USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 707 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 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ -164:sc= -0.348 (180deg=-0.749) USER MOD Single : A 18 MET CE :methyl -118:sc= -3.59! (180deg=-7.64!) USER MOD Single : A 21 ASN : amide:sc= -1.23 K(o=-1.2,f=-2.2) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot -68:sc= -0.159 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 53:sc= 1.21 USER MOD Single : A 37 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0363) USER MOD Single : A 46 THR OG1 : rot 81:sc= -4.18! USER MOD Single : A 56 THR OG1 : rot 150:sc= -0.621 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.521 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 153:sc= -0.135 (180deg=-0.738) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -110:sc= -1.38 (180deg=-3.49!) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.630 -8.029 -7.510 1.00 0.00 N ATOM 76 CA LEU A 5 10.897 -8.050 -8.234 1.00 0.00 C ATOM 77 C LEU A 5 11.165 -9.430 -8.824 1.00 0.00 C ATOM 78 O LEU A 5 11.110 -10.440 -8.121 1.00 0.00 O ATOM 79 CB LEU A 5 12.043 -7.648 -7.304 1.00 0.00 C ATOM 80 CG LEU A 5 13.183 -6.858 -7.948 1.00 0.00 C ATOM 81 CD1 LEU A 5 13.763 -7.622 -9.128 1.00 0.00 C ATOM 82 CD2 LEU A 5 12.699 -5.483 -8.385 1.00 0.00 C ATOM 0 HA LEU A 5 10.832 -7.333 -9.053 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.631 -7.054 -6.488 1.00 0.00 H new ATOM 0 HB3 LEU A 5 12.459 -8.553 -6.861 1.00 0.00 H new ATOM 0 HG LEU A 5 13.971 -6.725 -7.207 1.00 0.00 H new ATOM 0 HD11 LEU A 5 14.573 -7.044 -9.573 1.00 0.00 H new ATOM 0 HD12 LEU A 5 14.148 -8.582 -8.786 1.00 0.00 H new ATOM 0 HD13 LEU A 5 12.984 -7.788 -9.872 1.00 0.00 H new ATOM 0 HD21 LEU A 5 13.524 -4.935 -8.841 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.893 -5.595 -9.110 1.00 0.00 H new ATOM 0 HD23 LEU A 5 12.334 -4.933 -7.518 1.00 0.00 H new ATOM 94 N LYS A 6 11.456 -9.467 -10.120 1.00 0.00 N ATOM 95 CA LYS A 6 11.737 -10.723 -10.806 1.00 0.00 C ATOM 96 C LYS A 6 13.086 -10.665 -11.516 1.00 0.00 C ATOM 97 O LYS A 6 13.367 -9.727 -12.261 1.00 0.00 O ATOM 98 CB LYS A 6 10.630 -11.035 -11.815 1.00 0.00 C ATOM 99 CG LYS A 6 10.162 -9.821 -12.600 1.00 0.00 C ATOM 100 CD LYS A 6 9.658 -10.210 -13.979 1.00 0.00 C ATOM 101 CE LYS A 6 8.329 -10.946 -13.900 1.00 0.00 C ATOM 102 NZ LYS A 6 7.956 -11.560 -15.205 1.00 0.00 N ATOM 0 H LYS A 6 11.503 -8.641 -10.717 1.00 0.00 H new ATOM 0 HA LYS A 6 11.773 -11.516 -10.059 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.989 -11.792 -12.512 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.779 -11.466 -11.287 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.368 -9.315 -12.051 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.983 -9.111 -12.699 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.544 -9.316 -14.591 1.00 0.00 H new ATOM 0 HD3 LYS A 6 10.396 -10.842 -14.472 1.00 0.00 H new ATOM 0 HE2 LYS A 6 8.389 -11.722 -13.137 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.548 -10.253 -13.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 7.045 -12.052 -15.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.874 -10.817 -15.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.689 -12.241 -15.490 1.00 0.00 H new ATOM 116 N VAL A 7 13.917 -11.676 -11.281 1.00 0.00 N ATOM 117 CA VAL A 7 15.235 -11.742 -11.901 1.00 0.00 C ATOM 118 C VAL A 7 15.264 -12.773 -13.023 1.00 0.00 C ATOM 119 O VAL A 7 14.802 -13.902 -12.856 1.00 0.00 O ATOM 120 CB VAL A 7 16.323 -12.090 -10.869 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.314 -11.089 -9.724 1.00 0.00 C ATOM 122 CG2 VAL A 7 16.131 -13.508 -10.350 1.00 0.00 C ATOM 0 H VAL A 7 13.701 -12.460 -10.666 1.00 0.00 H new ATOM 0 HA VAL A 7 15.440 -10.755 -12.315 1.00 0.00 H new ATOM 0 HB VAL A 7 17.295 -12.035 -11.360 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.090 -11.352 -9.005 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.504 -10.089 -10.114 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.342 -11.108 -9.232 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.909 -13.737 -9.622 1.00 0.00 H new ATOM 0 HG22 VAL A 7 15.153 -13.593 -9.876 1.00 0.00 H new ATOM 0 HG23 VAL A 7 16.193 -14.211 -11.181 1.00 0.00 H new ATOM 132 N LYS A 8 15.811 -12.379 -14.168 1.00 0.00 N ATOM 133 CA LYS A 8 15.903 -13.269 -15.319 1.00 0.00 C ATOM 134 C LYS A 8 17.275 -13.166 -15.978 1.00 0.00 C ATOM 135 O LYS A 8 17.858 -12.084 -16.056 1.00 0.00 O ATOM 136 CB LYS A 8 14.810 -12.935 -16.337 1.00 0.00 C ATOM 137 CG LYS A 8 14.836 -11.490 -16.805 1.00 0.00 C ATOM 138 CD LYS A 8 15.651 -11.331 -18.077 1.00 0.00 C ATOM 139 CE LYS A 8 14.783 -11.475 -19.317 1.00 0.00 C ATOM 140 NZ LYS A 8 14.432 -12.897 -19.586 1.00 0.00 N ATOM 0 H LYS A 8 16.198 -11.448 -14.324 1.00 0.00 H new ATOM 0 HA LYS A 8 15.764 -14.292 -14.968 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.918 -13.590 -17.201 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.836 -13.148 -15.895 1.00 0.00 H new ATOM 0 HG2 LYS A 8 13.817 -11.145 -16.979 1.00 0.00 H new ATOM 0 HG3 LYS A 8 15.257 -10.860 -16.021 1.00 0.00 H new ATOM 0 HD2 LYS A 8 16.134 -10.354 -18.081 1.00 0.00 H new ATOM 0 HD3 LYS A 8 16.444 -12.078 -18.098 1.00 0.00 H new ATOM 0 HE2 LYS A 8 13.870 -10.893 -19.191 1.00 0.00 H new ATOM 0 HE3 LYS A 8 15.308 -11.061 -20.178 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 14.081 -12.990 -20.