOM 0 H ARG B 223 -0.185 -11.670 -24.566 1.00 0.00 H new ATOM 0 HA ARG B 223 0.825 -10.987 -22.143 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.601 -12.691 -22.628 1.00 0.00 H new ATOM 0 HB3 ARG B 223 0.987 -13.235 -23.038 1.00 0.00 H new ATOM 0 HG2 ARG B 223 1.381 -12.512 -25.425 1.00 0.00 H new ATOM 0 HG3 ARG B 223 3.018 -12.057 -24.995 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.445 -14.400 -24.198 1.00 0.00 H new ATOM 0 HD3 ARG B 223 1.819 -14.847 -24.674 1.00 0.00 H new ATOM 0 HE ARG B 223 3.313 -13.611 -26.872 1.00 0.00 H new ATOM 0 HH11 ARG B 223 2.713 -16.542 -25.033 1.00 0.00 H new ATOM 0 HH12 ARG B 223 3.156 -17.619 -26.362 1.00 0.00 H new ATOM 0 HH21 ARG B 223 3.877 -15.007 -28.571 1.00 0.00 H new ATOM 0 HH22 ARG B 223 3.809 -16.758 -28.346 1.00 0.00 H new ATOM 1748 N LEU B 224 3.334 -10.148 -22.381 1.00 0.00 N ATOM 1749 CA LEU B 224 4.458 -9.231 -22.419 1.00 0.00 C ATOM 1750 C LEU B 224 5.315 -9.498 -23.643 1.00 0.00 C ATOM 1751 O LEU B 224 6.041 -10.494 -23.717 1.00 0.00 O ATOM 1752 CB LEU B 224 5.297 -9.390 -21.143 1.00 0.00 C ATOM 1753 CG LEU B 224 4.447 -9.075 -19.891 1.00 0.00 C ATOM 1754 CD1 LEU B 224 3.803 -7.681 -20.025 1.00 0.00 C ATOM 1755 CD2 LEU B 224 3.359 -10.152 -19.688 1.00 0.00 C ATOM 0 H LEU B 224 3.345 -10.804 -21.600 1.00 0.00 H new ATOM 0 HA LEU B 224 4.081 -8.210 -22.476 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.684 -10.407 -21.080 1.00 0.00 H new ATOM 0 HB3 LEU B 224 6.158 -8.723 -21.182 1.00 0.00 H new ATOM 0 HG LEU B 224 5.100 -9.079 -19.018 1.00 0.00 H new ATOM 0 HD11 LEU B 224 3.206 -7.469 -19.138 1.00 0.00 H new ATOM 0 HD12 LEU B 224 4.584 -6.927 -20.126 1.00 0.00 H new ATOM 0 HD13 LEU B 224 3.162 -7.659 -20.907 1.00 0.00 H new ATOM 0 HD21 LEU B 224 2.771 -9.913 -18.802 1.00 0.00 H new ATOM 0 HD22 LEU B 224 2.706 -10.179 -20.560 1.00 0.00 H new ATOM 0 HD23 LEU B 224 3.831 -11.126 -19.558 1.00 0.00 H new ATOM 1767 N GLU B 225 5.222 -8.585 -24.607 1.00 0.00 N ATOM 1768 CA GLU B 225 5.981 -8.698 -25.840 1.00 0.00 C ATOM 1769 C GLU B 225 7.328 -8.001 -25.689 1.00 0.00 C ATOM 1770 O GLU B 225 7.480 -7.083 -24.882 1.00 0.00 O ATOM 1771 CB GLU B 225 5.201 -8.075 -26.997 1.00 0.00 C ATOM 1772 CG GLU B 225 5.941 -8.350 -28.306 1.00 0.00 C ATOM 1773 CD GLU B 225 5.099 -7.893 -29.491 1.00 0.00 C ATOM 1774 OE1 GLU B 225 4.120 -7.203 -29.264 1.00 0.00 O ATOM 1775 OE2 GLU B 225 5.449 -8.240 -30.608 1.00 0.00 O ATOM 0 H GLU B 225 4.626 -7.759 -24.553 1.00 0.00 H new ATOM 0 HA GLU B 225 6.148 -9.754 -26.054 1.00 0.00 H new ATOM 0 HB2 GLU B 225 4.195 -8.492 -27.039 1.00 0.00 H new ATOM 0 HB3 GLU B 225 5.095 -7.001 -26.844 1.00 0.00 H new ATOM 0 HG2 GLU B 225 6.898 -7.829 -28.308 1.00 0.00 H new ATOM 0 HG3 GLU B 225 6.158 -9.415 -28.393 1.00 0.00 H new