USER MOD reduce.3.24.130724 H: found=0, std=0, add=693, rem=0, adj=24 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 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot 91:sc= 0.976 USER MOD Single : A 20 SER OG : rot -62:sc= -3.46! USER MOD Single : A 21 SER OG : rot 180:sc= -0.612 USER MOD Single : A 27 THR OG1 : rot 180:sc= 0.0142 USER MOD Single : A 30 ASN : amide:sc= -0.0372 X(o=-0.037,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= -0.364 USER MOD Single : A 33 THR OG1 : rot -60:sc= -2.64! USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot -91:sc= -1.16! USER MOD Single : A 57 SER OG : rot 180:sc= 0 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 30:sc= -2.3! 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= 0.157 USER MOD Single : A 76 SER OG : rot 180:sc= -0.501 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 82 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : B 208 SER OG : rot 180:sc= 0 USER MOD Single : B 210 THR OG1 : rot -57:sc= 1.11 USER MOD Single : B 213 ASN : amide:sc= -0.927 K(o=-0.93,f=-2.7!) USER MOD Single : B 215 LYS NZ :NH3+ -138:sc= -6.22! (180deg=-6.83!) USER MOD Single : B 217 THR OG1 : rot 180:sc= 0 USER MOD Single : B 219 LYS NZ :NH3+ 152:sc= -0.686 (180deg=-1.34) USER MOD ----------------------------------------------------------------- ATOM 114 N ASP A 11 0.636 0.474 -9.044 1.00 0.00 N ATOM 115 CA ASP A 11 0.207 -0.020 -10.348 1.00 0.00 C ATOM 116 C ASP A 11 0.606 -1.476 -10.523 1.00 0.00 C ATOM 117 O ASP A 11 1.430 -1.999 -9.770 1.00 0.00 O ATOM 118 CB ASP A 11 0.837 0.823 -11.458 1.00 0.00 C ATOM 119 CG ASP A 11 2.356 0.680 -11.435 1.00 0.00 C ATOM 120 OD1 ASP A 11 2.828 -0.444 -11.405 1.00 0.00 O ATOM 121 OD2 ASP A 11 3.025 1.701 -11.438 1.00 0.00 O ATOM 0 HA ASP A 11 -0.879 0.057 -10.407 1.00 0.00 H new ATOM 0 HB2 ASP A 11 0.450 0.508 -12.427 1.00 0.00 H new ATOM 0 HB3 ASP A 11 0.562 1.870 -11.330 1.00 0.00 H new ATOM 126 N LEU A 12 0.018 -2.129 -11.516 1.00 0.00 N ATOM 127 CA LEU A 12 0.320 -3.529 -11.774 1.00 0.00 C ATOM 128 C LEU A 12 1.755 -3.678 -12.276 1.00 0.00 C ATOM 129 O LEU A 12 2.302 -2.771 -12.905 1.00 0.00 O ATOM 130 CB LEU A 12 -0.680 -4.094 -12.815 1.00 0.00 C ATOM 131 CG LEU A 12 -1.341 -5.382 -12.293 1.00 0.00 C ATOM 132 CD1 LEU A 12 -2.430 -5.829 -13.270 1.00 0.00 C ATOM 133 CD2 LEU A 12 -0.288 -6.486 -12.145 1.00 0.00 C ATOM 0 H LEU A 12 -0.665 -1.716 -12.151 1.00 0.00 H new ATOM 0 HA LEU A 12 0.222 -4.093 -10.846 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -1.446 -3.349 -13.032 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -0.161 -4.300 -13.751 1.00 0.00 H new ATOM 0 HG LEU A 12 -1.789 -5.188 -11.318 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.898 -6.741 -12.900 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.182 -5.045 -13.359 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.986 -6.019 -14.247 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -0.763 -7.395 -11.775 1.00 0.00 H new ATOM 0 HD22 LEU A 12 0.170 -6.684 -13.114 1.00 0.00 H new ATOM 0 HD23 LEU A 12 0.479 -6.165 -11.440 1.00 0.00 H new ATOM 145 N SER A 13 2.354 -4.834 -12.000 1.00 0.00 N ATOM 146 CA SER A 13 3.720 -5.106 -12.431 1.00 0.00 C ATOM 147 C SER A 13 3.874 -6.567 -12.835 1.00 0.00 C ATOM 148 O SER A 13 3.192 -7.448 -12.307 1.00 0.00 O ATOM 149 CB SER A 13 4.701 -4.793 -11.310 1.00 0.00 C ATOM 150 OG SER A 13 4.572 -5.774 -10.289 1.00 0.00 O ATOM 0 H SER A 13 1.915 -5.595 -11.481 1.00 0.00 H new ATOM 0 HA SER A 13 3.934 -4.471 -13.290 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.721 -4.783 -11.695 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.504 -3.801 -10.905 1.00 0.00 H new ATOM 0 HG SER A 13 5.203 -5.578 -9.565 1.00 0.00 H new ATOM 156 N PHE A 14 4.771 -6.815 -13.783 1.00 0.00 N ATOM 157 CA PHE A 14 5.022 -8.168 -14.279 1.00 0.00 C ATOM 158 C PHE A 14 6.418 -8.637 -13.880 1.00 0.00 C ATOM 159 O PHE A 14 7.352 -7.838 -13.805 1.00 0.00 O ATOM 160 CB PHE A 14 4.899 -8.174 -15.798 1.00 0.00 C ATOM 161 CG PHE A 14 3.563 -7.585 -16.184 1.00 0.00 C ATOM 162 CD1 PHE A 14 3.353 -6.203 -16.077 1.00 0.00 C ATOM 163 CD2 PHE A 14 2.541 -8.414 -16.657 1.00 0.00 C ATOM 164 CE1 PHE A 14 2.119 -5.655 -16.444 1.00 0.00 C ATOM 165 CE2 PHE A 14 1.309 -7.864 -17.030 1.00 0.00 C ATOM 166 CZ PHE A 14 1.098 -6.485 -16.924 1.00 0.00 C ATOM 0 H PHE A 14 5.340 -6.094 -14.227 1.00 0.00 H new ATOM 0 HA PHE A 14 4.290 -8.846 -13.841 1.00 0.00 H new ATOM 0 HB2 PHE A 14 5.708 -7.596 -16.244 1.00 0.00 H new ATOM 0 HB3 PHE A 14 4.986 -9.191 -16.179 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.142 -5.563 -15.712 1.00 0.00 H new ATOM 0 HD2 PHE A 14 2.702 -9.479 -16.735 1.00 0.00 H new ATOM 0 HE1 PHE A 14 1.954 -4.591 -16.357 1.00 0.00 H new ATOM 0 HE2 PHE A 14 0.521 -8.504 -17.400 1.00 0.00 H new ATOM 0 HZ PHE A 14 0.148 -6.060 -17.212 1.00 0.00 H new ATOM 176 N VAL A 15 6.555 -9.935 -13.637 1.00 0.00 N ATOM 177 CA VAL A 15 7.844 -10.506 -13.259 1.00 0.00 C ATOM 178 C VAL A 15 7.972 -11.926 -13.792 1.00 0.00 C ATOM 179 O VAL A 15 6.975 -12.595 -14.055 1.00 0.00 O ATOM 180 CB VAL A 15 7.979 -10.514 -11.736 1.00 0.00 C ATOM 181 CG1 VAL A 15 8.055 -9.074 -11.222 1.00 0.00 C ATOM 182 CG2 VAL A 15 6.758 -11.205 -11.125 1.00 0.00 C ATOM 0 H VAL A 15 5.793 -10.611 -13.694 1.00 0.00 H new ATOM 0 HA VAL A 15 8.637 -9.896 -13.691 1.00 0.00 H new ATOM 0 HB VAL A 15 8.885 -11.050 -11.453 1.00 0.00 H new ATOM 0 HG11 VAL A 15 8.151 -9.080 -10.136 1.00 0.00 H new ATOM 0 HG12 VAL A 15 8.920 -8.576 -11.660 1.00 0.00 H new ATOM 0 HG13 VAL A 15 7.148 -8.539 -11.503 1.00 0.00 H new ATOM 0 HG21 VAL A 15 6.850 -11.213 -10.039 1.00 0.00 H new ATOM 0 HG22 VAL A 15 5.855 -10.665 -11.409 1.00 0.00 H new ATOM 0 HG23 VAL A 15 6.698 -12.230 -11.492 1.00 0.00 H new ATOM 192 N ASP A 16 9.208 -12.375 -13.949 1.00 0.00 N ATOM 193 CA ASP A 16 9.467 -13.717 -14.449 1.00 0.00 C ATOM 194 C ASP A 16 8.886 -13.890 -15.852 1.00 0.00 C ATOM 195 O ASP A 16 8.522 -14.997 -16.250 1.00 0.00 O ATOM 196 CB ASP A 16 8.846 -14.752 -13.508 1.00 0.00 C ATOM 197 CG ASP A 16 9.411 -16.138 -13.799 1.00 0.00 C ATOM 198 OD1 ASP A 16 9.991 -16.311 -14.858 1.00 0.00 O ATOM 199 OD2 ASP A 16 9.254 -17.007 -12.957 1.00 0.00 O ATOM 0 H ASP A 16 10.045 -11.832 -13.738 1.00 0.00 H new ATOM 0 HA ASP A 16 10.546 -13.865 -14.494 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.048 -14.479 -12.472 1.00 0.00 H new ATOM 0 HB3 ASP A 16 7.763 -14.760 -13.630 1.00 0.00 H new ATOM 204 N ILE A 17 8.803 -12.792 -16.595 1.00 0.00 N ATOM 205 CA ILE A 17 8.268 -12.842 -17.952 1.00 0.00 C ATOM 206 C ILE A 17 9.045 -13.851 -18.782 1.00 0.00 C ATOM 207 O ILE A 17 10.276 -13.856 -18.782 1.00 0.00 O ATOM 208 CB ILE A 17 8.369 -11.465 -18.602 1.00 0.00 C ATOM 209 CG1 ILE A 17 7.434 -10.511 -17.865 1.00 0.00 C ATOM 210 CG2 ILE A 17 7.973 -11.547 -20.081 1.00 0.00 C ATOM 211 CD1 ILE A 17 7.690 -9.073 -18.330 1.00 0.00 C ATOM 0 H ILE A 17 9.096 -11.865 -16.286 1.00 0.00 H new ATOM 0 HA ILE A 17 7.222 -13.144 -17.905 1.00 0.00 H new ATOM 0 HB ILE A 17 9.395 -11.103 -18.541 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.396 -10.785 -18.054 1.00 0.00 H new ATOM 0 HG13 ILE A 17 7.593 -10.589 -16.790 1.00 0.00 H new ATOM 0 HG21 ILE A 17 8.049 -10.558 -20.533 1.00 0.00 H new ATOM 0 HG22 ILE A 17 8.641 -12.235 -20.599 1.00 0.00 H new ATOM 0 HG23 ILE A 17 6.947 -11.906 -20.164 1.00 0.00 H new ATOM 0 HD11 ILE A 17 7.020 -8.395 -17.801 1.00 0.00 H new ATOM 0 HD12 ILE A 17 8.724 -8.801 -18.118 1.00 0.00 H new ATOM 0 HD13 ILE A 17 7.508 -9.000 -19.402 1.00 0.00 H new ATOM 223 N THR A 18 8.317 -14.709 -19.494 1.00 0.00 N ATOM 224 CA THR A 18 8.942 -15.736 -20.335 1.00 0.00 C ATOM 225 C THR A 18 8.323 -15.731 -21.735 1.00 0.00 C ATOM 226 O THR A 18 7.564 -14.827 -22.088 1.00 0.00 O ATOM 227 CB THR A 18 8.779 -17.128 -19.681 1.00 0.00 C ATOM 228 OG1 THR A 18 8.548 -16.968 -18.289 1.00 0.00 O ATOM 229 CG2 THR A 18 10.048 -17.971 -19.884 1.00 0.00 C ATOM 0 H THR A 18 7.297 -14.716 -19.508 1.00 0.00 H new ATOM 0 HA THR A 18 10.005 -15.512 -20.428 1.00 0.00 H new ATOM 0 HB THR A 18 7.936 -17.637 -20.148 1.00 0.00 H new ATOM 0 HG1 THR A 18 7.584 -16.917 -18.121 1.00 0.00 H new ATOM 0 HG21 THR A 18 9.915 -18.947 -19.417 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.232 -18.101 -20.951 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.898 -17.464 -19.428 1.00 0.00 H new ATOM 237 N ASP A 19 8.648 -16.755 -22.519 1.00 0.00 N ATOM 238 CA ASP A 19 8.112 -16.866 -23.872 1.00 0.00 C ATOM 239 C ASP A 19 6.677 -17.365 -23.849 1.00 0.00 C ATOM 240 O ASP A 19 5.800 -16.792 -24.496 1.00 0.00 O ATOM 241 CB ASP A 19 8.963 -17.829 -24.707 1.00 0.00 C ATOM 242 CG ASP A 19 9.195 -19.120 -23.925 1.00 0.00 C ATOM 243 OD1 ASP A 19 8.793 -19.174 -22.776 1.00 0.00 O ATOM 244 OD2 ASP A 19 9.776 -20.032 -24.489 1.00 0.00 O ATOM 0 H ASP A 19 9.273 -17.513 -22.245 1.00 0.00 H new ATOM 0 HA ASP A 19 8.137 -15.873 -24.320 1.00 0.00 H new ATOM 0 HB2 ASP A 19 8.462 -18.048 -25.650 1.00 0.00 H new ATOM 0 HB3 ASP A 19 9.918 -17.365 -24.954 1.00 0.00 H new ATOM 249 N SER A 20 6.435 -18.449 -23.109 1.00 0.00 N ATOM 250 CA SER A 20 5.094 -19.035 -23.020 1.00 0.00 C ATOM 251 C SER A 20 4.604 -19.046 -21.572 1.00 0.00 C ATOM 252 O SER A 20 3.628 -19.722 -21.244 1.00 0.00 O ATOM 253 CB SER A 20 5.135 -20.472 -23.541 1.00 0.00 C ATOM 254 OG SER A 20 3.875 -21.093 -23.314 1.00 0.00 O ATOM 0 H SER A 20 7.146 -18.938 -22.565 1.00 0.00 H new ATOM 0 HA SER A 20 4.411 -18.433 -23.620 1.00 0.00 H new ATOM 0 HB2 SER A 20 5.369 -20.478 -24.606 1.00 0.00 H new ATOM 0 HB3 SER A 20 5.924 -21.031 -23.038 1.00 0.00 H new ATOM 0 HG SER A 20 3.693 -21.122 -22.351 1.00 0.00 H new ATOM 260 N SER A 21 5.297 -18.308 -20.710 1.00 0.00 N ATOM 261 CA SER A 21 4.934 -18.250 -19.293 1.00 0.00 C ATOM 262 C SER A 21 5.240 -16.867 -18.726 1.00 0.00 C ATOM 263 O SER A 21 6.346 -16.349 -18.891 1.00 0.00 O ATOM 264 CB SER A 21 5.732 -19.298 -18.522 1.00 0.00 C ATOM 265 OG SER A 21 5.745 -20.513 -19.257 1.00 0.00 O ATOM 0 H SER A 21 6.108 -17.744 -20.963 1.00 0.00 H new ATOM 0 HA SER A 21 3.867 -18.448 -19.193 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.751 -18.948 -18.358 1.00 0.00 H new ATOM 0 HB3 SER A 21 5.289 -19.459 -17.539 1.00 0.00 H new ATOM 0 HG SER A 21 6.258 -21.188 -18.765 1.00 0.00 H new ATOM 271 N ILE A 22 4.257 -16.276 -18.051 1.00 0.00 N ATOM 272 CA ILE A 22 4.424 -14.952 -17.453 1.00 0.00 C ATOM 273 C ILE A 22 4.076 -15.003 -15.967 1.00 0.00 C ATOM 274 O ILE A 22 3.158 -15.715 -15.558 1.00 0.00 O ATOM 275 CB ILE A 22 3.517 -13.943 -18.181 1.00 0.00 C ATOM 276 CG1 ILE A 22 2.039 -14.370 -18.057 1.00 0.00 C ATOM 277 CG2 ILE A 22 3.914 -13.884 -19.668 1.00 0.00 C ATOM 278 CD1 ILE A 22 1.139 -13.256 -18.599 1.00 0.00 C ATOM 0 H ILE A 22 3.337 -16.692 -17.904 1.00 0.00 H new ATOM 0 HA ILE A 22 5.462 -14.636 -17.555 1.00 0.00 H new ATOM 0 HB ILE A 22 3.639 -12.959 -17.727 1.00 0.00 H new ATOM 0 HG12 ILE A 22 1.868 -15.293 -18.612 1.00 0.00 H new ATOM 0 HG13 ILE A 22 1.795 -14.575 -17.015 1.00 0.00 H new ATOM 0 HG21 ILE A 22 3.274 -13.171 -20.187 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.954 -13.569 -19.755 1.00 0.00 H new ATOM 0 HG23 ILE A 22 3.795 -14.871 -20.116 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.095 -13.557 -18.512 1.00 0.00 H new ATOM 0 HD12 ILE A 22 1.303 -12.344 -18.025 1.00 0.00 H new ATOM 0 HD13 ILE A 22 1.377 -13.073 -19.647 1.00 0.00 H new ATOM 290 N GLY A 23 4.828 -14.262 -15.154 1.00 0.00 N ATOM 291 CA GLY A 23 4.593 -14.246 -13.710 1.00 0.00 C ATOM 292 C GLY A 23 3.768 -13.027 -13.317 1.00 0.00 C ATOM 293 O GLY A 23 4.313 -12.005 -12.900 1.00 0.00 O ATOM 0 H GLY A 23 5.598 -13.670 -15.466 1.00 0.00 H new ATOM 0 HA2 GLY A 23 4.073 -15.156 -13.410 1.00 0.00 H new ATOM 0 HA3 GLY A 23 5.546 -14.234 -13.181 1.00 0.00 H new ATOM 297 N LEU A 24 2.452 -13.142 -13.459 1.00 0.00 N ATOM 298 CA LEU A 24 1.562 -12.037 -13.122 1.00 0.00 C ATOM 299 C LEU A 24 1.618 -11.761 -11.629 1.00 0.00 C ATOM 300 O LEU A 24 1.443 -12.669 -10.817 1.00 0.00 O ATOM 301 CB LEU A 24 0.126 -12.382 -13.514 1.00 0.00 C ATOM 302 CG LEU A 24 0.042 -12.594 -15.029 1.00 0.00 C ATOM 303 CD1 LEU A 24 -1.356 -13.103 -15.393 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.327 -11.276 -15.770 1.00 0.00 C ATOM 0 H LEU A 24 1.982 -13.980 -13.801 1.00 0.00 H new ATOM 0 HA LEU A 24 1.885 -11.151 -13.669 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.197 -13.283 -12.992 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -0.547 -11.580 -13.211 1.00 0.00 H new ATOM 0 HG LEU A 24 0.789 -13.330 -15.328 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -1.419 -13.255 -16.471 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.544 -14.047 -14.882 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -2.102 -12.370 -15.086 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.264 -11.442 -16.845 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.407 -10.527 -15.475 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.327 -10.924 -15.515 1.00 0.00 H new ATOM 316 N ARG A 25 1.854 -10.501 -11.278 1.00 0.00 N ATOM 317 CA ARG A 25 1.928 -10.107 -9.875 1.00 0.00 C ATOM 318 C ARG A 25 1.420 -8.687 -9.706 1.00 0.00 C ATOM 319 O ARG A 25 1.812 -7.794 -10.446 1.00 0.00 O ATOM 320 CB ARG A 25 3.392 -10.223 -9.388 1.00 0.00 C ATOM 321 CG ARG A 25 3.682 -9.334 -8.147 1.00 0.00 C ATOM 322 CD ARG A 25 2.885 -9.809 -6.926 1.00 0.00 C ATOM 323 NE ARG A 25 3.759 -10.616 -6.086 1.00 0.00 N ATOM 324 CZ ARG A 25 3.634 -10.641 -4.768 1.00 0.00 C ATOM 325 NH1 ARG A 25 2.699 -9.943 -4.185 1.00 0.00 N ATOM 326 NH2 ARG A 25 4.443 -11.376 -4.060 1.00 0.00 N ATOM 0 H ARG A 25 1.997 -9.739 -11.941 1.00 0.00 H new ATOM 0 HA ARG A 25 1.301 -10.768 -9.276 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.608 -11.263 -9.144 1.00 0.00 H new ATOM 0 HB3 ARG A 25 4.064 -9.940 -10.198 1.00 0.00 H new ATOM 0 HG2 ARG A 25 4.748 -9.358 -7.920 1.00 0.00 H new ATOM 0 HG3 ARG A 25 3.427 -8.298 -8.371 1.00 0.00 H new ATOM 0 HD2 ARG A 25 2.506 -8.954 -6.366 1.00 0.00 H new ATOM 0 HD3 ARG A 25 2.020 -10.392 -7.242 1.00 0.00 H new ATOM 0 HE ARG A 25 4.488 -11.178 -6.525 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.062 -9.376 -4.745 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.605 -9.964 -3.170 1.00 0.00 H new ATOM 0 HH21 ARG A 25 5.167 -11.927 -4.521 1.00 0.00 H new ATOM 0 HH22 ARG A 25 4.353 -11.400 -3.044 1.00 0.00 H new ATOM 340 N TRP A 26 0.589 -8.482 -8.688 1.00 0.00 N ATOM 341 CA TRP A 26 0.072 -7.150 -8.393 1.00 0.00 C ATOM 342 C TRP A 26 0.040 -6.947 -6.881 1.00 0.00 C ATOM 343 O TRP A 26 -0.502 -7.776 -6.163 1.00 0.00 O ATOM 344 CB TRP A 26 -1.337 -6.979 -8.987 1.00 0.00 C ATOM 345 CG TRP A 26 -2.367 -7.549 -8.064 1.00 0.00 C ATOM 346 CD1 TRP A 26 -2.964 -6.859 -7.065 1.00 0.00 C ATOM 347 CD2 TRP A 26 -2.910 -8.894 -8.017 1.00 0.00 C ATOM 348 NE1 TRP A 26 -3.850 -7.696 -6.416 1.00 0.00 N ATOM 349 CE2 TRP A 26 -3.851 -8.962 -6.963 1.00 0.00 C ATOM 350 CE3 TRP A 26 -2.683 -10.048 -8.779 1.00 0.00 C ATOM 351 CZ2 TRP A 26 -4.542 -10.135 -6.674 1.00 0.00 C ATOM 352 CZ3 TRP A 26 -3.373 -11.233 -8.491 1.00 0.00 C ATOM 353 CH2 TRP A 26 -4.302 -11.277 -7.438 1.00 0.00 C ATOM 0 H TRP A 26 0.262 -9.215 -8.058 1.00 0.00 H new ATOM 0 HA TRP A 26 0.724 -6.401 -8.844 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -1.540 -5.922 -9.159 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -1.393 -7.476 -9.955 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -2.778 -5.825 -6.816 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -4.433 -7.413 -5.628 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -1.973 -10.024 -9.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -5.258 -10.161 -5.865 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -3.190 -12.118 -9.082 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -4.830 -12.194 -7.220 1.00 0.00 H new ATOM 364 N THR A 27 0.617 -5.851 -6.408 1.00 0.00 N ATOM 365 CA THR A 27 0.638 -5.584 -4.971 1.00 0.00 C ATOM 366 C THR A 27 -0.775 -5.280 -4.446 1.00 0.00 C ATOM 367 O THR A 27 -1.336 -4.240 -4.783 1.00 0.00 O ATOM 368 CB THR A 27 1.533 -4.378 -4.670 1.00 0.00 C ATOM 369 OG1 THR A 27 2.658 -4.393 -5.536 1.00 0.00 O ATOM 370 CG2 THR A 27 1.998 -4.440 -3.209 1.00 0.00 C ATOM 0 H THR A 27 1.070 -5.142 -6.984 1.00 0.00 H new ATOM 0 HA THR A 27 1.025 -6.475 -4.477 1.00 0.00 H new ATOM 0 HB THR A 27 0.972 -3.457 -4.830 1.00 0.00 H new ATOM 0 HG1 THR A 27 3.229 -3.620 -5.344 1.00 0.00 H new ATOM 0 HG21 THR A 27 2.635 -3.582 -2.993 1.00 0.00 H new ATOM 0 HG22 THR A 27 1.130 -4.422 -2.550 1.00 0.00 H new ATOM 0 HG23 THR A 27 2.560 -5.360 -3.045 1.00 0.00 H new ATOM 378 N PRO A 28 -1.351 -6.123 -3.615 1.00 0.00 N ATOM 379 CA PRO A 28 -2.711 -5.868 -3.042 1.00 0.00 C ATOM 380 C PRO A 28 -2.776 -4.563 -2.234 1.00 0.00 C ATOM 381 O PRO A 28 -1.773 -4.111 -1.677 1.00 0.00 O ATOM 382 CB PRO A 28 -2.984 -7.090 -2.146 1.00 0.00 C ATOM 383 CG PRO A 28 -2.036 -8.148 -2.606 1.00 0.00 C ATOM 384 CD PRO A 28 -0.806 -7.413 -3.132 1.00 0.00 C ATOM 0 HA PRO A 28 -3.457 -5.744 -3.827 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -2.822 -6.849 -1.095 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -4.018 -7.422 -2.241 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.770 -8.816 -1.787 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.486 -8.763 -3.386 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.062 -7.266 -2.349 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -0.320 -7.968 -3.934 1.00 0.00 H new ATOM 392 N LEU A 29 -3.974 -3.968 -2.180 1.00 0.00 N ATOM 393 CA LEU A 29 -4.187 -2.722 -1.442 1.00 0.00 C ATOM 394 C LEU A 29 -4.864 -2.997 -0.111 1.00 0.00 C ATOM 395 O LEU A 29 -5.840 -3.741 -0.024 1.00 0.00 O ATOM 396 CB LEU A 29 -5.060 -1.766 -2.265 1.00 0.00 C ATOM 397 CG LEU A 29 -4.409 -1.527 -3.630 1.00 0.00 C ATOM 398 CD1 LEU A 29 -5.317 -0.628 -4.477 1.00 0.00 C ATOM 399 CD2 LEU A 29 -3.037 -0.862 -3.439 1.00 0.00 C ATOM 0 H LEU A 29 -4.809 -4.331 -2.639 1.00 0.00 H new ATOM 0 HA LEU A 29 -3.215 -2.264 -1.259 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -6.057 -2.187 -2.394 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -5.180 -0.820 -1.737 1.00 0.00 H new ATOM 0 HG LEU A 29 -4.271 -2.480 -4.141 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -4.855 -0.457 -5.449 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -6.283 -1.113 -4.615 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -5.459 0.326 -3.970 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -2.576 -0.693 -4.412 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -3.163 0.092 -2.927 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -2.397 -1.512 -2.842 1.00 0.00 H new ATOM 411 N ASN A 30 -4.331 -2.388 0.930 1.00 0.00 N ATOM 412 CA ASN A 30 -4.870 -2.563 2.264 1.00 0.00 C ATOM 413 C ASN A 30 -6.394 -2.515 2.234 1.00 0.00 C ATOM 414 O ASN A 30 -7.063 -3.166 3.035 1.00 0.00 O ATOM 415 CB ASN A 30 -4.336 -1.456 3.154 1.00 0.00 C ATOM 416 CG ASN A 30 -4.930 -1.589 4.554 1.00 0.00 C ATOM 417 OD1 ASN A 30 -5.494 -0.630 5.078 1.00 0.00 O ATOM 418 ND2 ASN A 30 -4.851 -2.729 5.190 1.00 0.00 N ATOM 0 H ASN A 30 -3.524 -1.767 0.877 1.00 0.00 H new ATOM 0 HA ASN A 30 -4.566 -3.535 2.654 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -3.248 -1.509 3.204 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -4.589 -0.483 2.732 1.00 0.00 H new ATOM 0 HD21 ASN A 30 -5.257 -2.823 6.121 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -4.383 -3.524 4.755 1.00 0.00 H new ATOM 425 N SER A 31 -6.931 -1.749 1.287 1.00 0.00 N ATOM 426 CA SER A 31 -8.377 -1.626 1.130 1.00 0.00 C ATOM 427 C SER A 31 -8.911 -2.726 0.212 1.00 0.00 C ATOM 428 O SER A 31 -10.008 -3.243 0.424 1.00 0.00 O ATOM 429 CB SER A 31 -8.728 -0.258 0.549 1.00 0.00 C ATOM 430 OG SER A 31 -8.452 0.746 1.514 1.00 0.00 O ATOM 0 H SER A 31 -6.387 -1.205 0.618 1.00 0.00 H new ATOM 0 HA SER A 31 -8.840 -1.730 2.112 1.00 0.00 H new ATOM 0 HB2 SER A 31 -8.151 -0.076 -0.357 1.00 0.00 H new ATOM 0 HB3 SER A 31 -9.781 -0.229 0.268 1.00 0.00 H new ATOM 0 HG SER A 31 -8.675 1.626 1.144 1.00 0.00 H new ATOM 436 N SER A 32 -8.132 -3.075 -0.817 1.00 0.00 N ATOM 437 CA SER A 32 -8.548 -4.110 -1.761 1.00 0.00 C ATOM 438 C SER A 32 -9.099 -5.319 -1.012 1.00 0.00 C ATOM 439 O SER A 32 -8.375 -6.005 -0.295 1.00 0.00 O ATOM 440 CB SER A 32 -7.361 -4.531 -2.652 1.00 0.00 C ATOM 441 OG SER A 32 -7.285 -3.657 -3.772 1.00 0.00 O ATOM 0 H SER A 32 -7.221 -2.660 -1.014 1.00 0.00 H new ATOM 0 HA SER A 32 -9.335 -3.704 -2.397 1.00 0.00 H new ATOM 0 HB2 SER A 32 -6.432 -4.494 -2.083 1.00 0.00 H new ATOM 0 HB3 SER A 32 -7.489 -5.560 -2.987 1.00 0.00 H new ATOM 0 HG SER A 32 -6.531 -3.919 -4.341 1.00 0.00 H new ATOM 447 N THR A 33 -10.395 -5.558 -1.182 1.00 0.00 N ATOM 448 CA THR A 33 -11.047 -6.673 -0.509 1.00 0.00 C ATOM 449 C THR A 33 -10.269 -7.956 -0.782 1.00 0.00 C ATOM 450 O THR A 33 -9.624 -8.089 -1.820 1.00 0.00 O ATOM 451 CB THR A 33 -12.475 -6.830 -1.022 1.00 0.00 C ATOM 452 OG1 THR A 33 -13.096 -5.558 -1.082 1.00 0.00 O ATOM 453 CG2 THR A 33 -13.268 -7.746 -0.085 1.00 0.00 C ATOM 0 H THR A 33 -11.009 -5.000 -1.775 1.00 0.00 H new ATOM 0 HA THR A 33 -11.071 -6.477 0.563 1.00 0.00 H new ATOM 0 HB THR A 33 -12.453 -7.273 -2.018 1.00 0.00 H new ATOM 0 HG1 THR A 33 -13.114 -5.160 -0.187 1.00 0.00 H new ATOM 0 HG21 THR A 33 -14.287 -7.854 -0.458 1.00 0.00 H new ATOM 0 HG22 THR A 33 -12.791 -8.725 -0.044 1.00 0.00 H new ATOM 0 HG23 THR A 33 -13.291 -7.312 0.915 1.00 0.00 H new ATOM 461 N ILE A 34 -10.311 -8.889 0.170 1.00 0.00 N ATOM 462 CA ILE A 34 -9.577 -10.145 0.031 1.00 0.00 C ATOM 463 C ILE A 34 -10.464 -11.233 -0.562 1.00 0.00 C ATOM 464 O ILE A 34 -11.164 -11.946 0.158 1.00 0.00 O ATOM 465 CB ILE A 34 -9.074 -10.602 1.399 1.00 0.00 C ATOM 466 CG1 ILE A 34 -8.428 -9.418 2.127 1.00 0.00 C ATOM 467 CG2 ILE A 34 -8.049 -11.721 1.223 1.00 0.00 C ATOM 468 CD1 ILE A 34 -7.368 -8.761 1.237 1.00 0.00 C ATOM 0 H ILE A 34 -10.840 -8.800 1.037 1.00 0.00 H new ATOM 0 HA ILE A 34 -8.735 -9.974 -0.640 1.00 0.00 H new ATOM 0 HB ILE A 34 -9.912 -10.975 1.988 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -9.191 -8.687 2.395 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.972 -9.759 3.056 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.692 -12.045 2.201 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.514 -12.563 0.709 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -7.209 -11.355 0.633 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -6.918 -7.922 1.767 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.597 -9.491 0.991 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.835 -8.403 0.319 1.00 0.00 H new ATOM 480 N ILE A 35 -10.416 -11.359 -1.884 1.00 0.00 N ATOM 481 CA ILE A 35 -11.202 -12.370 -2.581 1.00 0.00 C ATOM 482 C ILE A 35 -10.500 -12.790 -3.867 1.00 0.00 C ATOM 483 O ILE A 35 -10.173 -11.957 -4.712 1.00 0.00 O ATOM 484 CB ILE A 35 -12.602 -11.828 -2.889 1.00 0.00 C ATOM 485 CG1 ILE A 35 -12.498 -10.471 -3.609 1.00 0.00 C ATOM 486 CG2 ILE A 35 -13.377 -11.644 -1.582 1.00 0.00 C ATOM 487 CD1 ILE A 35 -13.890 -9.819 -3.735 1.00 0.00 C ATOM 0 H ILE A 35 -9.843 -10.775 -2.493 1.00 0.00 H new ATOM 0 HA ILE A 35 -11.300 -13.245 -1.938 1.00 0.00 H new ATOM 0 HB ILE A 35 -13.122 -12.538 -3.532 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -11.829 -9.810 -3.058 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -12.064 -10.610 -4.599 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -14.373 -11.258 -1.801 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -13.463 -12.603 -1.072 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -12.848 -10.939 -0.941 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -13.798 -8.861 -4.246 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -14.548 -10.474 -4.307 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -14.309 -9.661 -2.741 1.00 0.00 H new ATOM 499 N GLY A 36 -10.266 -14.090 -4.005 1.00 0.00 N ATOM 500 CA GLY A 36 -9.596 -14.607 -5.185 1.00 0.00 C ATOM 501 C GLY A 36 -10.217 -14.039 -6.450 1.00 0.00 C ATOM 502 O GLY A 36 -11.440 -14.039 -6.611 1.00 0.00 O ATOM 0 H GLY A 36 -10.529 -14.798 -3.319 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.537 -14.352 -5.148 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -9.662 -15.695 -5.199 1.00 0.00 H new ATOM 506 N TYR A 37 -9.364 -13.549 -7.343 1.00 0.00 N ATOM 507 CA TYR A 37 -9.811 -12.966 -8.609 1.00 0.00 C ATOM 508 C TYR A 37 -9.550 -13.949 -9.749 1.00 0.00 C ATOM 509 O TYR A 37 -8.448 -14.475 -9.886 1.00 0.00 O ATOM 510 CB TYR A 37 -9.081 -11.628 -8.867 1.00 0.00 C ATOM 511 CG TYR A 37 -7.729 -11.864 -9.522 1.00 0.00 C ATOM 512 CD1 TYR A 37 -6.811 -12.737 -8.927 1.00 0.00 C ATOM 513 CD2 TYR A 37 -7.406 -11.231 -10.731 1.00 0.00 C ATOM 514 CE1 TYR A 37 -5.580 -12.978 -9.543 1.00 0.00 C ATOM 515 CE2 TYR A 37 -6.169 -11.467 -11.339 1.00 0.00 C ATOM 516 CZ TYR A 37 -5.259 -12.344 -10.745 1.00 0.00 C ATOM 517 OH TYR A 37 -4.044 -12.592 -11.350 1.00 0.00 O ATOM 0 H TYR A 37 -8.352 -13.543 -7.215 1.00 0.00 H new ATOM 0 HA TYR A 37 -10.881 -12.767 -8.555 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -9.693 -10.993 -9.507 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -8.945 -11.096 -7.925 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -7.053 -13.223 -7.994 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -8.114 -10.560 -11.194 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -4.874 -13.657 -9.088 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -5.918 -10.972 -12.266 1.00 0.00 H new ATOM 0 HH TYR A 37 -3.979 -12.072 -12.178 1.00 0.00 H new ATOM 527 N ARG A 38 -10.566 -14.193 -10.564 1.00 0.00 N ATOM 528 CA ARG A 38 -10.420 -15.115 -11.678 1.00 0.00 C ATOM 529 C ARG A 38 -9.715 -14.446 -12.852 1.00 0.00 C ATOM 530 O ARG A 38 -10.076 -13.341 -13.258 1.00 0.00 O ATOM 531 CB ARG A 38 -11.801 -15.602 -12.128 1.00 0.00 C ATOM 532 CG ARG A 38 -11.681 -16.422 -13.433 1.00 0.00 C ATOM 533 CD ARG A 38 -12.086 -15.564 -14.640 1.00 0.00 C ATOM 534 NE ARG A 38 -13.536 -15.444 -14.695 1.00 0.00 N ATOM 535 CZ ARG A 38 -14.115 -14.488 -15.408 1.00 0.00 C ATOM 536 NH1 ARG A 38 -13.384 -13.631 -16.065 1.00 0.00 N ATOM 537 NH2 ARG A 38 -15.416 -14.404 -15.449 1.00 0.00 N ATOM 0 H ARG A 38 -11.490 -13.770 -10.476 1.00 0.00 H new ATOM 0 HA ARG A 38 -9.817 -15.960 -11.345 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -12.251 -16.214 -11.346 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.461 -14.749 -12.286 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -10.657 -16.775 -13.556 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -12.318 -17.305 -13.376 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -11.633 -14.576 -14.564 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.714 -16.015 -15.560 1.00 0.00 H new ATOM 0 HE ARG A 38 -14.115 -16.105 -14.177 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -12.367 -13.696 -16.030 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -13.830 -12.896 -16.614 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -15.987 -15.073 -14.933 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -15.863 -13.669 -15.997 1.00 0.00 H new ATOM 551 N ILE A 39 -8.717 -15.131 -13.409 1.00 0.00 N ATOM 552 CA ILE A 39 -7.966 -14.613 -14.556 1.00 0.00 C ATOM 553 C ILE A 39 -8.404 -15.341 -15.826 1.00 0.00 C ATOM 554 O ILE A 39 -8.342 -16.568 -15.899 1.00 0.00 O ATOM 555 CB ILE A 39 -6.457 -14.813 -14.322 1.00 0.00 C ATOM 556 CG1 ILE A 39 -6.084 -16.288 -14.557 1.00 0.00 C ATOM 557 CG2 ILE A 39 -6.102 -14.409 -12.876 1.00 0.00 C ATOM 558 CD1 ILE A 39 -4.735 -16.597 -13.911 1.00 0.00 C ATOM 0 H ILE A 39 -8.408 -16.048 -13.085 1.00 0.00 H new ATOM 0 HA ILE A 39 -8.167 -13.548 -14.671 1.00 0.00 H new ATOM 0 HB ILE A 39 -5.898 -14.189 -15.019 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -6.853 -16.937 -14.139 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -6.040 -16.494 -15.626 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -5.034 -14.551 -12.710 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -6.358 -13.361 -12.718 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -6.663 -15.029 -12.177 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.480 -17.643 -14.083 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -3.967 -15.960 -14.349 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -4.794 -16.409 -12.839 1.00 0.00 H new ATOM 570 N THR A 40 -8.869 -14.578 -16.811 1.00 0.00 N ATOM 571 CA THR A 40 -9.337 -15.160 -18.064 1.00 0.00 C ATOM 572 C THR A 40 -8.260 -15.055 -19.133 1.00 0.00 C ATOM 573 O THR A 40 -7.613 -14.018 -19.272 1.00 0.00 O ATOM 574 CB THR A 40 -10.598 -14.427 -18.539 1.00 0.00 C ATOM 575 OG1 THR A 40 -11.481 -14.249 -17.441 1.00 0.00 O ATOM 576 CG2 THR A 40 -11.291 -15.261 -19.616 1.00 0.00 C ATOM 0 H THR A 40 -8.932 -13.561 -16.766 1.00 0.00 H new ATOM 0 HA THR A 40 -9.567 -16.212 -17.893 1.00 0.00 H new ATOM 0 HB THR A 40 -10.324 -13.455 -18.948 1.00 0.00 H new ATOM 0 HG1 THR A 40 -12.096 -15.010 -17.389 1.00 0.00 H new ATOM 0 HG21 THR A 40 -12.188 -14.743 -19.956 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.613 -15.404 -20.458 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.567 -16.231 -19.203 1.00 0.00 H new ATOM 584 N VAL A 41 -8.069 -16.136 -19.887 1.00 0.00 N ATOM 585 CA VAL A 41 -7.066 -16.168 -20.954 1.00 0.00 C ATOM 586 C VAL A 41 -7.669 -16.757 -22.223 1.00 0.00 C ATOM 587 O VAL A 41 -8.455 -17.703 -22.164 1.00 0.00 O ATOM 588 CB VAL A 41 -5.850 -16.998 -20.518 1.00 0.00 C ATOM 589 CG1 VAL A 41 -6.322 -18.330 -19.928 1.00 0.00 C ATOM 590 CG2 VAL A 41 -4.940 -17.262 -21.732 1.00 0.00 C ATOM 0 H VAL A 41 -8.595 -17.003 -19.780 1.00 0.00 H new ATOM 0 HA VAL A 41 -6.741 -15.148 -21.156 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.290 -16.447 -19.762 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.458 -18.918 -19.619 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.959 -18.140 -19.064 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -6.886 -18.882 -20.680 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -4.078 -17.851 -21.419 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.497 -17.809 -22.492 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.600 -16.312 -22.145 1.00 0.00 H new ATOM 600 N VAL A 42 -7.298 -16.200 -23.381 1.00 0.00 N ATOM 601 CA VAL A 42 -7.807 -16.690 -24.656 1.00 0.00 C ATOM 602 C VAL A 42 -6.660 -16.865 -25.636 1.00 0.00 C ATOM 603 O VAL A 42 -5.831 -15.971 -25.805 1.00 0.00 O ATOM 604 CB VAL A 42 -8.833 -15.694 -25.219 1.00 0.00 C ATOM 605 CG1 VAL A 42 -9.127 -16.006 -26.693 1.00 0.00 C ATOM 606 CG2 VAL A 42 -10.130 -15.794 -24.410 1.00 0.00 C ATOM 0 H VAL A 42 -6.651 -15.415 -23.457 1.00 0.00 H new ATOM 0 HA VAL A 42 -8.292 -17.654 -24.504 1.00 0.00 H new ATOM 0 HB VAL A 42 -8.425 -14.686 -25.147 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -9.855 -15.292 -27.078 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -8.206 -15.932 -27.271 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -9.529 -17.016 -26.778 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -10.861 -15.089 -24.806 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -10.527 -16.807 -24.482 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -9.927 -15.557 -23.366 1.00 0.00 H new ATOM 616 N ALA A 43 -6.629 -18.011 -26.297 1.00 0.00 N ATOM 617 CA ALA A 43 -5.594 -18.292 -27.282 1.00 0.00 C ATOM 618 C ALA A 43 -6.137 -18.037 -28.683 1.00 0.00 C ATOM 619 O ALA A 43 -7.266 -18.418 -28.994 1.00 0.00 O ATOM 620 CB ALA A 43 -5.156 -19.748 -27.159 1.00 0.00 C ATOM 0 H ALA A 43 -7.308 -18.762 -26.170 1.00 0.00 H new ATOM 0 HA ALA A 43 -4.739 -17.640 -27.104 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -4.381 -19.958 -27.896 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.763 -19.926 -26.158 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -6.011 -20.401 -27.334 1.00 0.00 H new ATOM 626 N ALA A 44 -5.338 -17.390 -29.529 1.00 0.00 N ATOM 627 CA ALA A 44 -5.766 -17.092 -30.895 1.00 0.00 C ATOM 628 C ALA A 44 -5.194 -18.112 -31.879 1.00 0.00 C ATOM 629 O