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 15.276 -13.492 -19.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.693 -13.204 -18.922 1.00 0.00 H new ATOM 154 N VAL A 9 17.786 -14.298 -16.451 1.00 0.00 N ATOM 155 CA VAL A 9 19.088 -14.335 -17.106 1.00 0.00 C ATOM 156 C VAL A 9 19.036 -13.657 -18.471 1.00 0.00 C ATOM 157 O VAL A 9 18.269 -14.059 -19.345 1.00 0.00 O ATOM 158 CB VAL A 9 19.588 -15.781 -17.282 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.961 -15.796 -17.937 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.619 -16.500 -15.942 1.00 0.00 C ATOM 0 H VAL A 9 17.318 -15.202 -16.393 1.00 0.00 H new ATOM 0 HA VAL A 9 19.782 -13.795 -16.461 1.00 0.00 H new ATOM 0 HB VAL A 9 18.895 -16.310 -17.936 1.00 0.00 H new ATOM 0 HG11 VAL A 9 21.298 -16.826 -18.053 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.902 -15.321 -18.916 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.668 -15.251 -17.312 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.975 -17.520 -16.085 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.289 -15.974 -15.262 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.615 -16.522 -15.517 1.00 0.00 H new ATOM 170 N GLU A 10 19.858 -12.627 -18.645 1.00 0.00 N ATOM 171 CA GLU A 10 19.905 -11.893 -19.905 1.00 0.00 C ATOM 172 C GLU A 10 21.007 -12.436 -20.810 1.00 0.00 C ATOM 173 O GLU A 10 20.853 -12.488 -22.030 1.00 0.00 O ATOM 174 CB GLU A 10 20.132 -10.402 -19.644 1.00 0.00 C ATOM 175 CG GLU A 10 21.508 -10.086 -19.080 1.00 0.00 C ATOM 176 CD GLU A 10 22.519 -9.756 -20.161 1.00 0.00 C ATOM 177 OE1 GLU A 10 22.177 -9.886 -21.354 1.00 0.00 O ATOM 178 OE2 GLU A 10 23.654 -9.368 -19.812 1.00 0.00 O ATOM 0 H GLU A 10 20.500 -12.282 -17.931 1.00 0.00 H new ATOM 0 HA GLU A 10 18.947 -12.025 -20.409 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.996 -9.854 -20.576 1.00 0.00 H new ATOM 0 HB3 GLU A 10 19.373 -10.043 -18.949 1.00 0.00 H new ATOM 0 HG2 GLU A 10 21.430 -9.245 -18.391 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.865 -10.939 -18.502 1.00 0.00 H new ATOM 185 N ASP A 11 22.118 -12.838 -20.203 1.00 0.00 N ATOM 186 CA ASP A 11 23.247 -13.378 -20.953 1.00 0.00 C ATOM 187 C ASP A 11 24.263 -14.024 -20.016 1.00 0.00 C ATOM 188 O ASP A 11 24.983 -13.335 -19.294 1.00 0.00 O ATOM 189 CB ASP A 11 23.919 -12.273 -21.770 1.00 0.00 C ATOM 190 CG ASP A 11 24.927 -12.818 -22.762 1.00 0.00 C ATOM 191 OD1 ASP A 11 25.242 -14.024 -22.686 1.00 0.00 O ATOM 192 OD2 ASP A 11 25.401 -12.039 -23.614 1.00 0.00 O ATOM 0 H ASP A 11 22.261 -12.800 -19.194 1.00 0.00 H new ATOM 0 HA ASP A 11 22.868 -14.142 -21.632 1.00 0.00 H new ATOM 0 HB2 ASP A 11 23.157 -11.706 -22.305 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.418 -11.578 -21.095 1.00 0.00 H new ATOM 197 N PHE A 12 24.314 -15.352 -20.033 1.00 0.00 N ATOM 198 CA PHE A 12 25.240 -16.092 -19.184 1.00 0.00 C ATOM 199 C PHE A 12 26.329 -16.759 -20.019 1.00 0.00 C ATOM 200 O PHE A 12 26.233 -16.828 -21.244 1.00 0.00 O ATOM 201 CB PHE A 12 24.488 -17.146 -18.370 1.00 0.00 C ATOM 202 CG PHE A 12 24.043 -18.327 -19.184 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.821 -18.314 -19.838 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.846 -19.451 -19.295 1.00 0.00 C ATOM 205 CE1 PHE A 12 22.409 -19.399 -20.589 1.00 0.00 C ATOM 206 CE2 PHE A 12 24.439 -20.539 -20.045 1.00 0.00 C ATOM 207 CZ PHE A 12 23.219 -20.513 -20.691 1.00 0.00 C ATOM 0 H PHE A 12 23.725 -15.937 -20.625 1.00 0.00 H new ATOM 0 HA PHE A 12 25.712 -15.385 -18.502 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.129 -17.494 -17.560 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.615 -16.683 -17.909 1.00 0.00 H new ATOM 0 HD1 PHE A 12 22.183 -17.446 -19.760 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.800 -19.477 -18.790 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.455 -19.376 -21.095 1.00 0.00 H new ATOM 0 HE2 PHE A 12 25.075 -21.408 -20.125 1.00 0.00 H new ATOM 0 HZ PHE A 12 22.898 -21.363 -21.275 1.00 0.00 H new ATOM 217 N GLY A 13 27.366 -17.250 -19.346 1.00 0.00 N ATOM 218 CA GLY A 13 28.458 -17.905 -20.041 1.00 0.00 C ATOM 219 C GLY A 13 29.546 -18.377 -19.097 1.00 0.00 C ATOM 220 O GLY A 13 29.336 -18.455 -17.886 1.00 0.00 O ATOM 0 H GLY A 13 27.469 -17.205 -18.332 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.070 -18.757 -20.599 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.887 -17.216 -20.769 1.00 0.00 H new ATOM 224 N PHE A 14 30.711 -18.695 -19.650 1.00 0.00 N ATOM 225 CA PHE A 14 31.836 -19.165 -18.849 1.00 0.00 C ATOM 226 C PHE A 14 33.135 -18.498 -19.293 1.00 0.00 C ATOM 227 O PHE A 14 33.442 -18.442 -20.484 1.00 0.00 O ATOM 228 CB PHE A 14 31.966 -20.685 -18.958 1.00 0.00 C ATOM 229 CG PHE A 14 33.236 -21.222 -18.361 1.00 0.00 C ATOM 230 CD1 PHE A 14 33.318 -21.496 -17.005 1.00 0.00 C ATOM 231 CD2 PHE A 14 34.348 -21.452 -19.155 1.00 0.00 C ATOM 232 CE1 PHE A 14 34.485 -21.990 -16.452 1.00 0.00 C ATOM 233 CE2 PHE A 14 35.517 -21.946 -18.608 1.00 0.00 C ATOM 234 CZ PHE A 14 35.586 -22.214 -17.255 1.00 0.00 C ATOM 0 H PHE A 14 30.902 -18.636 -20.650 1.00 0.00 H new ATOM 0 HA PHE A 14 31.648 -18.897 -17.809 1.00 0.00 H new ATOM 0 HB2 PHE A 14 31.115 -21.151 -18.461 1.00 0.00 H new ATOM 0 HB3 PHE A 14 31.918 -20.971 -20.009 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.460 -21.322 -16.373 1.00 0.00 H new ATOM 0 HD2 PHE A 14 34.301 -21.243 -20.213 1.00 0.00 H new ATOM 0 HE1 PHE A 14 34.535 -22.200 -15.394 1.00 0.00 H new ATOM 0 HE2 PHE A 14 36.376 -22.122 -19.238 1.00 0.00 H new ATOM 0 HZ PHE A 14 36.499 -22.598 -16.826 1.00 0.00 H new ATOM 244 N ARG A 15 33.894 -17.994 -18.325 1.00 0.00 N ATOM 245 CA ARG A 15 35.160 -17.330 -18.615 1.00 0.00 C ATOM 246 C ARG A 15 36.337 -18.263 -18.345 1.00 0.00 C ATOM 247 O ARG A 15 36.641 -18.577 -17.195 1.00 0.00 O ATOM 248 CB ARG A 15 35.298 -16.060 -17.773 1.00 0.00 C ATOM 249 CG ARG A 15 36.017 -14.930 -18.490 1.00 0.00 C ATOM 250 CD ARG A 15 35.225 -14.440 -19.693 1.00 0.00 C ATOM 251 NE ARG A 15 35.569 -13.067 -20.053 1.00 0.00 N ATOM 252 CZ ARG A 15 34.897 -12.352 -20.948 1.00 0.00 C ATOM 253 NH1 ARG A 15 33.851 -12.877 -21.571 1.00 0.00 N ATOM 254 NH2 ARG A 15 35.271 -11.108 -21.221 1.00 0.00 N ATOM 0 H ARG A 15 33.655 -18.033 -17.334 1.00 0.00 H new ATOM 0 HA ARG A 15 35.167 -17.060 -19.671 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.305 -15.719 -17.479 1.00 0.00 H new ATOM 0 HB3 ARG A 15 35.837 -16.299 -16.856 1.00 0.00 H new ATOM 0 HG2 ARG A 15 36.179 -14.103 -17.798 1.00 0.00 H new ATOM 0 HG3 ARG A 15 37.000 -15.271 -18.815 1.00 0.00 H new ATOM 0 HD2 ARG A 15 35.414 -15.096 -20.543 1.00 0.00 H new ATOM 0 HD3 ARG A 15 34.159 -14.501 -19.474 1.00 0.00 H new ATOM 0 HE ARG A 15 36.369 -12.634 -19.592 1.00 0.00 H new ATOM 0 HH11 ARG A 15 33.560 -13.832 -21.363 1.00 0.00 H new ATOM 0 HH12 ARG A 15 33.337 -12.325 -22.258 1.00 0.00 H new ATOM 0 HH21 ARG A 15 36.075 -10.701 -20.743 1.00 0.00 H new ATOM 0 HH22 ARG A 15 34.754 -10.559 -21.908 1.00 0.00 H new ATOM 268 N GLU A 16 36.995 -18.701 -19.414 1.00 0.00 N ATOM 269 CA GLU A 16 38.138 -19.598 -19.292 1.00 0.00 C ATOM 270 C GLU A 16 39.340 -18.870 -18.696 1.00 0.00 C ATOM 271 O GLU A 16 40.223 -19.489 -18.103 1.00 0.00 O ATOM 272 CB GLU A 16 38.506 -20.180 -20.658 1.00 0.00 C ATOM 273 CG GLU A 16 39.093 -19.158 -21.617 1.00 0.00 C ATOM 274 CD GLU A 16 39.492 -19.768 -22.947 1.00 0.00 C ATOM 275 OE1 GLU A 16 38.616 -19.898 -23.827 1.00 0.00 O ATOM 276 OE2 GLU A 16 40.681 -20.115 -23.107 1.00 0.00 O ATOM 0 H GLU A 16 36.756 -18.449 -20.373 1.00 0.00 H new ATOM 0 HA GLU A 16 37.859 -20.411 -18.622 1.00 0.00 H new ATOM 0 HB2 GLU A 16 39.224 -20.988 -20.518 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.616 -20.619 -21.108 1.00 0.00 H new ATOM 0 HG2 GLU A 16 38.364 -18.366 -21.789 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.966 -18.694 -21.158 1.00 0.00 H new ATOM 283 N ASP A 17 39.367 -17.552 -18.860 1.00 0.00 N ATOM 284 CA ASP A 17 40.459 -16.738 -18.339 1.00 0.00 C ATOM 285 C ASP A 17 40.577 -16.892 -16.826 1.00 0.00 C ATOM 286 O ASP A 17 41.653 -16.712 -16.257 1.00 0.00 O ATOM 287 CB ASP A 17 40.245 -15.267 -18.700 1.00 0.00 C ATOM 288 CG ASP A 17 40.511 -14.986 -20.166 1.00 0.00 C ATOM 289 OD1 ASP A 17 41.427 -15.616 -20.734 1.00 0.00 O ATOM 290 OD2 ASP A 17 39.804 -14.134 -20.744 1.00 0.00 O ATOM 0 H ASP A 17 38.645 -17.024 -19.350 1.00 0.00 H new ATOM 0 HA ASP A 17 41.387 -17.084 -18.795 1.00 0.00 H new ATOM 0 HB2 ASP A 17 39.221 -14.982 -18.458 1.00 0.00 H new ATOM 0 HB3 ASP A 17 40.901 -14.647 -18.089 1.00 0.00 H new ATOM 295 N MET A 18 39.464 -17.224 -16.181 1.00 0.00 N ATOM 296 CA MET A 18 39.443 -17.402 -14.734 1.00 0.00 C ATOM 297 C MET A 18 39.119 -18.847 -14.368 1.00 0.00 C ATOM 298 O MET A 18 39.616 -19.371 -13.373 1.00 0.00 O ATOM 299 CB MET A 18 38.419 -16.460 -14.098 1.00 0.00 C ATOM 300 CG MET A 18 38.761 -14.988 -14.264 1.00 0.00 C ATOM 301 SD MET A 18 37.699 -14.160 -15.462 1.00 0.00 S ATOM 302 CE MET A 18 36.192 -13.980 -14.512 1.00 0.00 C ATOM 0 H MET A 18 38.565 -17.375 -16.638 1.00 0.00 H new ATOM 0 HA MET A 18 40.434 -17.163 -14.349 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.440 -16.649 -14.539 1.00 0.00 H new ATOM 0 HB3 MET A 18 38.339 -16.688 -13.035 1.00 0.00 H new ATOM 0 HG2 MET A 18 38.674 -14.488 -13.300 1.00 0.00 H new ATOM 0 HG3 MET A 18 39.800 -14.894 -14.579 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.388 -14.533 -14.997 1.00 0.00 H new ATOM 0 HE2 MET A 18 36.347 -14.372 -13.507 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.923 -12.925 -14.453 1.00 0.00 H new ATOM 312 N GLY A 19 38.281 -19.485 -15.181 1.00 0.00 N ATOM 313 CA GLY A 19 37.905 -20.863 -14.925 1.00 0.00 C ATOM 314 C GLY A 19 36.633 -20.974 -14.109 1.00 0.00 C ATOM 315 O GLY A 19 36.425 -21.960 -13.400 1.00 0.00 O ATOM 