ALA A 44 -5.643 -18.206 -33.023 1.00 0.00 O ATOM 630 CB ALA A 44 -5.310 -15.682 -31.282 1.00 0.00 C ATOM 0 H ALA A 44 -4.400 -17.065 -29.297 1.00 0.00 H new ATOM 0 HA ALA A 44 -6.854 -17.148 -30.938 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -5.630 -15.463 -32.301 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -5.751 -14.956 -30.599 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.223 -15.622 -31.223 1.00 0.00 H new ATOM 636 N GLY A 45 -4.190 -18.869 -31.432 1.00 0.00 N ATOM 637 CA GLY A 45 -3.548 -19.875 -32.282 1.00 0.00 C ATOM 638 C GLY A 45 -4.083 -21.271 -31.980 1.00 0.00 C ATOM 639 O GLY A 45 -3.405 -22.271 -32.215 1.00 0.00 O ATOM 0 H GLY A 45 -3.805 -18.805 -30.490 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.722 -19.634 -33.331 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -2.470 -19.854 -32.125 1.00 0.00 H new ATOM 643 N GLU A 46 -5.304 -21.336 -31.455 1.00 0.00 N ATOM 644 CA GLU A 46 -5.922 -22.619 -31.125 1.00 0.00 C ATOM 645 C GLU A 46 -7.426 -22.557 -31.356 1.00 0.00 C ATOM 646 O GLU A 46 -8.046 -21.502 -31.215 1.00 0.00 O ATOM 647 CB GLU A 46 -5.637 -22.992 -29.666 1.00 0.00 C ATOM 648 CG GLU A 46 -4.133 -23.213 -29.469 1.00 0.00 C ATOM 649 CD GLU A 46 -3.850 -23.642 -28.034 1.00 0.00 C ATOM 650 OE1 GLU A 46 -4.801 -23.814 -27.289 1.00 0.00 O ATOM 651 OE2 GLU A 46 -2.686 -23.799 -27.702 1.00 0.00 O ATOM 0 H GLU A 46 -5.883 -20.521 -31.250 1.00 0.00 H new ATOM 0 HA GLU A 46 -5.494 -23.382 -31.775 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -5.987 -22.200 -29.004 1.00 0.00 H new ATOM 0 HB3 GLU A 46 -6.184 -23.896 -29.399 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -3.776 -23.975 -30.162 1.00 0.00 H new ATOM 0 HG3 GLU A 46 -3.590 -22.296 -29.696 1.00 0.00 H new ATOM 658 N GLY A 47 -8.001 -23.698 -31.712 1.00 0.00 N ATOM 659 CA GLY A 47 -9.431 -23.777 -31.961 1.00 0.00 C ATOM 660 C GLY A 47 -10.212 -23.546 -30.679 1.00 0.00 C ATOM 661 O GLY A 47 -11.388 -23.190 -30.718 1.00 0.00 O ATOM 0 H GLY A 47 -7.500 -24.578 -31.834 1.00 0.00 H new ATOM 0 HA2 GLY A 47 -9.717 -23.035 -32.706 1.00 0.00 H new ATOM 0 HA3 GLY A 47 -9.680 -24.755 -32.373 1.00 0.00 H new ATOM 665 N ILE A 48 -9.550 -23.749 -29.534 1.00 0.00 N ATOM 666 CA ILE A 48 -10.202 -23.554 -28.233 1.00 0.00 C ATOM 667 C ILE A 48 -9.311 -22.711 -27.304 1.00 0.00 C ATOM 668 O ILE A 48 -8.100 -22.922 -27.249 1.00 0.00 O ATOM 669 CB ILE A 48 -10.528 -24.937 -27.586 1.00 0.00 C ATOM 670 CG1 ILE A 48 -12.025 -25.238 -27.741 1.00 0.00 C ATOM 671 CG2 ILE A 48 -10.184 -24.980 -26.083 1.00 0.00 C ATOM 672 CD1 ILE A 48 -12.277 -26.725 -27.489 1.00 0.00 C ATOM 0 H ILE A 48 -8.575 -24.045 -29.481 1.00 0.00 H new ATOM 0 HA ILE A 48 -11.136 -23.014 -28.385 1.00 0.00 H new ATOM 0 HB ILE A 48 -9.918 -25.679 -28.101 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -12.602 -24.637 -27.038 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -12.359 -24.967 -28.742 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -10.430 -25.963 -25.681 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -9.120 -24.788 -25.948 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -10.759 -24.219 -25.556 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -13.340 -26.938 -27.599 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -11.712 -27.317 -28.209 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -11.959 -26.982 -26.479 1.00 0.00 H new ATOM 684 N PRO A 49 -9.895 -21.802 -26.554 1.00 0.00 N ATOM 685 CA PRO A 49 -9.141 -20.964 -25.580 1.00 0.00 C ATOM 686 C PRO A 49 -8.730 -21.759 -24.339 1.00 0.00 C ATOM 687 O PRO A 49 -9.287 -22.820 -24.056 1.00 0.00 O ATOM 688 CB PRO A 49 -10.128 -19.847 -25.221 1.00 0.00 C ATOM 689 CG PRO A 49 -11.482 -20.449 -25.420 1.00 0.00 C ATOM 690 CD PRO A 49 -11.334 -21.459 -26.558 1.00 0.00 C ATOM 0 HA PRO A 49 -8.206 -20.589 -25.995 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -9.991 -19.515 -24.192 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -9.986 -18.975 -25.859 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -11.829 -20.936 -24.509 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -12.216 -19.683 -25.672 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -11.954 -22.340 -26.392 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -11.639 -21.031 -27.513 1.00 0.00 H new ATOM 698 N ILE A 50 -7.758 -21.229 -23.604 1.00 0.00 N ATOM 699 CA ILE A 50 -7.285 -21.883 -22.388 1.00 0.00 C ATOM 700 C ILE A 50 -8.262 -21.649 -21.243 1.00 0.00 C ATOM 701 O ILE A 50 -8.936 -20.622 -21.191 1.00 0.00 O ATOM 702 CB ILE A 50 -5.903 -21.350 -21.998 1.00 0.00 C ATOM 703 CG1 ILE A 50 -4.883 -21.742 -23.070 1.00 0.00 C ATOM 704 CG2 ILE A 50 -5.482 -21.942 -20.648 1.00 0.00 C ATOM 705 CD1 ILE A 50 -3.558 -21.020 -22.807 1.00 0.00 C ATOM 0 H ILE A 50 -7.284 -20.354 -23.827 1.00 0.00 H new ATOM 0 HA ILE A 50 -7.214 -22.953 -22.583 1.00 0.00 H new ATOM 0 HB ILE A 50 -5.945 -20.264 -21.916 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.729 -22.821 -23.062 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.261 -21.481 -24.059 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -4.498 -21.560 -20.374 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -6.207 -21.659 -19.885 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -5.441 -23.029 -20.724 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -2.833 -21.300 -23.571 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -3.719 -19.942 -22.837 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -3.178 -21.303 -21.825 1.00 0.00 H new ATOM 717 N PHE A 51 -8.329 -22.607 -20.327 1.00 0.00 N ATOM 718 CA PHE A 51 -9.225 -22.491 -19.183 1.00 0.00 C ATOM 719 C PHE A 51 -8.703 -21.455 -18.193 1.00 0.00 C ATOM 720 O PHE A 51 -7.498 -21.359 -17.956 1.00 0.00 O ATOM 721 CB PHE A 51 -9.346 -23.843 -18.478 1.00 0.00 C ATOM 722 CG PHE A 51 -10.063 -24.826 -19.378 1.00 0.00 C ATOM 723 CD1 PHE A 51 -11.439 -24.691 -19.606 1.00 0.00 C ATOM 724 CD2 PHE A 51 -9.353 -25.868 -19.988 1.00 0.00 C ATOM 725 CE1 PHE A 51 -12.101 -25.599 -20.443 1.00 0.00 C ATOM 726 CE2 PHE A 51 -10.015 -26.774 -20.825 1.00 0.00 C ATOM 727 CZ PHE A 51 -11.390 -26.639 -21.054 1.00 0.00 C ATOM 0 H PHE A 51 -7.779 -23.466 -20.353 1.00 0.00 H new ATOM 0 HA PHE A 51 -10.203 -22.174 -19.545 1.00 0.00 H new ATOM 0 HB2 PHE A 51 -8.356 -24.222 -18.225 1.00 0.00 H new ATOM 0 HB3 PHE A 51 -9.892 -23.728 -17.541 1.00 0.00 H new ATOM 0 HD1 PHE A 51 -11.989 -23.888 -19.137 1.00 0.00 H new ATOM 0 HD2 PHE A 51 -8.293 -25.973 -19.812 1.00 0.00 H new ATOM 0 HE1 PHE A 51 -13.162 -25.496 -20.617 1.00 0.00 H new ATOM 0 HE2 PHE A 51 -9.466 -27.577 -21.294 1.00 0.00 H new ATOM 0 HZ PHE A 51 -11.901 -27.336 -21.701 1.00 0.00 H new ATOM 737 N GLU A 52 -9.623 -20.691 -17.613 1.00 0.00 N ATOM 738 CA GLU A 52 -9.271 -19.669 -16.634 1.00 0.00 C ATOM 739 C GLU A 52 -8.612 -20.301 -15.423 1.00 0.00 C ATOM 740 O GLU A 52 -8.391 -21.510 -15.377 1.00 0.00 O ATOM 741 CB GLU A 52 -10.527 -18.890 -16.215 1.00 0.00 C ATOM 742 CG GLU A 52 -11.350 -19.701 -15.207 1.00 0.00 C ATOM 743 CD GLU A 52 -11.568 -21.115 -15.738 1.00 0.00 C ATOM 744 OE1 GLU A 52 -12.106 -21.238 -16.826 1.00 0.00 O ATOM 745 OE2 GLU A 52 -11.188 -22.049 -15.054 1.00 0.00 O ATOM 0 H GLU A 52 -10.622 -20.761 -17.805 1.00 0.00 H new ATOM 0 HA GLU A 52 -8.562 -18.976 -17.088 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -10.240 -17.935 -15.775 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -11.133 -18.667 -17.093 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -10.833 -19.738 -14.248 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -12.310 -19.216 -15.033 1.00 0.00 H new ATOM 752 N ASP A 53 -8.304 -19.471 -14.441 1.00 0.00 N ATOM 753 CA ASP A 53 -7.674 -19.946 -13.220 1.00 0.00 C ATOM 754 C ASP A 53 -8.188 -19.154 -12.014 1.00 0.00 C ATOM 755 O ASP A 53 -8.290 -17.927 -12.058 1.00 0.00 O ATOM 756 CB ASP A 53 -6.148 -19.803 -13.352 1.00 0.00 C ATOM 757 CG ASP A 53 -5.505 -21.128 -13.770 1.00 0.00 C ATOM 758 OD1 ASP A 53 -5.814 -22.137 -13.154 1.00 0.00 O ATOM 759 OD2 ASP A 53 -4.715 -21.111 -14.697 1.00 0.00 O ATOM 0 H ASP A 53 -8.479 -18.466 -14.465 1.00 0.00 H new ATOM 0 HA ASP A 53 -7.924 -20.996 -13.065 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -5.914 -19.033 -14.088 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -5.727 -19.474 -12.402 1.00 0.00 H new ATOM 764 N PHE A 54 -8.506 -19.872 -10.938 1.00 0.00 N ATOM 765 CA PHE A 54 -9.004 -19.244 -9.712 1.00 0.00 C ATOM 766 C PHE A 54 -7.945 -19.304 -8.617 1.00 0.00 C ATOM 767 O PHE A 54 -7.563 -20.388 -8.172 1.00 0.00 O ATOM 768 CB PHE A 54 -10.262 -19.968 -9.235 1.00 0.00 C ATOM 769 CG PHE A 54 -11.308 -19.911 -10.316 1.00 0.00 C ATOM 770 CD1 PHE A 54 -12.190 -18.826 -10.379 1.00 0.00 C ATOM 771 CD2 PHE A 54 -11.397 -20.942 -11.258 1.00 0.00 C ATOM 772 CE1 PHE A 54 -13.162 -18.771 -11.384 1.00 0.00 C ATOM 773 CE2 PHE A 54 -12.368 -20.887 -12.263 1.00 0.00 C ATOM 774 CZ PHE A 54 -13.251 -19.802 -12.327 1.00 0.00 C ATOM 0 H PHE A 54 -8.428 -20.888 -10.889 1.00 0.00 H new ATOM 0 HA PHE A 54 -9.238 -18.201 -9.926 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -10.029 -21.005 -8.993 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -10.639 -19.504 -8.323 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -12.120 -18.031 -9.652 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -10.717 -21.779 -11.209 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -13.843 -17.934 -11.432 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -12.437 -21.682 -12.991 1.00 0.00 H new ATOM 0 HZ PHE A 54 -14.000 -19.761 -13.104 1.00 0.00 H new ATOM 784 N VAL A 55 -7.477 -18.136 -8.182 1.00 0.00 N ATOM 785 CA VAL A 55 -6.461 -18.054 -7.130 1.00 0.00 C ATOM 786 C VAL A 55 -6.898 -17.067 -6.054 1.00 0.00 C ATOM 787 O VAL A 55 -7.513 -16.044 -6.352 1.00 0.00 O ATOM 788 CB VAL A 55 -5.114 -17.604 -7.726 1.00 0.00 C ATOM 789 CG1 VAL A 55 -5.173 -16.113 -8.088 1.00 0.00 C ATOM 790 CG2 VAL A 55 -3.984 -17.839 -6.706 1.00 0.00 C ATOM 0 H VAL A 55 -7.784 -17.232 -8.541 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.343 -19.042 -6.684 1.00 0.00 H new ATOM 0 HB VAL A 55 -4.916 -18.186 -8.626 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -4.217 -15.803 -8.509 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -5.963 -15.947 -8.821 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.382 -15.529 -7.192 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -3.034 -17.518 -7.135 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -4.186 -17.266 -5.801 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -3.931 -18.899 -6.459 1.00 0.00 H new ATOM 800 N ASP A 56 -6.574 -17.381 -4.807 1.00 0.00 N ATOM 801 CA ASP A 