0 H GLY A 19 37.857 -19.072 -16.011 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.771 -21.382 -15.874 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.716 -21.366 -14.398 1.00 0.00 H new ATOM 319 N LEU A 20 35.779 -19.961 -14.206 1.00 0.00 N ATOM 320 CA LEU A 20 34.520 -19.949 -13.469 1.00 0.00 C ATOM 321 C LEU A 20 33.359 -19.567 -14.382 1.00 0.00 C ATOM 322 O LEU A 20 33.563 -19.047 -15.478 1.00 0.00 O ATOM 323 CB LEU A 20 34.603 -18.972 -12.295 1.00 0.00 C ATOM 324 CG LEU A 20 35.404 -17.693 -12.542 1.00 0.00 C ATOM 325 CD1 LEU A 20 34.703 -16.813 -13.565 1.00 0.00 C ATOM 326 CD2 LEU A 20 35.613 -16.935 -11.239 1.00 0.00 C ATOM 0 H LEU A 20 35.935 -19.138 -14.787 1.00 0.00 H new ATOM 0 HA LEU A 20 34.342 -20.954 -13.086 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.589 -18.692 -12.009 1.00 0.00 H new ATOM 0 HB3 LEU A 20 35.042 -19.493 -11.445 1.00 0.00 H new ATOM 0 HG LEU A 20 36.380 -17.970 -12.939 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.288 -15.908 -13.728 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.605 -17.356 -14.505 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.713 -16.544 -13.196 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.185 -16.028 -11.434 1.00 0.00 H new ATOM 0 HD22 LEU A 20 34.645 -16.670 -10.813 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.159 -17.564 -10.536 1.00 0.00 H new ATOM 338 N ASN A 21 32.140 -19.827 -13.920 1.00 0.00 N ATOM 339 CA ASN A 21 30.945 -19.509 -14.695 1.00 0.00 C ATOM 340 C ASN A 21 30.331 -18.192 -14.231 1.00 0.00 C ATOM 341 O ASN A 21 30.338 -17.876 -13.041 1.00 0.00 O ATOM 342 CB ASN A 21 29.917 -20.635 -14.571 1.00 0.00 C ATOM 343 CG ASN A 21 30.475 -21.977 -15.006 1.00 0.00 C ATOM 344 OD1 ASN A 21 31.354 -22.538 -14.352 1.00 0.00 O ATOM 345 ND2 ASN A 21 29.964 -22.498 -16.116 1.00 0.00 N ATOM 0 H ASN A 21 31.953 -20.257 -13.014 1.00 0.00 H new ATOM 0 HA ASN A 21 31.237 -19.406 -15.740 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.579 -20.703 -13.537 1.00 0.00 H new ATOM 0 HB3 ASN A 21 29.043 -20.394 -15.177 1.00 0.00 H new ATOM 0 HD21 ASN A 21 30.299 -23.399 -16.458 1.00 0.00 H new ATOM 0 HD22 ASN A 21 29.236 -21.997 -16.626 1.00 0.00 H new ATOM 352 N TYR A 22 29.800 -17.427 -15.178 1.00 0.00 N ATOM 353 CA TYR A 22 29.183 -16.143 -14.868 1.00 0.00 C ATOM 354 C TYR A 22 27.823 -16.013 -15.548 1.00 0.00 C ATOM 355 O TYR A 22 27.576 -16.622 -16.590 1.00 0.00 O ATOM 356 CB TYR A 22 30.096 -14.996 -15.304 1.00 0.00 C ATOM 357 CG TYR A 22 30.112 -14.770 -16.798 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.176 -13.941 -17.405 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.062 -15.385 -17.604 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.186 -13.732 -18.771 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.081 -15.180 -18.970 1.00 0.00 C ATOM 362 CZ TYR A 22 30.141 -14.353 -19.549 1.00 0.00 C ATOM 363 OH TYR A 22 30.155 -14.147 -20.909 1.00 0.00 O ATOM 0 H TYR A 22 29.784 -17.674 -16.168 1.00 0.00 H new ATOM 0 HA TYR A 22 29.036 -16.091 -13.789 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.775 -14.079 -14.810 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.111 -15.202 -14.965 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.428 -13.452 -16.799 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.799 -16.035 -17.155 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.450 -13.086 -19.227 1.00 0.00 H new ATOM 0 HE2 TYR A 22 31.828 -15.665 -19.581 1.00 0.00 H new ATOM 0 HH TYR A 22 30.891 -14.656 -21.309 1.00 0.00 H new ATOM 373 N VAL A 23 26.944 -15.214 -14.952 1.00 0.00 N ATOM 374 CA VAL A 23 25.610 -15.001 -15.500 1.00 0.00 C ATOM 375 C VAL A 23 25.120 -13.585 -15.219 1.00 0.00 C ATOM 376 O VAL A 23 25.292 -13.065 -14.117 1.00 0.00 O ATOM 377 CB VAL A 23 24.598 -16.007 -14.921 1.00 0.00 C ATOM 378 CG1 VAL A 23 24.729 -16.085 -13.408 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.181 -15.628 -15.323 1.00 0.00 C ATOM 0 H VAL A 23 27.132 -14.703 -14.089 1.00 0.00 H new ATOM 0 HA VAL A 23 25.683 -15.150 -16.577 1.00 0.00 H new ATOM 0 HB VAL A 23 24.816 -16.993 -15.332 1.00 0.00 H new ATOM 0 HG11 VAL A 23 24.006 -16.801 -13.017 1.00 0.00 H new ATOM 0 HG12 VAL A 23 25.737 -16.407 -13.146 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.538 -15.103 -12.975 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.479 -16.350 -14.905 1.00 0.00 H new ATOM 0 HG22 VAL A 23 22.949 -14.633 -14.942 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.099 -15.629 -16.410 1.00 0.00 H new ATOM 389 N ARG A 24 24.508 -12.966 -16.224 1.00 0.00 N ATOM 390 CA ARG A 24 23.993 -11.609 -16.085 1.00 0.00 C ATOM 391 C ARG A 24 22.493 -11.623 -15.806 1.00 0.00 C ATOM 392 O ARG A 24 21.723 -12.259 -16.526 1.00 0.00 O ATOM 393 CB ARG A 24 24.280 -10.800 -17.351 1.00 0.00 C ATOM 394 CG ARG A 24 25.644 -10.129 -17.349 1.00 0.00 C ATOM 395 CD ARG A 24 26.767 -11.150 -17.257 1.00 0.00 C ATOM 396 NE ARG A 24 28.042 -10.604 -17.716 1.00 0.00 N ATOM 397 CZ ARG A 24 28.370 -10.480 -18.997 1.00 0.00 C ATOM 398 NH1 ARG A 24 27.521 -10.860 -19.942 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.549 -9.974 -19.335 1.00 0.00 N ATOM 0 H ARG A 24 24.357 -13.383 -17.143 1.00 0.00 H new ATOM 0 HA ARG A 24 24.498 -11.140 -15.240 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.210 -11.459 -18.217 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.510 -10.038 -17.467 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.761 -9.538 -18.258 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.709 -9.438 -16.509 1.00 0.00 H new ATOM 0 HD2 ARG A 24 26.867 -11.487 -16.225 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.511 -12.025 -17.854 1.00 0.00 H new ATOM 0 HE ARG A 24 28.717 -10.301 -17.014 1.00 0.00 H new ATOM 0 HH11 ARG A 24 26.613 -11.249 -19.686 1.00 0.00 H new ATOM 0 HH12 ARG A 24 27.776 -10.764 -20.925 1.00 0.00 H new ATOM 0 HH21 ARG A 24 30.204 -9.680 -18.611 1.00 0.00 H new ATOM 0 HH22 ARG A 24 29.800 -9.879 -20.319 1.00 0.00 H new ATOM 413 N TYR A 25 22.085 -10.917 -14.757 1.00 0.00 N ATOM 414 CA TYR A 25 20.678 -10.851 -14.381 1.00 0.00 C ATOM 415 C TYR A 25 20.110 -9.459 -14.640 1.00 0.00 C ATOM 416 O TYR A 25 20.761 -8.450 -14.366 1.00 0.00 O ATOM 417 CB TYR A 25 20.505 -11.218 -12.906 1.00 0.00 C ATOM 418 CG TYR A 25 20.925 -12.634 -12.581 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.136 -13.716 -12.951 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.111 -12.889 -11.904 1.00 0.00 C ATOM 421 CE1 TYR A 25 20.516 -15.011 -12.656 1.00 0.00 C ATOM 422 CE2 TYR A 25 22.499 -14.181 -11.605 1.00 0.00 C ATOM 423 CZ TYR A 25 21.698 -15.238 -11.983 1.00 0.00 C ATOM 424 OH TYR A 25 22.081 -16.526 -11.688 1.00 0.00 O ATOM 0 H TYR A 25 22.709 -10.383 -14.152 1.00 0.00 H new ATOM 0 HA TYR A 25 20.130 -11.567 -14.994 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.088 -10.526 -12.297 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.460 -11.085 -12.627 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.210 -13.542 -13.478 1.00 0.00 H new ATOM 0 HD2 TYR A 25 22.740 -12.063 -11.606 1.00 0.00 H new ATOM 0 HE1 TYR A 25 19.891 -15.841 -12.951 1.00 0.00 H new ATOM 0 HE2 TYR A 25 23.424 -14.362 -11.078 1.00 0.00 H new ATOM 0 HH TYR A 25 21.470 -16.905 -11.022 1.00 0.00 H new ATOM 434 N ARG A 26 18.892 -9.413 -15.170 1.00 0.00 N ATOM 435 CA ARG A 26 18.236 -8.146 -15.467 1.00 0.00 C ATOM 436 C ARG A 26 17.084 -7.890 -14.500 1.00 0.00 C ATOM 437 O ARG A 26 16.085 -8.609 -14.503 1.00 0.00 O ATOM 438 CB ARG A 26 17.718 -8.141 -16.906 1.00 0.00 C ATOM 439 CG ARG A 26 17.757 -6.771 -17.563 1.00 0.00 C ATOM 440 CD ARG A 26 18.044 -6.875 -19.053 1.00 0.00 C ATOM 441 NE ARG A 26 18.497 -5.605 -19.614 1.00 0.00 N ATOM 442 CZ ARG A 26 18.514 -5.340 -20.915 1.00 0.00 C ATOM 443 NH1 ARG A 26 18.105 -6.253 -21.786 1.00 0.00 N ATOM 444 NH2 ARG A 26 18.940 -4.161 -21.348 1.00 0.00 N ATOM 0 H ARG A 26 18.340 -10.239 -15.402 1.00 0.00 H new ATOM 0 HA ARG A 26 18.970 -7.349 -15.349 1.00 0.00 H new ATOM 0 HB2 ARG A 26 18.312 -8.836 -17.499 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.692 -8.510 -16.915 1.00 0.00 H new ATOM 0 HG2 ARG A 26 16.804 -6.266 -17.410 1.00 0.00 H new ATOM 0 HG3 ARG A 26 18.523 -6.159 -17.086 1.00 0.00 H new ATOM 0 HD2 ARG A 26 18.804 -7.638 -19.223 1.00 0.00 H new ATOM 0 HD3 ARG A 26 17.143 -7.200 -19.574 1.00 0.00 H new ATOM 0 HE ARG A 26 18.818 -4.881 -18.971 1.00 0.00 H new ATOM 0 HH11 ARG A 26 17.777 -7.161 -21.457 1.00 0.00 H new ATOM 0 HH12 ARG A 26 18.119 -6.047 -22.785 1.00 0.00 H new ATOM 0 HH21 ARG A 26 19.255 -3.456 -20.681 1.00 0.00 H new ATOM 0 HH22 ARG A 26 18.952 -3.959 -22.348 1.00 0.00 H new ATOM 458 N VAL A 27 17.231 -6.861 -13.671 1.00 0.00 N ATOM 459 CA VAL A 27 16.203 -6.510 -12.698 1.00 0.00 C ATOM 460 C VAL A 27 15.717 -5.079 -12.904 1.00 0.00 C ATOM 461 O VAL A 27 16.516 -4.163 -13.095 1.00 0.00 O ATOM 462 CB VAL A 27 16.720 -6.662 -11.256 1.00 0.00 C ATOM 463 CG1 VAL A 27 16.743 -8.127 -10.848 1.00 0.00 C ATOM 464 CG2 VAL A 27 18.102 -6.040 -11.117 1.00 0.00 C ATOM 0 H VAL A 27 18.052 -6.256 -13.654 1.00 0.00 H new ATOM 0 HA VAL A 27 15.372 -7.199 -12.853 1.00 0.00 H new ATOM 0 HB VAL A 27 16.040 -6.134 -10.588 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.111 -8.214 -9.826 1.00 0.00 H new ATOM 0 HG12 VAL A 27 15.735 -8.537 -10.907 1.00 0.00 H new ATOM 0 HG13 VAL A 27 17.400 -8.681 -11.519 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.452 -6.157 -10.091 1.00 0.00 H new ATOM 0 HG22 VAL A 27 18.795 -6.538 -11.796 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.050 -4.980 -11.364 1.00 0.00 H new ATOM 474 N SER A 28 14.401 -4.896 -12.864 1.00 0.00 N ATOM 475 CA SER A 28 13.808 -3.577 -13.049 1.00 0.00 C ATOM 476 C SER A 28 13.132 -3.100 -11.767 1.00 0.00 C ATOM 477 O SER A 28 12.411 -3.854 -11.115 1.00 0.00 O ATOM 478 CB SER A 28 12.793 -3.607 -14.194 1.00 0.00 C ATOM 479 OG SER A 28 12.256 -4.907 -14.365 1.00 0.00 O ATOM 0 H SER A 28 13.726 -5.644 -12.705 1.00 0.00 H new ATOM 0 HA SER A 28 14.607 -2.879 -13.299 1.00 0.00 H new ATOM 0 HB2 SER A 28 11.988 -2.902 -13.989 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.273 -3.284 -15.118 1.00 0.00 H new ATOM 0 HG SER A 28 11.609 -4.899 -15.101 1.00 0.00 H new ATOM 485 N GLY A 29 13.371 -1.841 -11.412 1.00 0.00 N ATOM 486 CA GLY A 29 12.778 -1.284 -10.210 1.00 0.00 C ATOM 487 C GLY A 29 13.760 -0.448 -9.414 1.00 0.00 C ATOM 488 O GLY A 29 13.450 0.677 -9.018 1.00 0.00 O ATOM 0 H GLY A 29 13.964 -1.197 -11.935 1.00 0.00 H new ATOM 0 HA2 GLY A 29 11.920 -0.670 -10.483 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.404 -2.094 -9.584 1.00 0.00 H new ATOM 492 N LEU A 30 14.947 -0.996 -9.177 1.00 0.00 N ATOM 493 CA LEU A 30 15.977 -0.293 -8.421 1.00 0.00 C ATOM 494 C LEU A 30 16.217 1.101 -8.993 1.00 0.00 C ATOM 495 O LEU A 30 15.722 1.434 -10.070 1.00 0.00 O ATOM 496 CB LEU A 30 17.281 -1.093 -8.433 1.00 0.00 C ATOM 497 CG LEU A 30 17.159 -2.581 -8.103 1.00 0.00 C ATOM 498 CD1 LEU A 30 17.939 -3.416 -9.106 1.00 0.00 C ATOM 499 CD2 LEU A 30 17.644 -2.854 -6.687 1.00 0.00 C ATOM 0 H LEU A 30 15.220 -1.925 -9.498 1.00 0.00 H new ATOM 0 HA LEU A 30 15.631 -0.189 -7.393 1.00 0.00 H new ATOM 0 HB2 LEU A 30 17.734 -0.996 -9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 30 17.969 -0.639 -7.720 1.00 0.00 H new ATOM 0 HG LEU A 30 16.108 -2.863 -8.167 1.00 0.00 H new ATOM 0 HD11 LEU A 30 17.840 -4.472 -8.855 1.00 0.00 H new ATOM 0 HD12 LEU A 30 17.546 -3.243 -10.108 1.00 0.00 H new ATOM 0 HD13 LEU A 30 18.991 -3.132 -9.075 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.550 -3.918 -6.469 1.00 0.00 H new ATOM 0 HD22 LEU A 30 18.689 -2.556 -6.596 1.00 0.00 H new ATOM 0 HD23 LEU A 30 17.041 -2.284 -5.980 1.00 0.00 H new ATOM 511 N ASP A 31 16.980 1.909 -8.266 1.00 0.00 N ATOM 512 CA ASP A 31 17.289 3.266 -8.703 1.00 0.00 C ATOM 513 C ASP A 31 18.788 3.438 -8.924 1.00 0.00 C ATOM 514 O ASP A 31 19.584 2.584 -8.536 1.00 0.00 O ATOM 515 CB ASP A 31 16.793 4.281 -7.672 1.00 0.00 C ATOM 516 CG ASP A 31 15.360 4.709 -7.923 1.00 0.00 C ATOM 517 OD1 ASP A 31 14.441 3.943 -7.566 1.00 0.00 O ATOM 518 OD2 ASP A 31 15.158 5.810 -8.478 1.00 0.00 O ATOM 0 H ASP A 31 17.396 1.649 -7.372 1.00 0.00 H new ATOM 0 HA ASP A 31 16.778 3.442 -9.650 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.870 3.849 -6.674 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.440 5.158 -7.690 1.00 0.00 H new ATOM 523 N GLU A 32 19.165 4.548 -9.550 1.00 0.00 N ATOM 524 CA GLU A 32 20.570 4.830 -9.824 1.00 0.00 C ATOM 525 C GLU A 32 21.359 4.974 -8.526 1.00 0.00 C ATOM 526 O GLU A 32 22.480 4.479 -8.412 1.00 0.00 O ATOM 527 CB GLU A 32 20.703 6.106 -10.659 1.00 0.00 C ATOM 528 CG GLU A 32 19.974 6.040 -11.991 1.00 0.00 C ATOM 529 CD GLU A 32 19.393 7.379 -12.404 1.00 0.00 C ATOM 530 OE1 GLU A 32 18.664 7.986 -11.592 1.00 0.00 O ATOM 531 OE2 GLU A 32 19.668 7.819 -13.540 1.00 0.00 O ATOM 0 H GLU A 32 18.519 5.266 -9.877 1.00 0.00 H new ATOM 0 HA GLU A 32 20.980 3.991 -10.387 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.317 6.948 -10.084 1.00 0.00 H new ATOM 0 HB3 GLU A 32 21.760 6.302 -10.842 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.663 5.694 -12.761 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.172 5.304 -11.926 1.00 0.00 H new ATOM 538 N GLU A 33 20.765 5.656 -7.552 1.00 0.00 N ATOM 539 CA GLU A 33 21.414 5.867 -6.263 1.00 0.00 C ATOM 540 C GLU A 33 21.361 4.600 -5.414 1.00 0.00 C ATOM 541 O GLU A 33 22.357 4.202 -4.809 1.00 0.00 O ATOM 542 CB GLU A 33 20.747 7.023 -5.515 1.00 0.00 C ATOM 543 CG GLU A 33 21.372 7.312 -4.160 1.00 0.00 C ATOM 544 CD GLU A 33 21.114 8.730 -3.689 1.00 0.00 C ATOM 545 OE1 GLU A 33 21.631 9.671 -4.325 1.00 0.00 O ATOM 546 OE2 GLU A 33 20.393 8.898 -2.683 1.00 0.00 O ATOM 0 H GLU A 33 19.837 6.071 -7.631 1.00 0.00 H new ATOM 0 HA GLU A 33 22.459 6.117 -6.447 1.00 0.00 H new ATOM 0 HB2 GLU A 33 20.801 7.922 -6.130 1.00 0.00 H new ATOM 0 HB3 GLU A 33 19.690 6.794 -5.377 1.00 0.00 H new ATOM 0 HG2 GLU A 33 20.976 6.611 -3.425 1.00 0.00 H new ATOM 0 HG3 GLU A 33 22.447 7.142 -4.216 1.00 0.00 H new ATOM 553 N LEU A 34 20.192 3.970 -5.374 1.00 0.00 N ATOM 554 CA LEU A 34 20.007 2.748 -4.599 1.00 0.00 C ATOM 555 C LEU A 34 21.011 1.679 -5.020 1.00 0.00 C ATOM 556 O LEU A 34 21.563 0.965 -4.182 1.00 0.00 O ATOM 557 CB LEU A 34 18.582 2.221 -4.773 1.00 0.00 C ATOM 558 CG LEU A 34 17.622 2.487 -3.613 1.00 0.00 C ATOM 559 CD1 LEU A 34 16.182 2.261 -4.049 1.00 0.00 C ATOM 560 CD2 LEU A 34 17.965 1.604 -2.422 1.00 0.00 C ATOM 0 H LEU A 34 19.358 4.285 -5.869 1.00 0.00 H new ATOM 0 HA LEU A 34 20.175 2.985 -3.548 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.160 2.663 -5.676 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.632 1.145 -4.938 1.00 0.00 H new ATOM 0 HG LEU A 34 17.730 3.529 -3.310 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.513 2.455 -3.210 1.00 0.00 H new ATOM 0 HD12 LEU A 34 15.940 2.936 -4.870 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.060 1.230 -4.380 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.271 1.808 -1.606 1.00 0.00 H new ATOM 0 HD22 LEU A 34 17.887 0.556 -2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 34 18.983 1.815 -2.094 1.00 0.00 H new ATOM 572 N THR A 35 