56 -6.926 -16.518 -3.688 1.00 0.00 C ATOM 802 C ASP A 56 -6.163 -15.201 -3.766 1.00 0.00 C ATOM 803 O ASP A 56 -5.054 -15.147 -4.299 1.00 0.00 O ATOM 804 CB ASP A 56 -6.613 -17.220 -2.366 1.00 0.00 C ATOM 805 CG ASP A 56 -7.645 -18.314 -2.093 1.00 0.00 C ATOM 806 OD1 ASP A 56 -8.695 -18.285 -2.713 1.00 0.00 O ATOM 807 OD2 ASP A 56 -7.369 -19.163 -1.261 1.00 0.00 O ATOM 0 H ASP A 56 -6.068 -18.227 -4.545 1.00 0.00 H new ATOM 0 HA ASP A 56 -7.994 -16.307 -3.739 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -5.614 -17.654 -2.404 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -6.616 -16.496 -1.551 1.00 0.00 H new ATOM 812 N SER A 57 -6.762 -14.142 -3.229 1.00 0.00 N ATOM 813 CA SER A 57 -6.134 -12.826 -3.237 1.00 0.00 C ATOM 814 C SER A 57 -4.864 -12.831 -2.390 1.00 0.00 C ATOM 815 O SER A 57 -3.910 -12.111 -2.683 1.00 0.00 O ATOM 816 CB SER A 57 -7.113 -11.781 -2.693 1.00 0.00 C ATOM 817 OG SER A 57 -6.711 -10.490 -3.136 1.00 0.00 O ATOM 0 H SER A 57 -7.679 -14.170 -2.784 1.00 0.00 H new ATOM 0 HA SER A 57 -5.867 -12.575 -4.264 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.124 -11.998 -3.037 1.00 0.00 H new ATOM 0 HB3 SER A 57 -7.133 -11.815 -1.604 1.00 0.00 H new ATOM 0 HG SER A 57 -7.335 -9.817 -2.792 1.00 0.00 H new ATOM 823 N SER A 58 -4.863 -13.645 -1.338 1.00 0.00 N ATOM 824 CA SER A 58 -3.707 -13.729 -0.453 1.00 0.00 C ATOM 825 C SER A 58 -2.440 -13.999 -1.255 1.00 0.00 C ATOM 826 O SER A 58 -1.376 -13.457 -0.951 1.00 0.00 O ATOM 827 CB SER A 58 -3.912 -14.849 0.568 1.00 0.00 C ATOM 828 OG SER A 58 -5.094 -14.595 1.312 1.00 0.00 O ATOM 0 H SER A 58 -5.642 -14.250 -1.080 1.00 0.00 H new ATOM 0 HA SER A 58 -3.601 -12.777 0.067 1.00 0.00 H new ATOM 0 HB2 SER A 58 -3.988 -15.810 0.060 1.00 0.00 H new ATOM 0 HB3 SER A 58 -3.053 -14.909 1.237 1.00 0.00 H new ATOM 0 HG SER A 58 -5.229 -15.312 1.966 1.00 0.00 H new ATOM 834 N VAL A 59 -2.557 -14.837 -2.276 1.00 0.00 N ATOM 835 CA VAL A 59 -1.413 -15.169 -3.110 1.00 0.00 C ATOM 836 C VAL A 59 -0.872 -13.905 -3.774 1.00 0.00 C ATOM 837 O VAL A 59 0.340 -13.695 -3.830 1.00 0.00 O ATOM 838 CB VAL A 59 -1.819 -16.191 -4.177 1.00 0.00 C ATOM 839 CG1 VAL A 59 -0.581 -16.672 -4.940 1.00 0.00 C ATOM 840 CG2 VAL A 59 -2.497 -17.387 -3.508 1.00 0.00 C ATOM 0 H VAL A 59 -3.427 -15.296 -2.545 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.633 -15.604 -2.486 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.511 -15.720 -4.875 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -0.879 -17.398 -5.696 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -0.098 -15.822 -5.423 1.00 0.00 H new ATOM 0 HG13 VAL A 59 0.117 -17.138 -4.244 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -2.786 -18.113 -4.268 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -1.805 -17.852 -2.806 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -3.385 -17.050 -2.973 1.00 0.00 H new ATOM 850 N GLY A 60 -1.770 -13.059 -4.272 1.00 0.00 N ATOM 851 CA GLY A 60 -1.353 -11.820 -4.919 1.00 0.00 C ATOM 852 C GLY A 60 -0.790 -12.097 -6.313 1.00 0.00 C ATOM 853 O GLY A 60 -1.039 -11.350 -7.257 1.00 0.00 O ATOM 0 H GLY A 60 -2.779 -13.206 -4.241 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -2.202 -11.140 -4.993 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -0.598 -11.323 -4.310 1.00 0.00 H new ATOM 857 N TYR A 61 -0.008 -13.168 -6.426 1.00 0.00 N ATOM 858 CA TYR A 61 0.620 -13.539 -7.701 1.00 0.00 C ATOM 859 C TYR A 61 0.060 -14.848 -8.230 1.00 0.00 C ATOM 860 O TYR A 61 -0.487 -15.652 -7.480 1.00 0.00 O ATOM 861 CB TYR A 61 2.138 -13.674 -7.520 1.00 0.00 C ATOM 862 CG TYR A 61 2.422 -14.634 -6.388 1.00 0.00 C ATOM 863 CD1 TYR A 61 2.342 -16.015 -6.604 1.00 0.00 C ATOM 864 CD2 TYR A 61 2.760 -14.143 -5.121 1.00 0.00 C ATOM 865 CE1 TYR A 61 2.600 -16.905 -5.554 1.00 0.00 C ATOM 866 CE2 TYR A 61 3.017 -15.033 -4.071 1.00 0.00 C ATOM 867 CZ TYR A 61 2.938 -16.414 -4.287 1.00 0.00 C ATOM 868 OH TYR A 61 3.191 -17.291 -3.251 1.00 0.00 O ATOM 0 H TYR A 61 0.209 -13.797 -5.653 1.00 0.00 H new ATOM 0 HA TYR A 61 0.402 -12.751 -8.422 1.00 0.00 H new ATOM 0 HB2 TYR A 61 2.595 -14.035 -8.441 1.00 0.00 H new ATOM 0 HB3 TYR A 61 2.578 -12.700 -7.306 1.00 0.00 H new ATOM 0 HD1 TYR A 61 2.081 -16.394 -7.581 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.822 -13.078 -4.954 1.00 0.00 H new ATOM 0 HE1 TYR A 61 2.538 -17.970 -5.721 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.276 -14.654 -3.094 1.00 0.00 H new ATOM 0 HH TYR A 61 3.412 -16.785 -2.441 1.00 0.00 H new ATOM 878 N TYR A 62 0.204 -15.064 -9.530 1.00 0.00 N ATOM 879 CA TYR A 62 -0.281 -16.285 -10.157 1.00 0.00 C ATOM 880 C TYR A 62 0.546 -16.590 -11.398 1.00 0.00 C ATOM 881 O TYR A 62 1.051 -15.678 -12.059 1.00 0.00 O ATOM 882 CB TYR A 62 -1.756 -16.137 -10.537 1.00 0.00 C ATOM 883 CG TYR A 62 -2.333 -17.499 -10.825 1.00 0.00 C ATOM 884 CD1 TYR A 62 -2.573 -18.391 -9.772 1.00 0.00 C ATOM 885 CD2 TYR A 62 -2.627 -17.869 -12.135 1.00 0.00 C ATOM 886 CE1 TYR A 62 -3.111 -19.654 -10.036 1.00 0.00 C ATOM 887 CE2 TYR A 62 -3.168 -19.129 -12.402 1.00 0.00 C ATOM 888 CZ TYR A 62 -3.410 -20.021 -11.352 1.00 0.00 C ATOM 889 OH TYR A 62 -3.948 -21.264 -11.615 1.00 0.00 O ATOM 0 H TYR A 62 0.653 -14.410 -10.171 1.00 0.00 H new ATOM 0 HA TYR A 62 -0.183 -17.108 -9.449 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -2.307 -15.660 -9.726 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -1.856 -15.494 -11.412 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.343 -18.103 -8.757 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -2.437 -17.181 -12.945 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.295 -20.344 -9.226 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -3.399 -19.414 -13.418 1.00 0.00 H new ATOM 0 HH TYR A 62 -4.482 -21.558 -10.848 1.00 0.00 H new ATOM 899 N THR A 63 0.687 -17.876 -11.713 1.00 0.00 N ATOM 900 CA THR A 63 1.465 -18.305 -12.871 1.00 0.00 C ATOM 901 C THR A 63 0.556 -18.914 -13.926 1.00 0.00 C ATOM 902 O THR A 63 -0.293 -19.754 -13.621 1.00 0.00 O ATOM 903 CB THR A 63 2.498 -19.348 -12.438 1.00 0.00 C ATOM 904 OG1 THR A 63 3.324 -18.802 -11.422 1.00 0.00 O ATOM 905 CG2 THR A 63 3.362 -19.751 -13.635 1.00 0.00 C ATOM 0 H THR A 63 0.271 -18.640 -11.180 1.00 0.00 H new ATOM 0 HA THR A 63 1.968 -17.435 -13.293 1.00 0.00 H new ATOM 0 HB THR A 63 1.981 -20.228 -12.056 1.00 0.00 H new ATOM 0 HG1 THR A 63 3.985 -19.470 -11.143 1.00 0.00 H new ATOM 0 HG21 THR A 63 4.095 -20.494 -13.321 1.00 0.00 H new ATOM 0 HG22 THR A 63 2.729 -20.174 -14.415 1.00 0.00 H new ATOM 0 HG23 THR A 63 3.878 -18.873 -14.023 1.00 0.00 H new ATOM 913 N VAL A 64 0.762 -18.506 -15.174 1.00 0.00 N ATOM 914 CA VAL A 64 -0.017 -19.024 -16.298 1.00 0.00 C ATOM 915 C VAL A 64 0.921 -19.419 -17.442 1.00 0.00 C ATOM 916 O VAL A 64 1.374 -18.567 -18.209 1.00 0.00 O ATOM 917 CB VAL A 64 -1.024 -17.962 -16.775 1.00 0.00 C ATOM 918 CG1 VAL A 64 -2.371 -18.169 -16.074 1.00 0.00 C ATOM 919 CG2 VAL A 64 -0.492 -16.565 -16.434 1.00 0.00 C ATOM 0 H VAL A 64 1.465 -17.815 -15.435 1.00 0.00 H new ATOM 0 HA VAL A 64 -0.568 -19.907 -15.974 1.00 0.00 H new ATOM 0 HB VAL A 64 -1.157 -18.056 -17.853 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -3.079 -17.414 -16.416 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -2.756 -19.161 -16.311 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -2.238 -18.079 -14.996 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -1.204 -15.812 -16.771 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -0.358 -16.480 -15.356 1.00 0.00 H new ATOM 0 HG23 VAL A 64 0.465 -16.408 -16.932 1.00 0.00 H new ATOM 929 N THR A 65 1.202 -20.717 -17.556 1.00 0.00 N ATOM 930 CA THR A 65 2.085 -21.217 -18.606 1.00 0.00 C ATOM 931 C THR A 65 1.317 -22.096 -19.572 1.00 0.00 C ATOM 932 O THR A 65 0.210 -22.549 -19.273 1.00 0.00 O ATOM 933 CB THR A 65 3.224 -22.035 -17.986 1.00 0.00 C ATOM 934 OG1 THR A 65 2.783 -23.369 -17.788 1.00 0.00 O ATOM 935 CG2 THR A 65 3.631 -21.431 -16.637 1.00 0.00 C ATOM 0 H THR A 65 0.832 -21.438 -16.936 1.00 0.00 H new ATOM 0 HA THR A 65 2.494 -20.362 -19.145 1.00 0.00 H new ATOM 0 HB THR A 65 4.083 -22.021 -18.657 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.507 -23.898 -17.393 1.00 0.00 H new ATOM 0 HG21 THR A 65 4.441 -22.019 -16.205 1.00 0.00 H new ATOM 0 HG22 THR A 65 3.967 -20.404 -16.784 1.00 0.00 H new ATOM 0 HG23 THR A 65 2.776 -21.440 -15.962 1.00 0.00 H new ATOM 943 N GLY A 66 1.921 -22.338 -20.731 1.00 0.00 N ATOM 944 CA GLY A 66 1.303 -23.171 -21.753 1.00 0.00 C ATOM 945 C GLY A 66 0.825 -22.332 -22.932 1.00 0.00 C ATOM 946 O GLY A 66 -0.101 -22.721 -23.644 1.00 0.00 O ATOM 0 H GLY A 66 2.837 -21.969 -20.985 1.00 0.00 H new ATOM 0 HA2 GLY A 66 2.018 -23.917 -22.100 1.00 0.00 H new ATOM 0 HA3 GLY A 66 0.461 -23.713 -21.324 1.00 0.00 H new ATOM 950 N LEU A 67 1.447 -21.172 -23.146 1.00 0.00 N ATOM 951 CA LEU A 67 1.058 -20.298 -24.256 1.00 0.00 C ATOM 952 C LEU A 67 2.044 -20.476 -25.407 1.00 0.00 C ATOM 953 O LEU A 67 3.196 -20.068 -25.313 1.00 0.00 O ATOM 954 CB LEU A 67 1.071 -18.844 -23.797 1.00 0.00 C ATOM 955 CG LEU A 67 0.476 -18.750 -22.390 1.00 0.00 C ATOM 956 CD1 LEU A 67 0.445 -17.288 -21.949 1.00 0.00 C ATOM 957 CD2 LEU A 67 -0.946 -19.308 -22.394 1.00 0.00 C ATOM 0 H LEU A 67 2.213 -20.818 -22.574 1.00 0.00 H new ATOM 0 HA LEU A 67 0.054 -20.561 -24.588 1.00 0.00 H new ATOM 0 HB2 LEU A 67 2.091 -18.460 -23.799 1.00 0.00 H new ATOM 0 HB3 LEU A 67 0.497 -18.228 -24.489 1.00 0.00 H new ATOM 0 HG LEU A 67 1.089 -19.329 -21.699 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.021 -17.219 -20.947 1.00 0.00 H new ATOM 0 HD12 LEU A 67 1.459 -16.888 -21.943 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.168 -16.712 -22.642 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.367 -19.240 -21.391 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.561 -18.732 -23.085 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -0.927 -20.351 -22.709 1.00 0.00 H new ATOM 969 N GLU A 68 1.592 -21.092 -26.478 1.00 0.00 N ATOM 970 CA GLU A 68 2.470 -21.336 -27.618 1.00 0.00 C ATOM 971 C GLU A 68 3.179 -20.052 -28.087 1.00 0.00 C ATOM 972 O GLU A 68 2.560 -18.990 -28.149 1.00 0.00 O ATOM 973 CB GLU A 68 1.674 -21.927 -28.779 1.00 0.00 C ATOM 974 CG GLU A 68 0.891 -23.150 -28.300 1.00 0.00 C ATOM 975 CD GLU A 68 1.846 -24.213 -27.767 1.00 0.00 C ATOM 976 OE1 GLU A 68 2.740 -24.602 -28.501 1.00 0.00 O ATOM 977 OE2 GLU A 68 1.671 -24.618 -26.629 1.00 0.00 O ATOM 0 H GLU A 68 0.637 -21.431 -26.590 1.00 0.00 H new ATOM 0 HA GLU A 68 3.233 -22.043 -27.291 1.00 0.00 H new ATOM 0 HB2 GLU A 68 0.989 -21.180 -29.180 1.00 0.00 H new ATOM 0 HB3 GLU A 68 2.348 -22.209 -29.588 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.189 -22.858 -27.519 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.303 -23.559 -29.122 1.00 0.00 H new ATOM 984 N PRO A 69 4.452 -20.132 -28.444 1.00 0.00 N ATOM 985 CA PRO A 69 5.231 -18.955 -28.945 1.00 0.00 C ATOM 986 C PRO A 69 4.824 -18.588 -30.364 1.00 0.00 C ATOM 987 O PRO A 69 4.314 -19.422 -31.113 1.00 0.00 O ATOM 988 CB PRO A 69 6.688 -19.425 -28.879 1.00 0.00 C ATOM 989 CG PRO A 69 6.618 -20.904 -29.056 1.00 0.00 C ATOM 990 CD PRO A 69 5.291 -21.348 -28.418 1.00 0.00 C ATOM 0 HA PRO A 69 5.058 -18.054 -28.357 1.00 0.00 H new ATOM 0 HB2 PRO A 69 7.289 -18.961 -29.661 1.00 0.00 H new ATOM 0 HB3 PRO A 69 7.146 -19.162 -27.926 1.00 0.00 H new ATOM 0 HG2 PRO A 69 6.652 -21.172 -30.112 1.00 0.00 H new ATOM 0 HG3 PRO A 69 7.465 -21.394 -28.576 1.00 0.00 H new ATOM 0 HD2 PRO A 69 4.831 -22.161 -28.980 1.00 0.00 H new ATOM 0 HD3 PRO A 69 5.439 -21.708 -27.400 1.00 0.00 H new ATOM 998 N GLY A 70 5.079 -17.346 -30.733 1.00 0.00 N ATOM 999 CA GLY A 70 4.761 -16.882 -32.068 1.00 0.00 C ATOM 1000 C GLY A 70 3.253 -16.769 -32.281 1.00 0.00 C ATOM 1001 O GLY A 70 2.799 -16.250 -33.301 1.00 0.00 O ATOM 0 H GLY A 70 5.504 -16.643 -30.128 1.00 0.00 H new ATOM 0 HA2 GLY A 70 5.226 -15.911 -32.236 1.00 0.00 H new ATOM 0 HA3 GLY A 70 5.182 -17.569 -32.802 1.00 0.00 H new ATOM 1005 N ILE A 71 2.486 -17.266 -31.314 1.00 0.00 N ATOM 1006 CA ILE A 71 1.026 -17.231 -31.390 1.00 0.00 C ATOM 1007 C ILE A 71 0.510 -16.055 -30.575 1.00 0.00 C ATOM 1008 O ILE A 71 1.105 -15.662 -29.572 1.00 0.00 O ATOM 1009 CB ILE A 71 0.440 -18.564 -30.852 1.00 0.00 C ATOM 1010 CG1 ILE A 71 0.422 -19.635 -31.959 1.00 0.00 C ATOM 1011 CG2 ILE A 71 -1.003 -18.379 -30.351 1.00 0.00 C ATOM 1012 CD1 ILE A 71 1.845 -20.129 -32.228 1.00 0.00 C ATOM 0 H ILE A 71 2.851 -17.699 -30.466 1.00 0.00 H new ATOM 0 HA ILE A 71 0.713 -17.109 -32.427 1.00 0.00 H new ATOM 0 HB ILE A 71 1.078 -18.880 -30.027 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -0.212 -20.470 -31.659 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -0.007 -19.221 -32.871 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -1.384 -19.331 -29.981 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -1.017 -17.644 -29.546 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -1.631 -18.031 -31.171 1.00 0.00 H new ATOM 0 HD11 ILE A 71 1.825 -20.886 -33.012 1.00 0.00 H new ATOM 0 HD12 ILE A 71 2.466 -19.292 -32.547 1.00 0.00 H new ATOM 0 HD13 ILE A 71 2.259 -20.561 -31.317 1.00 0.00 H new ATOM 1024 N ASP A 72 -0.611 -15.513 -31.018 1.00 0.00 N ATOM 1025 CA ASP A 72 -1.237 -14.387 -30.347 1.00 0.00 C ATOM 1026 C ASP A 72 -2.215 -14.878 -29.282 1.00 0.00 C ATOM 1027 O ASP A 72 -3.218 -15.524 -29.589 1.00 0.00 O ATOM 1028 CB ASP A 72 -1.978 -13.542 -31.383 1.00 0.00 C ATOM 1029 CG ASP A 72 -2.827 -12.481 -30.689 1.00 0.00 C ATOM 1030 OD1 ASP A 72 -3.724 -12.859 -29.952 1.00 0.00 O ATOM 1031 OD2 ASP A 72 -2.557 -11.311 -30.891 1.00 0.00 O ATOM 0 H ASP A 72 -1.110 -15.838 -31.846 1.00 0.00 H new ATOM 0 HA ASP A 72 -0.470 -13.786 -29.858 1.00 0.00 H new ATOM 0 HB2 ASP A 72 -1.262 -13.065 -32.053 1.00 0.00 H new ATOM 0 HB3 ASP A 72 -2.612 -14.181 -31.997 1.00 0.00 H new ATOM 1036 N TYR A 73 -1.910 -14.571 -28.028 1.00 0.00 N ATOM 1037 CA TYR A 73 -2.754 -14.974 -26.908 1.00 0.00 C ATOM 1038 C TYR A 73 -3.475 -13.767 -26.325 1.00 0.00 C ATOM 1039 O TYR A 73 -2.845 -12.817 -25.876 1.00 0.00 O ATOM 1040 CB TYR A 73 -1.878 -15.611 -25.809 1.00 0.00 C ATOM 1041 CG TYR A 73 -1.689 -17.085 -26.077 1.00 0.00 C ATOM 1042 CD1 TYR A 73 -0.673 -17.519 -26.930 1.00 0.00 C ATOM 1043 CD2 TYR A 73 -2.543 -18.013 -25.475 1.00 0.00 C ATOM 1044 CE1 TYR A 73 -0.513 -18.885 -27.186 1.00 0.00 C ATOM 1045 CE2 TYR A 73 -2.385 -19.375 -25.732 1.00 0.00 C ATOM 1046 CZ TYR A 73 -1.373 -19.810 -26.586 1.00 0.00 C ATOM 1047 OH TYR A 73 -1.226 -21.155 -26.841 1.00 0.00 O ATOM 0 H TYR A 73 -1.081 -14.042 -27.759 1.00 0.00 H new ATOM 0 HA TYR A 73 -3.490 -15.693 -27.267 1.00 0.00 H new ATOM 0 HB2 TYR A 73 -0.909 -15.114 -25.774 1.00 0.00 H new ATOM 0 HB3 TYR A 73 -2.345 -15.469 -24.834 1.00 0.00 H new ATOM 0 HD1 TYR A 73 -0.011 -16.801 -27.392 1.00 0.00 H new ATOM 0 HD2 TYR A 73 -3.325 -17.676 -24.811 1.00 0.00 H new ATOM 0 HE1 TYR A 73 0.272 -19.224 -27.845 1.00 0.00 H new ATOM 0 HE2 TYR A 73 -3.047 -20.092 -25.269 1.00 0.00 H new ATOM 0 HH TYR A 73 -1.904 -21.658 -26.344 1.00 0.00 H new ATOM 1057 N ASP A 74 -4.797 -13.821 -26.358 1.00 0.00 N ATOM 1058 CA ASP A 74 -5.626 -12.745 -25.835 1.00 0.00 C ATOM 1059 C ASP A 74 -5.920 -12.995 -24.361 1.00 0.00 C ATOM 1060 O ASP A 74 -6.523 -14.002 -24.003 1.00 0.00 O ATOM 1061 CB ASP A 74 -6.936 -12.680 -26.624 1.00 0.00 C ATOM 1062 CG ASP A 74 -6.752 -11.870 -27.907 1.00 0.00 C ATOM 1063 OD1 ASP A 74 -6.170 -10.800 -27.831 1.00 0.00 O ATOM 1064 OD2 ASP A 74 -7.193 -12.335 -28.945 1.00 0.00 O ATOM 0 H ASP A 74 -5.323 -14.605 -26.745 1.00 0.00 H new ATOM 0 HA ASP A 74 -5.098 -11.797 -25.937 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.270 -13.688 -26.869 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -7.714 -12.227 -26.010 1.00 0.00 H new ATOM 1069 N ILE A 75 -5.471 -12.081 -23.510 1.00 0.00 N ATOM 1070 CA ILE A 75 -5.670 -12.211 -22.067 1.00 0.00 C ATOM 1071 C ILE A 75 -6.553 -11.081 -21.562 1.00 0.00 C ATOM 1072 O ILE A 75 -6.753 -10.075 -22.243 1.00 0.00 O ATOM 1073 CB ILE A 75 -4.307 -12.213 -21.334 1.00 0.00 C ATOM 1074 CG1 ILE A 75 -3.272 -11.428 -22.166 1.00 0.00 C ATOM 1075 CG2 ILE A 75 -3.816 -13.658 -21.118 1.00 0.00 C ATOM 1076 CD1 ILE A 75 -2.612 -12.340 -23.210 1.00 0.00 C ATOM 0 H ILE A 75 -4.966 -11.241 -23.791 1.00 0.00 H new ATOM 0 HA ILE A 75 -6.167 -13.159 -21.861 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.428 -11.737 -20.361 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -3.759 -10.589 -22.664 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.511 -11.010 -21.508 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.856 -13.643 -20.601 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.543 -14.203 -20.517 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -3.701 -14.151 -22.083 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.885 -11.767 -23.786 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.107 -13.164 -22.706 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -3.374 -12.737 -23.880 1.00 0.00 H new ATOM 1088 N SER A 76 -7.074 -11.255 -20.356 1.00 0.00 N ATOM 1089 CA SER A 76 -7.932 -10.253 -19.744 1.00 0.00 C ATOM 1090 C SER A 76 -7.846 -10.343 -18.223 1.00 0.00 C ATOM 1091 O SER A 76 -8.015 -11.419 -17.645 1.00 0.00 O ATOM 1092 CB SER A 76 -9.378 -10.459 -20.219 1.00 0.00 C ATOM 1093 OG SER A 76 -9.593 -11.841 -20.473 1.00 0.00 O ATOM 0 H SER A 76 -6.917 -12.083 -19.781 1.00 0.00 H new ATOM 0 HA SER A 76 -7.600 -9.259 -20.044 1.00 0.00 H new ATOM 0 HB2 SER A 76 -10.077 -10.103 -19.462 1.00 0.00 H new ATOM 0 HB3 SER A 76 -9.563 -9.878 -21.122 1.00 0.00 H new ATOM 0 HG SER A 76 -10.515 -11.979 -20.775 1.00 0.00 H new ATOM 1099 N VAL A 77 -7.595 -9.204 -17.584 1.00 0.00 N ATOM 1100 CA VAL A 77 -7.499 -9.150 -16.128 1.00 0.00 C ATOM 1101 C VAL A 77 -8.721 -8.439 -15.563 1.00 0.00 C ATOM 1102 O VAL A 77 -9.096 -7.363 -16.025 1.00 0.00 O ATOM 1103 CB VAL A 77 -6.231 -8.400 -15.708 1.00 0.00 C ATOM 1104 CG1 VAL A 77 -6.250 -8.158 -14.193 1.00 0.00 C ATOM 1105 CG2 VAL A 77 -5.005 -9.236 -16.072 1.00 0.00 C ATOM 0 H VAL A 77 -7.455 -8.308 -18.050 1.00 0.00 H new ATOM 0 HA VAL A 77 -7.454 -10.167 -15.739 1.00 0.00 H new ATOM 0 HB VAL A 77 -6.190 -7.442 -16.226 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -5.346 -7.624 -13.898 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -7.125 -7.563 -13.931 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.292 -9.115 -13.672 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -4.101 -8.705 -15.774 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -5.051 -10.194 -15.553 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -4.988 -9.407 -17.148 1.00 0.00 H new ATOM 1115 N ILE A 78 -9.334 -9.048 -14.551 1.00 0.00 N ATOM 1116 CA ILE A 78 -10.513 -8.469 -13.907 1.00 0.00 C ATOM 1117 C ILE A 78 -10.281 -8.325 -12.410 1.00 0.00 C ATOM 1118 O ILE A 78 -9.973 -9.297 -11.724 1.00 0.00 O ATOM 1119 CB ILE A 78 -11.733 -9.361 -14.156 1.00 0.00 C ATOM 1120 CG1 ILE A 78 -12.064 -9.346 -15.648 1.00 0.00 C ATOM 1121 CG2 ILE A 78 -12.929 -8.833 -13.358 1.00 0.00 C ATOM 1122 CD1 ILE A 78 -13.126 -10.404 -15.947 1.00 0.00 C ATOM 0 H ILE A 78 -9.035 -9.941 -14.159 1.00 0.00 H new ATOM 0 HA ILE A 78 -10.694 -7.482 -14.333 1.00 0.00 H new ATOM 0 HB ILE A 78 -11.514 -10.380 -13.838 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -12.425 -8.360 -15.941 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -11.165 -9.543 -16.232 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -13.795 -9.470 -13.537 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -12.688 -8.839 -12.295 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -13.156 -7.815 -13.673 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -13.361 -10.393 -17.011 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -12.748 -11.388 -15.670 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -14.027 -10.187 -15.374 1.00 0.00 H new ATOM 1134 N THR A 79 -10.444 -7.105 -11.899 1.00 0.00 N ATOM 1135 CA THR A 79 -10.257 -6.844 -10.474 1.00 0.00 C ATOM 1136 C THR A 79 -11.609 -6.768 -9.774 1.00 0.00 C ATOM 1137 O THR A 79 -12.403 -5.860 -10.027 1.00 0.00 O ATOM 1138 CB THR A 79 -9.515 -5.520 -10.282 1.00 0.00 C ATOM 1139 OG1 THR A 79 -8.244 -5.593 -10.913 1.00 0.00 O ATOM 1140 CG2 THR A 79 -9.329 -5.252 -8.786 1.00 0.00 C ATOM 0 H THR A 79 -10.704 -6.286 -12.448 1.00 0.00 H new ATOM 0 HA THR A 79 -9.672 -7.657 -10.043 1.00 0.00 H new ATOM 0 HB THR A 79 -10.094 -4.711 -10.727 1.00 0.00 H new ATOM 0 HG1 THR A 79 -7.769 -4.744 -10.792 1.00 0.00 H new ATOM 0 HG21 THR A 79 -8.800 -4.309 -8.648 1.00 0.00 H new ATOM 0 HG22 THR A 79 -10.304 -5.195 -8.303 1.00 0.00 H new ATOM 0 HG23 THR A 79 -8.750 -6.061 -8.341 1.00 0.00 H new ATOM 1148 N LEU A 80 -11.860 -7.726 -8.884 1.00 0.00 N ATOM 1149 CA LEU A 80 -13.117 -7.775 -8.140 1.00 0.00 C ATOM 1150 C LEU A 80 -12.851 -7.653 -6.650 1.00 0.00 C ATOM 1151 O LEU A 80 -12.252 -8.540 -6.040 1.00 0.00 O ATOM 1152 CB LEU A 80 -13.832 -9.105 -8.430 1.00 0.00 C ATOM 1153 CG LEU A 80 -14.555 -9.033 -9.787 1.00 0.00 C ATOM 1154 CD1 LEU A 80 -14.648 -10.431 -10.408 1.00 0.00 C ATOM 1155 CD2 LEU A 80 -15.977 -8.484 -9.593 1.00 0.00 C ATOM 0 H LEU A 80 -11.209 -8.479 -8.660 1.00 0.00 H new ATOM 0 HA LEU A 80 -13.748 -6.944 -8.454 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -13.109 -9.921 -8.437 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -14.549 -9.321 -7.638 1.00 0.00 H new ATOM 0 HG LEU A 80 -13.990 -8.374 -10.447 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -15.161 -10.369 -11.368 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -13.645 -10.830 -10.558 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -15.204 -11.089 -9.741 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -16.483 -8.436 -10.557 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -16.533 -9.141 -8.924 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -15.925 -7.485 -9.160 1.00 0.00 H new ATOM 1167 N ILE A 81 -13.311 -6.554 -6.069 1.00 0.00 N ATOM 1168 CA ILE A 81 -13.141 -6.319 -4.642 1.00 0.00 C ATOM 1169 C ILE A 81 -14.330 -5.532 -4.096 1.00 0.00 C ATOM 1170 O ILE A 81 -14.877 -4.670 -4.782 1.00 0.00 O ATOM 1171 CB ILE A 81 -11.835 -5.561 -4.382 1.00 0.00 C ATOM 1172 CG1 ILE A 81 -11.878 -4.161 -5.050 1.00 0.00 C ATOM 1173 CG2 ILE A 81 -10.662 -6.377 -4.952 1.00 0.00 C ATOM 1174 CD1 ILE A 81 -12.211 -3.084 -4.010 1.00 0.00 C ATOM 0 H ILE A 81 -13.805 -5.811 -6.564 1.00 0.00 H new ATOM 0 HA ILE A 81 -13.092 -7.280 -4.130 1.00 0.00 H new ATOM 0 HB ILE A 81 -11.705 -5.425 -3.308 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -10.916 -3.943 -5.514 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -12.625 -4.152 -5.844 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -9.728 -5.846 -4.772 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -10.625 -7.351 -4.464 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -10.801 -6.513 -6.024 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -12.238 -2.107 -4.493 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -13.184 -3.296 -3.566 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -11.449 -3.083 -3.231 1.00 0.00 H new ATOM 1186 N ASN A 82 -14.722 -5.827 -2.863 1.00 0.00 N ATOM 1187 CA ASN A 82 -15.848 -5.133 -2.242 1.00 0.00 C ATOM 1188 C ASN A 82 -15.541 -3.649 -2.044 1.00 0.00 C ATOM 1189 O ASN A 82 -16.348 -2.785 -2.385 1.00 0.00 O ATOM 1190 CB ASN A 82 -16.151 -5.767 -0.890 1.00 0.00 C ATOM 1191 CG ASN A 82 -17.316 -5.043 -0.224 1.00 0.00 C ATOM 1192 OD1 ASN A 82 -18.329 -4.772 -0.869 1.00 0.00 O ATOM 1193 ND2 ASN A 82 -17.234 -4.708 1.035 1.00 0.00 N ATOM 0 H ASN A 82 -14.283 -6.536 -2.276 1.00 0.00 H new ATOM 0 HA ASN A 82 -16.710 -5.222 -2.903 1.00 0.00 H new ATOM 0 HB2 ASN A 82 -16.394 -6.822 -1.020 1.00 0.00 H new ATOM 0 HB3 ASN A 82 -15.269 -5.719 -0.251 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -18.009 -4.221 1.485 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -16.394 -4.933 1.569 1.00 0.00 H new ATOM 1457 N GLY B 207 2.061 -1.492 -19.571 1.00 0.00 N ATOM 1458 CA GLY B 207 0.859 -0.912 -20.171 1.00 0.00 C ATOM 1459 C GLY B 207 0.302 0.205 -19.302 1.00 0.00 C ATOM 1460 O GLY B 207 1.045 1.062 -18.822 1.00 0.00 O ATOM 0 HA2 GLY B 207 1.094 -0.524 -21.162 1.00 0.00 H new ATOM 0 HA3 GLY B 207 0.104 -1.687 -20.303 1.00 0.00 H new ATOM 1464 N SER B 208 -1.008 0.179 -19.087 1.00 0.00 N ATOM 1465 CA SER B 208 -1.656 1.185 -18.258 1.00 0.00 C ATOM 1466 C SER B 208 -3.054 0.734 -17.858 1.00 0.00 C ATOM 1467 O SER B 208 -3.584 -0.237 -18.400 1.00 0.00 O ATOM 1468 CB SER B 208 -1.729 2.507 -19.010 1.00 0.00 C ATOM 1469 OG SER B 208 -2.560 2.352 -20.152 1.00 0.00 O ATOM 0 H SER B 208 -1.638 -0.524 -19.473 1.00 0.00 H new ATOM 0 HA SER B 208 -1.066 1.320 -17.351 1.00 0.00 H new ATOM 0 HB2 SER B 208 -2.126 3.287 -18.360 1.00 0.00 H new ATOM 0 HB3 SER B 208 -0.730 2.822 -19.313 1.00 0.00 H new ATOM 0 HG SER B 208 -2.611 3.202 -20.638 1.00 0.00 H new ATOM 1475 N TRP B 209 -3.656 1.449 -16.910 1.00 0.00 N ATOM 1476 CA TRP B 209 -5.003 1.121 -16.448 1.00 0.00 C ATOM 1477 C TRP B 209 -6.047 1.838 -17.294 1.00 0.00 C ATOM 1478 O TRP B 209 -5.792 2.924 -17.819 1.00 0.00 O ATOM 1479 CB TRP B 209 -5.174 1.529 -14.983 1.00 0.00 C ATOM 1480 CG TRP B 209 -4.419 0.583 -14.115 1.00 0.00 C ATOM 1481 CD1 TRP B 209 -3.129 0.730 -13.762 1.00 0.00 C ATOM 1482 CD2 TRP B 209 -4.880 -0.650 -13.492 1.00 0.00 C ATOM 1483 NE1 TRP B 209 -2.761 -0.330 -12.957 1.00 0.00 N ATOM 1484 CE2 TRP B 209 -3.809 -1.209 -12.758 1.00 0.00 C ATOM 1485 CE3 TRP B 209 -6.112 -1.330 -13.492 1.00 0.00 C ATOM 1486 CZ2 TRP B 209 -3.955 -2.402 -12.048 1.00 0.00 C ATOM 1487 CZ3 TRP B 209 -6.261 -2.528 -12.779 1.00 0.00 C ATOM 1488 CH2 TRP B 209 -5.186 -3.064 -12.058 1.00 0.00 C ATOM 0 H TRP B 209 -3.235 2.255 -16.449 1.00 0.00 H new ATOM 0 HA TRP B 209 -5.142 0.044 -16.544 1.00 0.00 H new ATOM 0 HB2 TRP B 209 -4.812 2.546 -14.833 1.00 0.00 H new ATOM 0 HB3 TRP B 209 -6.230 1.524 -14.713 1.00 0.00 H new ATOM 0 HD1 TRP B 209 -2.486 1.545 -14.060 1.00 0.00 H new ATOM 0 HE1 TRP B 209 -1.830 -0.450 -12.558 1.00 0.00 H new ATOM 0 HE3 TRP B 209 -6.948 -0.927 -14.045 1.00 0.00 H new ATOM 0 HZ2 TRP B 209 -3.122 -2.811 -11.495 1.00 0.00 H new ATOM 0 HZ3 TRP B 209 -7.211 -3.041 -12.786 1.00 0.00 H new ATOM 0 HH2 TRP B 209 -5.308 -3.987 -11.511 1.00 0.00 H new ATOM 1499 N THR B 210 -7.229 1.233 -17.419 1.00 0.00 N ATOM 1500 CA THR B 210 -8.315 1.830 -18.199 1.00 0.00 C ATOM 1501 C THR B 210 -9.601 1.866 -17.379 1.00 0.00 C ATOM 1502 O THR B 210 -10.016 0.853 -16.815 1.00 0.00 O ATOM 1503 CB THR B 210 -8.543 1.016 -19.472 1.00 0.00 C ATOM 1504 OG1 THR B 210 -8.906 -0.314 -19.120 1.00 0.00 O ATOM 1505 CG2 THR B 210 -7.258 0.994 -20.299 1.00 0.00 C ATOM 0 H THR B 210 -7.459 0.335 -16.993 1.00 0.00 H new ATOM 0 HA THR B 210 -8.036 2.850 -18.463 1.00 0.00 H new ATOM 0 HB THR B 210 -9.342 1.469 -20.059 1.00 0.00 H new ATOM 0 HG1 THR B 210 -8.210 -0.703 -18.550 1.00 0.00 H new ATOM 0 HG21 THR B 210 -7.420 0.414 -21.207 1.00 0.00 H new ATOM 0 HG22 THR B 210 -6.979 2.014 -20.565 1.00 0.00 H new ATOM 0 HG23 THR B 210 -6.458 0.539 -19.715 1.00 0.00 H new ATOM 1513 N TRP B 211 -10.230 3.040 -17.315 1.00 0.00 N ATOM 1514 CA TRP B 211 -11.473 3.201 -16.564 1.00 0.00 C ATOM 1515 C TRP B 211 -12.681 2.956 -17.466 1.00 0.00 C ATOM 1516 O TRP B 211 -12.970 3.755 -18.356 1.00 0.00 O ATOM 1517 CB TRP B 211 -11.545 4.615 -15.972 1.00 0.00 C ATOM 1518 CG TRP B 211 -12.909 4.857 -15.408 1.00 0.00 C ATOM 1519 CD1 TRP B 211 -13.801 5.750 -15.893 1.00 0.00 C ATOM 1520 CD2 TRP B 211 -13.559 4.199 -14.282 1.00 0.00 C ATOM 1521 NE1 TRP B 211 -14.954 5.687 -15.133 1.00 0.00 N ATOM 1522 CE2 TRP B 211 -14.853 4.747 -14.127 1.00 0.00 C ATOM 1523 CE3 TRP B 211 -13.154 3.192 -13.388 1.00 0.00 C ATOM 1524 CZ2 TRP B 211 -15.717 4.312 -13.122 1.00 0.00 C ATOM 1525 CZ3 TRP B 211 -14.021 2.752 -12.374 1.00 0.00 C ATOM 1526 CH2 TRP B 211 -15.299 3.311 -12.242 1.00 0.00 C ATOM 0 H TRP B 211 -9.900 3.890 -17.773 1.00 0.00 H new ATOM 0 HA TRP B 211 -11.487 2.469 -15.756 1.00 0.00 H new ATOM 0 HB2 TRP B 211 -10.793 4.732 -15.192 1.00 0.00 H new ATOM 0 HB3 TRP B 211 -11.323 5.354 -16.742 1.00 0.00 H new ATOM 0 HD1 TRP B 211 -13.639 6.405 -16.736 1.00 0.00 H new ATOM 0 HE1 TRP B 211 -15.779 6.265 -15.296 1.00 0.00 H new ATOM 0 HE3 TRP B 211 -12.171 2.754 -13.481 1.00 0.00 H new ATOM 0 HZ2 TRP B 211 -16.701 4.746 -13.025 1.00 0.00 H new ATOM 0 HZ3 TRP B 211 -13.701 1.978 -11.692 1.00 0.00 H new ATOM 0 HH2 TRP B 211 -15.961 2.968 -11.460 1.00 0.00 H new ATOM 1537 N GLU B 212 -13.381 1.853 -17.222 1.00 0.00 N ATOM 1538 CA GLU B 212 -14.558 1.519 -18.013 1.00 0.00 C ATOM 1539 C GLU B 212 -15.426 0.507 -17.278 1.00 0.00 C ATOM 1540 O GLU B 212 -14.969 -0.156 -16.351 1.00 0.00 O ATOM 1541 CB GLU B 212 -14.113 0.963 -19.394 1.00 0.00 C ATOM 1542 CG GLU B 212 -14.301 -0.569 -19.480 1.00 0.00 C ATOM 1543 CD GLU B 212 -13.591 -1.124 -20.717 1.00 0.00 C ATOM 1544 OE1 GLU B 212 -12.547 -0.596 -21.061 1.00 0.00 O ATOM 1545 OE2 GLU B 212 -14.105 -2.066 -21.299 1.00 0.00 O ATOM 0 H GLU B 212 -13.156 1.181 -16.489 1.00 0.00 H new ATOM 0 HA GLU B 212 -15.153 2.419 -18.168 1.00 0.00 H new ATOM 0 HB2 GLU B 212 -14.689 1.445 -20.184 1.00 0.00 H new ATOM 0 HB3 GLU B 212 -13.066 1.212 -19.566 1.00 0.00 H new ATOM 0 HG2 GLU B 212 -13.904 -1.042 -18.582 1.00 0.00 H new ATOM 0 HG3 GLU B 212 -15.363 -0.810 -19.524 1.00 0.00 H new ATOM 1552 N ASN B 213 -16.651 0.344 -17.752 1.00 0.00 N ATOM 1553 CA ASN B 213 -17.538 -0.652 -17.175 1.00 0.00 C ATOM 1554 C ASN B 213 -17.609 -0.507 -15.661 1.00 0.00 C ATOM 1555 O ASN B 213 -17.715 -1.499 -14.941 1.00 0.00 O ATOM 1556 CB ASN B 213 -17.038 -2.052 -17.547 1.00 0.00 C ATOM 1557 CG ASN B 213 -17.351 -2.353 -19.011 1.00 0.00 C ATOM 1558 OD1 ASN B 213 -17.962 -1.535 -19.699 1.00 0.00 O ATOM 1559 ND2 ASN B 213 -16.970 -3.489 -19.529 1.00 0.00 N ATOM 0 H ASN B 213 -17.049 0.880 -18.523 1.00 0.00 H new ATOM 0 HA ASN B 213 -18.541 -0.502 -17.575 1.00 0.00 H new ATOM 0 HB2 ASN B 213 -15.964 -2.120 -17.376 1.00 0.00 H new ATOM 0 HB3 ASN B 213 -17.510 -2.797 -16.906 1.00 0.00 H new ATOM 0 HD21 ASN B 213 -17.178 -3.700 -20.505 1.00 0.00 H new ATOM 0 HD22 ASN B 213 -16.464 -4.166 -18.958 1.00 0.00 H new ATOM 1566 N GLY B 214 -17.548 0.728 -15.181 1.00 0.00 N ATOM 1567 CA GLY B 214 -17.608 0.986 -13.746 1.00 0.00 C ATOM 1568 C GLY B 214 -16.596 0.128 -12.995 1.00 0.00 C ATOM 1569 O GLY B 214 -16.723 -0.086 -11.790 1.00 0.00 O ATOM 0 H GLY B 214 -17.458 1.563 -15.759 1.00 0.00 H new ATOM 0 HA2 GLY B 214 -17.410 2.041 -13.554 1.00 0.00 H new ATOM 0 HA3 GLY B 214 -18.612 0.778 -13.377 1.00 0.00 H new ATOM 1573 N LYS B 215 -15.591 -0.364 -13.715 1.00 0.00 N ATOM 1574 CA LYS B 215 -14.559 -1.199 -13.110 1.00 0.00 C ATOM 1575 C LYS B 215 -13.206 -0.957 -13.768 1.00 0.00 C ATOM 1576 O LYS B 215 -13.125 -0.627 -14.951 1.00 0.00 O ATOM 1577 CB LYS B 215 -14.931 -2.675 -13.263 1.00 0.00 C ATOM 1578 CG LYS B 215 -16.210 -2.980 -12.463 1.00 0.00 C ATOM 1579 CD LYS B 215 -16.267 -4.479 -12.116 1.00 0.00 C ATOM 1580 CE LYS B 215 -15.463 -4.759 -10.839 1.00 0.00 C ATOM 1581 NZ LYS B 215 -15.021 -6.180 -10.846 1.00 0.00 N ATOM 0 H LYS B 215 -15.470 -0.199 -14.714 1.00 0.00 H new ATOM 0 HA LYS B 215 -14.489 -0.938 -12.054 1.00 0.00 H new ATOM 0 HB2 LYS B 215 -15.085 -2.913 -14.316 1.00 0.00 H new ATOM 0 HB3 LYS B 215 -14.113 -3.303 -12.911 1.00 0.00 H new ATOM 0 HG2 LYS B 215 -16.228 -2.386 -11.550 1.00 0.00 H new ATOM 0 HG3 LYS B 215 -17.088 -2.699 -13.044 1.00 0.00 H new ATOM 0 HD2 LYS B 215 -17.303 -4.788 -11.977 1.00 0.00 H new ATOM 0 HD3 LYS B 215 -15.867 -5.066 -12.942 1.00 0.00 H new ATOM 0 HE2 LYS B 215 -14.599 -4.096 -10.785 1.00 0.00 H new ATOM 0 HE3 LYS B 215 -16.073 -4.559 -9.958 1.00 0.00 H new ATOM 0 HZ1 LYS B 215 -15.141 -6.585 -9.896 1.00 0.00 H new ATOM 0 HZ2 LYS B 215 -15.594 -6.718 -11.527 1.00 0.00 H new ATOM 0 HZ3 LYS B 215 -14.019 -6.231 -11.120 1.00 0.00 H new ATOM 1595 N TRP B 216 -12.143 -1.143 -12.993 1.00 0.00 N ATOM 1596 CA TRP B 216 -10.789 -0.960 -13.508 1.00 0.00 C ATOM 1597 C TRP B 216 -10.295 -2.256 -14.139 1.00 0.00 C ATOM 1598 O TRP B 216 -10.112 -3.265 -13.455 1.00 0.00 O ATOM 1599 CB TRP B 216 -9.852 -0.549 -12.374 1.00 0.00 C ATOM 1600 CG TRP B 216 -10.297 0.763 -11.819 1.00 0.00 C ATOM 1601 CD1 TRP B 216 -11.404 0.945 -11.069 1.00 0.00 C ATOM 1602 CD2 TRP B 216 -9.671 2.071 -11.950 1.00 0.00 C ATOM 1603 NE1 TRP B 216 -11.503 2.282 -10.733 1.00 0.00 N ATOM 1604 CE2 TRP B 216 -10.456 3.018 -11.250 1.00 0.00 C ATOM 1605 CE3 TRP B 216 -8.511 2.523 -12.601 1.00 0.00 C ATOM 1606 CZ2 TRP B 216 -10.102 4.367 -11.201 1.00 0.00 C ATOM 1607 CZ3 TRP B 216 -8.149 3.879 -12.552 1.00 0.00 C ATOM 1608 CH2 TRP B 216 -8.943 4.799 -11.854 1.00 0.00 C ATOM 0 H TRP B 216 -12.191 -1.419 -12.012 1.00 0.00 H new ATOM 0 HA TRP B 216 -10.801 -0.175 -14.264 1.00 0.00 H new ATOM 0 HB2 TRP B 216 -9.854 -1.308 -11.591 1.00 0.00 H new ATOM 0 HB3 TRP B 216 -8.829 -0.473 -12.741 1.00 0.00 H new ATOM 0 HD1 TRP B 216 -12.100 0.172 -10.779 1.00 0.00 H new ATOM 0 HE1 TRP B 216 -12.258 2.677 -10.172 1.00 0.00 H new ATOM 0 HE3 TRP B 216 -7.893 1.822 -13.143 1.00 0.00 H new ATOM 0 HZ2 TRP B 216 -10.718 5.072 -10.663 1.00 0.00 H new ATOM 0 HZ3 TRP B 216 -7.254 4.215 -13.055 1.00 0.00 H new ATOM 0 HH2 TRP B 216 -8.660 5.841 -11.820 1.00 0.00 H new ATOM 1619 N THR B 217 -10.083 -2.222 -15.455 1.00 0.00 N ATOM 1620 CA THR B 217 -9.616 -3.399 -16.193 1.00 0.00 C ATOM 1621 C THR B 217 -8.264 -3.128 -16.838 1.00 0.00 C ATOM 1622 O THR B 217 -8.056 -2.078 -17.454 1.00 0.00 O ATOM 1623 CB THR B 217 -10.632 -3.774 -17.283 1.00 0.00 C ATOM 1624 OG1 THR B 217 -11.839 -4.208 -16.674 1.00 0.00 O ATOM 1625 CG2 THR B 217 -10.066 -4.892 -18.165 1.00 0.00 C ATOM 0 H THR B 217 -10.227 -1.394 -16.033 1.00 0.00 H new ATOM 0 HA THR B 217 -9.513 -4.224 -15.488 1.00 0.00 H new ATOM 0 HB THR B 217 -10.831 -2.901 -17.904 1.00 0.00 H new ATOM 0 HG1 THR B 217 -12.489 -4.446 -17.368 1.00 0.00 H new ATOM 0 HG21 THR B 217 -10.793 -5.151 -18.935 1.00 0.00 H new ATOM 0 HG22 THR B 217 -9.144 -4.552 -18.636 1.00 0.00 H new ATOM 0 HG23 THR B 217 -9.858 -5.769 -17.552 1.00 0.00 H new ATOM 1633 N TRP B 218 -7.354 -4.092 -16.709 1.00 0.00 N ATOM 1634 CA TRP B 218 -6.021 -3.983 -17.296 1.00 0.00 C ATOM 1635 C TRP B 218 -5.913 -4.900 -18.514 1.00 0.00 C ATOM 1636 O TRP B 218 -5.798 -6.119 -18.380 1.00 0.00 O ATOM 1637 CB TRP B 218 -4.960 -4.373 -16.265 1.00 0.00 C ATOM 1638 CG TRP B 218 -3.607 -4.255 -16.884 1.00 0.00 C ATOM 1639 CD1 TRP B 218 -3.036 -5.184 -17.686 1.00 0.00 C ATOM 1640 CD2 TRP B 218 -2.646 -3.168 -16.767 1.00 0.00 C ATOM 1641 NE1 TRP B 218 -1.786 -4.731 -18.071 1.00 0.00 N ATOM 1642 CE2 TRP B 218 -1.501 -3.495 -17.531 1.00 0.00 C ATOM 1643 CE3 TRP B 218 -2.657 -1.941 -16.080 1.00 0.00 C ATOM 1644 CZ2 TRP B 218 -0.405 -2.636 -17.609 1.00 0.00 C ATOM 1645 CZ3 TRP B 218 -1.554 -1.074 -16.159 1.00 0.00 C ATOM 1646 CH2 TRP B 218 -0.432 -1.421 -16.921 1.00 0.00 C ATOM 0 H TRP B 218 -7.517 -4.961 -16.201 1.00 0.00 H new ATOM 0 HA TRP B 218 -5.856 -2.951 -17.606 1.00 0.00 H new ATOM 0 HB2 TRP B 218 -5.031 -3.726 -15.390 1.00 0.00 H new ATOM 0 HB3 TRP B 218 -5.128 -5.394 -15.921 1.00 0.00 H new ATOM 0 HD1 TRP B 218 -3.482 -6.123 -17.977 1.00 0.00 H new ATOM 0 HE1 TRP B 218 -1.153 -5.249 -18.680 1.00 0.00 H new ATOM 0 HE3 TRP B 218 -3.517 -1.664 -15.489 1.00 0.00 H new ATOM 0 HZ2 TRP B 218 0.459 -2.909 -18.197 1.00 0.00 H new ATOM 0 HZ3 TRP B 218 -1.572 -0.134 -15.628 1.00 0.00 H new ATOM 0 HH2 TRP B 218 0.412 -0.750 -16.977 1.00 0.00 H new ATOM 1657 N LYS B 219 -5.969 -4.305 -19.702 1.00 0.00 N ATOM 1658 CA LYS B 219 -5.893 -5.065 -20.953 1.00 0.00 C ATOM 1659 C LYS B 219 -4.935 -4.398 -21.925 1.00 0.00 C ATOM 1660 O LYS B 219 -4.435 -3.304 -21.671 1.00 0.00 O ATOM 1661 CB LYS B 219 -7.290 -5.172 -21.587 1.00 0.00 C ATOM 1662 CG LYS B 219 -8.101 -6.251 -20.863 1.00 0.00 C ATOM 1663 CD LYS B 219 -9.582 -6.127 -21.239 1.00 0.00 C ATOM 1664 CE LYS B 219 -9.740 -6.241 -22.753 1.00 0.00 C ATOM 1665 NZ LYS B 219 -8.894 -7.356 -23.263 1.00 0.00 N ATOM 0 H LYS B 219 -6.067 -3.298 -19.828 1.00 0.00 H new ATOM 0 HA LYS B 219 -5.522 -6.065 -20.729 1.00 0.00 H new ATOM 0 HB2 LYS B 219 -7.804 -4.213 -21.524 1.00 0.00 H new ATOM 0 HB3 LYS B 219 -7.202 -5.417 -22.645 1.00 0.00 H new ATOM 0 HG2 LYS B 219 -7.730 -7.240 -21.132 1.00 0.00 H new ATOM 0 HG3 LYS B 219 -7.980 -6.148 -19.785 1.00 0.00 H new ATOM 0 HD2 LYS B 219 -10.159 -6.908 -20.744 1.00 0.00 H new ATOM 0 HD3 LYS B 219 -9.976 -5.171 -20.894 1.00 0.00 H new ATOM 0 HE2 LYS B 219 -10.785 -6.419 -23.007 1.00 0.00 H new ATOM 0 HE3 LYS B 219 -9.451 -5.305 -23.230 1.00 0.00 H new ATOM 0 HZ1 LYS B 219 -9.318 -7.745 -24.129 1.00 0.00 H new ATOM 0 HZ2 LYS B 219 -7.940 -6.999 -23.475 1.00 0.00 H new ATOM 0 HZ3 LYS B 219 -8.832 -8.103 -22.542 1.00 0.00 H new ATOM 1679 N GLY B 220 -4.689 -5.066 -23.042 1.00 0.00 N ATOM 1680 CA GLY B 220 -3.794 -4.530 -24.049 1.00 0.00 C ATOM 1681 C GLY B 220 -3.688 -5.478 -25.237 1.00 0.00 C ATOM 1682 O GLY B 220 -4.554 -6.328 -25.443 1.00 0.00 O ATOM 0 H GLY B 220 -5.095 -5.974 -23.271 1.00 0.00 H new ATOM 0 HA2 GLY B 220 -4.157 -3.558 -24.384 1.00 0.00 H new ATOM 0 HA3 GLY B 220 -2.806 -4.370 -23.616 1.00 0.00 H new ATOM 1686 N ILE B 221 -2.634 -5.313 -26.028 1.00 0.00 N ATOM 1687 CA ILE B 221 -2.451 -6.151 -27.208 1.00 0.00 C ATOM 1688 C ILE B 221 -2.500 -7.627 -26.821 1.00 0.00 C ATOM 1689 O ILE B 221 -3.479 -8.320 -27.102 1.00 0.00 O ATOM 1690 CB ILE B 221 -1.087 -5.828 -27.859 1.00 0.00 C ATOM 1691 CG1 ILE B 221 -0.832 -4.297 -27.814 1.00 0.00 C ATOM 1692 CG2 ILE B 221 -1.089 -6.315 -29.323 1.00 0.00 C ATOM 1693 CD1 ILE B 221 0.013 -3.929 -26.579 1.00 0.00 C ATOM 0 H ILE B 221 -1.903 -4.618 -25.878 1.00 0.00 H new ATOM 0 HA ILE B 221 -3.253 -5.948 -27.917 1.00 0.00 H new ATOM 0 HB ILE B 221 -0.294 -6.336 -27.310 1.00 0.00 H new ATOM 0 HG12 ILE B 221 -0.318 -3.981 -28.722 1.00 0.00 H new ATOM 0 HG13 ILE B 221 -1.783 -3.764 -27.784 1.00 0.00 H new ATOM 0 HG21 ILE B 221 -0.127 -6.088 -29.783 1.00 0.00 H new ATOM 0 HG22 ILE B 221 -1.258 -7.392 -29.348 1.00 0.00 H new ATOM 0 HG23 ILE B 221 -1.883 -5.810 -29.873 1.00 0.00 H new ATOM 0 HD11 ILE B 221 0.183 -2.852 -26.562 1.00 0.00 H new ATOM 0 HD12 ILE B 221 -0.516 -4.227 -25.674 1.00 0.00 H new ATOM 0 HD13 ILE B 221 0.971 -4.447 -26.626 1.00 0.00 H new ATOM 1705 N ILE B 222 -1.445 -8.095 -26.175 1.00 0.00 N ATOM 1706 CA ILE B 222 -1.351 -9.485 -25.747 1.00 0.00 C ATOM 1707 C ILE B 222 -0.304 -9.628 -24.646 1.00 0.00 C ATOM 1708 O ILE B 222 0.128 -8.637 -24.062 1.00 0.00 O ATOM 1709 CB ILE B 222 -0.969 -10.377 -26.926 1.00 0.00 C ATOM 1710 CG1 ILE B 222 0.263 -9.792 -27.611 1.00 0.00 C ATOM 1711 CG2 ILE B 222 -2.118 -10.464 -27.933 1.00 0.00 C ATOM 1712 CD1 ILE B 222 0.817 -10.823 -28.579 1.00 0.00 C ATOM 0 H ILE B 222 -0.633 -7.528 -25.933 1.00 0.00 H new ATOM 0 HA ILE B 222 -2.324 -9.793 -25.363 1.00 0.00 H new ATOM 0 HB ILE B 222 -0.756 -11.380 -26.557 1.00 0.00 H new ATOM 0 HG12 ILE B 222 0.001 -8.877 -28.142 1.00 0.00 H new ATOM 0 HG13 ILE B 222 1.017 -9.526 -26.870 1.00 0.00 H new ATOM 0 HG21 ILE B 222 -1.825 -11.104 -28.765 1.00 0.00 H new ATOM 0 HG22 ILE B 222 -2.998 -10.883 -27.445 1.00 0.00 H new ATOM 0 HG23 ILE B 222 -2.350 -9.467 -28.307 1.00 0.00 H new ATOM 0 HD11 ILE B 222 1.699 -10.418 -29.076 1.00 0.00 H new ATOM 0 HD12 ILE B 222 1.091 -11.725 -28.032 1.00 0.00 H new ATOM 0 HD13 ILE B 222 0.060 -11.066 -29.324 1.00 0.00 H new ATOM 1724 N ARG B 223 0.097 -10.869 -24.381 1.00 0.00 N ATOM 1725 CA ARG B 223 1.115 -11.153 -23.374 1.00 0.00 C ATOM 1726 C ARG B 223 2.236 -10.124 -23.427 1.00 0.00 C ATOM 1727 O ARG B 223 2.277 -9.270 -24.313 1.00 0.00 O ATOM 1728 CB ARG B 223 1.679 -12.548 -23.570 1.00 0.00 C ATOM 1729 CG ARG B 223 2.328 -12.642 -24.943 1.00 0.00 C ATOM 1730 CD ARG B 223 2.807 -14.067 -25.157 1.00 0.00 C ATOM 1731 NE ARG B 223 3.477 -14.177 -26.447 1.00 0.00 N ATOM 1732 CZ ARG B 223 2.781 -14.356 -27.567 1.00 0.00 C ATOM 1733 NH1 ARG B 223 1.480 -14.444 -27.517 1.00 0.00 N ATOM 1734 NH2 ARG B 223 3.398 -14.441 -28.716 1.00 0.00 N ATOM 0 H ARG B 223 -0.269 -11.696 -24.852 1.00 0.00 H new ATOM 0 HA ARG B 223 0.643 -11.097 -22.393 1.00 0.00 H new ATOM 0 HB2 ARG B 223 2.411 -12.769 -22.793 1.00 0.00 H new ATOM 0 HB3 ARG B 223 0.885 -13.289 -23.479 1.00 0.00 H new ATOM 0 HG2 ARG B 223 1.615 -12.362 -25.718 1.00 0.00 H new ATOM 0 HG3 ARG B 223 3.165 -11.947 -25.014 1.00 0.00 H new ATOM 0 HD2 ARG B 223 3.490 -14.354 -24.357 1.00 0.00 H new ATOM 0 HD3 ARG B 223 1.962 -14.754 -25.117 1.00 0.00 H new ATOM 0 HE ARG B 223 4.494 -14.116 -26.492 1.00 0.00 H new ATOM 0 HH11 ARG B 223 0.998 -14.376 -26.621 1.00 0.00 H new ATOM 0 HH12 ARG B 223 0.945 -14.581 -28.374 1.00 0.00 H new ATOM 0 HH21 ARG B 223 4.415 -14.370 -28.755 1.00 0.00 H new ATOM 0 HH22 ARG B 223 2.863 -14.578 -29.573 1.00 0.00 H new ATOM 1748 N LEU B 224 3.149 -10.218 -22.475 1.00 0.00 N ATOM 1749 CA LEU B 224 4.259 -9.292 -22.416 1.00 0.00 C ATOM 1750 C LEU B 224 5.147 -9.422 -23.647 1.00 0.00 C ATOM 1751 O LEU B 224 5.844 -10.423 -23.833 1.00 0.00 O ATOM 1752 CB LEU B 224 5.080 -9.538 -21.149 1.00 0.00 C ATOM 1753 CG LEU B 224 4.224 -9.310 -19.886 1.00 0.00 C ATOM 1754 CD1 LEU B 224 3.624 -7.896 -19.895 1.00 0.00 C ATOM 1755 CD2 LEU B 224 3.096 -10.356 -19.801 1.00 0.00 C ATOM 0 H LEU B 224 3.141 -10.923 -21.738 1.00 0.00 H new ATOM 0 HA LEU B 224 3.856 -8.279 -22.393 1.00 0.00 H new ATOM 0 HB2 LEU B 224 5.466 -10.558 -21.153 1.00 0.00 H new ATOM 0 HB3 LEU B 224 5.942 -8.871 -21.134 1.00 0.00 H new ATOM 0 HG LEU B 224 4.868 -9.416 -19.013 1.00 0.00 H new ATOM 0 HD11 LEU B 224 3.023 -7.750 -18.998 1.00 0.00 H new ATOM 0 HD12 LEU B 224 4.428 -7.160 -19.917 1.00 0.00 H new ATOM 0 HD13 LEU B 224 2.995 -7.773 -20.777 1.00 0.00 H new ATOM 0 HD21 LEU B 224 2.503 -10.179 -18.904 1.00 0.00 H new ATOM 0 HD22 LEU B 224 2.457 -10.274 -20.680 1.00 0.00 H new ATOM 0 HD23 LEU B 224 3.529 -11.355 -19.759 1.00 0.00 H new ATOM 1767 N GLU B 225 5.106 -8.396 -24.490 1.00 0.00 N ATOM 1768 CA GLU B 225 5.897 -8.374 -25.714 1.00 0.00 C ATOM 1769 C GLU B 225 7.196 -7.615 -25.481 1.00 0.00 C ATOM 1770 O GLU B 225 7.250 -6.681 -24.679 1.00 0.00 O ATOM 1771 CB GLU B 225 5.103 -7.700 -26.838 1.00 0.00 C ATOM 1772 CG GLU B 225 5.772 -8.006 -28.180 1.00 0.00 C ATOM 1773 CD GLU B 225 5.555 -9.470 -28.544 1.00 0.00 C ATOM 1774 OE1 GLU B 225 4.809 -10.131 -27.838 1.00 0.00 O ATOM 1775 OE2 GLU B 225 6.141 -9.912 -29.519 1.00 0.00 O ATOM 0 H GLU B 225 4.531 -7.566 -24.347 1.00 0.00 H new ATOM 0 HA GLU B 225 6.128 -9.400 -26.002 1.00 0.00 H new ATOM 0 HB2 GLU B 225 4.075 -8.061 -26.840 1.00 0.00 H new ATOM 0 HB3 GLU B 225 5.062 -6.623 -26.676 1.00 0.00 H new ATOM 0 HG2 GLU B 225 5.359 -7.364 -28.957 1.00 0.00 H new ATOM 0 HG3 GLU B 225 6.839 -7.791 -28.122 1.00 0.00 H new