21.246 1.576 -6.325 1.00 0.00 N ATOM 573 CA THR A 35 22.184 0.596 -6.857 1.00 0.00 C ATOM 574 C THR A 35 23.540 0.702 -6.168 1.00 0.00 C ATOM 575 O THR A 35 24.175 -0.309 -5.870 1.00 0.00 O ATOM 576 CB THR A 35 22.377 0.771 -8.375 1.00 0.00 C ATOM 577 OG1 THR A 35 21.133 0.568 -9.054 1.00 0.00 O ATOM 578 CG2 THR A 35 23.415 -0.208 -8.905 1.00 0.00 C ATOM 0 H THR A 35 20.799 2.160 -7.032 1.00 0.00 H new ATOM 0 HA THR A 35 21.757 -0.388 -6.663 1.00 0.00 H new ATOM 0 HB THR A 35 22.730 1.786 -8.559 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.446 1.143 -8.657 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.534 -0.066 -9.979 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.369 -0.032 -8.407 1.00 0.00 H new ATOM 0 HG23 THR A 35 23.086 -1.229 -8.709 1.00 0.00 H new ATOM 586 N GLU A 36 23.977 1.932 -5.918 1.00 0.00 N ATOM 587 CA GLU A 36 25.258 2.169 -5.264 1.00 0.00 C ATOM 588 C GLU A 36 25.288 1.529 -3.879 1.00 0.00 C ATOM 589 O GLU A 36 26.352 1.184 -3.364 1.00 0.00 O ATOM 590 CB GLU A 36 25.529 3.670 -5.151 1.00 0.00 C ATOM 591 CG GLU A 36 25.769 4.348 -6.489 1.00 0.00 C ATOM 592 CD GLU A 36 26.911 5.345 -6.442 1.00 0.00 C ATOM 593 OE1 GLU A 36 26.655 6.524 -6.116 1.00 0.00 O ATOM 594 OE2 GLU A 36 28.059 4.948 -6.729 1.00 0.00 O ATOM 0 H GLU A 36 23.463 2.779 -6.158 1.00 0.00 H new ATOM 0 HA GLU A 36 26.038 1.712 -5.873 1.00 0.00 H new ATOM 0 HB2 GLU A 36 24.682 4.147 -4.658 1.00 0.00 H new ATOM 0 HB3 GLU A 36 26.399 3.826 -4.513 1.00 0.00 H new ATOM 0 HG2 GLU A 36 25.984 3.590 -7.242 1.00 0.00 H new ATOM 0 HG3 GLU A 36 24.858 4.859 -6.802 1.00 0.00 H new ATOM 601 N LYS A 37 24.112 1.375 -3.280 1.00 0.00 N ATOM 602 CA LYS A 37 24.001 0.777 -1.954 1.00 0.00 C ATOM 603 C LYS A 37 24.262 -0.725 -2.011 1.00 0.00 C ATOM 604 O LYS A 37 25.116 -1.244 -1.291 1.00 0.00 O ATOM 605 CB LYS A 37 22.612 1.042 -1.368 1.00 0.00 C ATOM 606 CG LYS A 37 22.221 2.510 -1.370 1.00 0.00 C ATOM 607 CD LYS A 37 22.899 3.269 -0.242 1.00 0.00 C ATOM 608 CE LYS A 37 22.444 4.719 -0.194 1.00 0.00 C ATOM 609 NZ LYS A 37 21.047 4.847 0.306 1.00 0.00 N ATOM 0 H LYS A 37 23.222 1.656 -3.692 1.00 0.00 H new ATOM 0 HA LYS A 37 24.754 1.235 -1.312 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.873 0.477 -1.936 1.00 0.00 H new ATOM 0 HB3 LYS A 37 22.581 0.668 -0.345 1.00 0.00 H new ATOM 0 HG2 LYS A 37 22.492 2.958 -2.326 1.00 0.00 H new ATOM 0 HG3 LYS A 37 21.139 2.599 -1.271 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.676 2.785 0.709 1.00 0.00 H new ATOM 0 HD3 LYS A 37 23.980 3.230 -0.374 1.00 0.00 H new ATOM 0 HE2 LYS A 37 23.114 5.288 0.450 1.00 0.00 H new ATOM 0 HE3 LYS A 37 22.514 5.155 -1.191 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 20.810 5.853 0.420 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 20.393 4.412 -0.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 20.961 4.365 1.224 1.00 0.00 H new ATOM 623 N LEU A 38 23.524 -1.417 -2.872 1.00 0.00 N ATOM 624 CA LEU A 38 23.677 -2.859 -3.024 1.00 0.00 C ATOM 625 C LEU A 38 25.054 -3.205 -3.584 1.00 0.00 C ATOM 626 O LEU A 38 25.751 -4.070 -3.052 1.00 0.00 O ATOM 627 CB LEU A 38 22.587 -3.414 -3.943 1.00 0.00 C ATOM 628 CG LEU A 38 21.158 -2.965 -3.636 1.00 0.00 C ATOM 629 CD1 LEU A 38 20.991 -2.696 -2.148 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.802 -1.727 -4.446 1.00 0.00 C ATOM 0 H LEU A 38 22.814 -1.002 -3.475 1.00 0.00 H new ATOM 0 HA LEU A 38 23.580 -3.315 -2.039 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.824 -3.129 -4.968 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.622 -4.503 -3.899 1.00 0.00 H new ATOM 0 HG LEU A 38 20.477 -3.768 -3.918 1.00 0.00 H new ATOM 0 HD11 LEU A 38 19.968 -2.378 -1.948 1.00 0.00 H new ATOM 0 HD12 LEU A 38 21.204 -3.606 -1.588 1.00 0.00 H new ATOM 0 HD13 LEU A 38 21.682 -1.911 -1.840 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.781 -1.422 -4.215 1.00 0.00 H new ATOM 0 HD22 LEU A 38 21.488 -0.918 -4.195 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.881 -1.953 -5.509 1.00 0.00 H new ATOM 642 N ILE A 39 25.439 -2.522 -4.657 1.00 0.00 N ATOM 643 CA ILE A 39 26.733 -2.755 -5.285 1.00 0.00 C ATOM 644 C ILE A 39 27.868 -2.613 -4.277 1.00 0.00 C ATOM 645 O ILE A 39 28.923 -3.228 -4.424 1.00 0.00 O ATOM 646 CB ILE A 39 26.975 -1.781 -6.454 1.00 0.00 C ATOM 647 CG1 ILE A 39 28.046 -2.335 -7.395 1.00 0.00 C ATOM 648 CG2 ILE A 39 27.380 -0.412 -5.927 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.446 -1.370 -8.490 1.00 0.00 C ATOM 0 H ILE A 39 24.873 -1.803 -5.109 1.00 0.00 H new ATOM 0 HA ILE A 39 26.718 -3.775 -5.669 1.00 0.00 H new ATOM 0 HB ILE A 39 26.047 -1.672 -7.016 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.929 -2.598 -6.813 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.678 -3.255 -7.849 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.548 0.265 -6.764 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.586 -0.016 -5.294 1.00 0.00 H new ATOM 0 HG23 ILE A 39 28.297 -0.503 -5.345 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.209 -1.829 -9.119 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.574 -1.126 -9.097 1.00 0.00 H new ATOM 0 HD13 ILE A 39 28.844 -0.458 -8.044 1.00 0.00 H new ATOM 661 N GLU A 40 27.641 -1.798 -3.251 1.00 0.00 N ATOM 662 CA GLU A 40 28.645 -1.576 -2.216 1.00 0.00 C ATOM 663 C GLU A 40 28.678 -2.741 -1.231 1.00 0.00 C ATOM 664 O GLU A 40 29.701 -3.004 -0.598 1.00 0.00 O ATOM 665 CB GLU A 40 28.362 -0.271 -1.471 1.00 0.00 C ATOM 666 CG GLU A 40 29.213 0.896 -1.941 1.00 0.00 C ATOM 667 CD GLU A 40 30.677 0.735 -1.578 1.00 0.00 C ATOM 668 OE1 GLU A 40 30.969 0.477 -0.392 1.00 0.00 O ATOM 669 OE2 GLU A 40 31.529 0.866 -2.481 1.00 0.00 O ATOM 0 H GLU A 40 26.772 -1.281 -3.114 1.00 0.00 H new ATOM 0 HA GLU A 40 29.619 -1.505 -2.700 1.00 0.00 H new ATOM 0 HB2 GLU A 40 27.310 -0.014 -1.592 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.531 -0.427 -0.406 1.00 0.00 H new ATOM 0 HG2 GLU A 40 29.120 0.996 -3.022 1.00 0.00 H new ATOM 0 HG3 GLU A 40 28.833 1.818 -1.501 1.00 0.00 H new ATOM 676 N ARG A 41 27.550 -3.434 -1.105 1.00 0.00 N ATOM 677 CA ARG A 41 27.449 -4.569 -0.196 1.00 0.00 C ATOM 678 C ARG A 41 27.687 -5.882 -0.936 1.00 0.00 C ATOM 679 O ARG A 41 27.956 -6.914 -0.320 1.00 0.00 O ATOM 680 CB ARG A 41 26.073 -4.591 0.473 1.00 0.00 C ATOM 681 CG ARG A 41 25.768 -3.339 1.279 1.00 0.00 C ATOM 682 CD ARG A 41 24.328 -3.328 1.767 1.00 0.00 C ATOM 683 NE ARG A 41 24.120 -2.357 2.838 1.00 0.00 N ATOM 684 CZ ARG A 41 24.478 -2.567 4.100 1.00 0.00 C ATOM 685 NH1 ARG A 41 25.060 -3.707 4.447 1.00 0.00 N ATOM 686 NH2 ARG A 41 24.256 -1.635 5.018 1.00 0.00 N ATOM 0 H ARG A 41 26.694 -3.229 -1.621 1.00 0.00 H new ATOM 0 HA ARG A 41 28.217 -4.459 0.569 1.00 0.00 H new ATOM 0 HB2 ARG A 41 25.308 -4.715 -0.293 1.00 0.00 H new ATOM 0 HB3 ARG A 41 26.011 -5.459 1.129 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.443 -3.281 2.133 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.952 -2.457 0.666 1.00 0.00 H new ATOM 0 HD2 ARG A 41 23.665 -3.096 0.934 1.00 0.00 H new ATOM 0 HD3 ARG A 41 24.058 -4.323 2.122 1.00 0.00 H new ATOM 0 HE ARG A 41 23.676 -1.469 2.604 1.00 0.00 H new ATOM 0 HH11 ARG A 41 25.234 -4.425 3.744 1.00 0.00 H new ATOM 0 HH12 ARG A 41 25.334 -3.865 5.417 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.810 -0.756 4.755 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.531 -1.797 5.987 1.00 0.00 H new ATOM 700 N LEU A 42 27.587 -5.835 -2.260 1.00 0.00 N ATOM 701 CA LEU A 42 27.791 -7.021 -3.085 1.00 0.00 C ATOM 702 C LEU A 42 29.131 -6.955 -3.810 1.00 0.00 C ATOM 703 O LEU A 42 29.674 -7.979 -4.227 1.00 0.00 O ATOM 704 CB LEU A 42 26.655 -7.162 -4.100 1.00 0.00 C ATOM 705 CG LEU A 42 25.287 -7.534 -3.529 1.00 0.00 C ATOM 706 CD1 LEU A 42 24.262 -7.672 -4.644 1.00 0.00 C ATOM 707 CD2 LEU A 42 25.378 -8.822 -2.723 1.00 0.00 C ATOM 0 H LEU A 42 27.366 -4.989 -2.785 1.00 0.00 H new ATOM 0 HA LEU A 42 27.795 -7.893 -2.431 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.557 -6.220 -4.639 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.939 -7.919 -4.831 1.00 0.00 H new ATOM 0 HG LEU A 42 24.963 -6.734 -2.863 1.00 0.00 H new ATOM 0 HD11 LEU A 42 23.294 -7.937 -4.218 1.00 0.00 H new ATOM 0 HD12 LEU A 42 24.176 -6.726 -5.178 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.580 -8.452 -5.336 1.00 0.00 H new ATOM 0 HD21 LEU A 42 24.395 -9.072 -2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 42 25.724 -9.630 -3.367 1.00 0.00 H new ATOM 0 HD23 LEU A 42 26.080 -8.687 -1.900 1.00 0.00 H new ATOM 719 N ASP A 43 29.660 -5.745 -3.956 1.00 0.00 N ATOM 720 CA ASP A 43 30.939 -5.546 -4.628 1.00 0.00 C ATOM 721 C ASP A 43 30.917 -6.150 -6.028 1.00 0.00 C ATOM 722 O ASP A 43 31.955 -6.539 -6.563 1.00 0.00 O ATOM 723 CB ASP A 43 32.072 -6.167 -3.809 1.00 0.00 C ATOM 724 CG ASP A 43 33.403 -5.484 -4.051 1.00 0.00 C ATOM 725 OD1 ASP A 43 33.400 -4.283 -4.395 1.00 0.00 O ATOM 726 OD2 ASP A 43 34.449 -6.150 -3.898 1.00 0.00 O ATOM 0 H ASP A 43 29.223 -4.887 -3.618 1.00 0.00 H new ATOM 0 HA ASP A 43 31.111 -4.473 -4.717 1.00 0.00 H new ATOM 0 HB2 ASP A 43 31.824 -6.109 -2.749 1.00 0.00 H new ATOM 0 HB3 ASP A 43 32.159 -7.225 -4.058 1.00 0.00 H new ATOM 731 N GLU A 44 29.727 -6.226 -6.616 1.00 0.00 N ATOM 732 CA GLU A 44 29.571 -6.785 -7.954 1.00 0.00 C ATOM 733 C GLU A 44 29.533 -5.679 -9.004 1.00 0.00 C ATOM 734 O GLU A 44 29.660 -4.498 -8.682 1.00 0.00 O ATOM 735 CB GLU A 44 28.293 -7.624 -8.034 1.00 0.00 C ATOM 736 CG GLU A 44 27.022 -6.817 -7.829 1.00 0.00 C ATOM 737 CD GLU A 44 25.860 -7.670 -7.357 1.00 0.00 C ATOM 738 OE1 GLU A 44 26.107 -8.795 -6.874 1.00 0.00 O ATOM 739 OE2 GLU A 44 24.704 -7.210 -7.469 1.00 0.00 O ATOM 0 H GLU A 44 28.858 -5.908 -6.187 1.00 0.00 H new ATOM 0 HA GLU A 44 30.430 -7.425 -8.156 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.250 -8.113 -9.007 1.00 0.00 H new ATOM 0 HB3 GLU A 44 28.338 -8.412 -7.283 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.210 -6.029 -7.099 1.00 0.00 H new ATOM 0 HG3 GLU A 44 26.752 -6.327 -8.765 1.00 0.00 H new ATOM 746 N ASP A 45 29.359 -6.071 -10.261 1.00 0.00 N ATOM 747 CA ASP A 45 29.304 -5.114 -11.360 1.00 0.00 C ATOM 748 C ASP A 45 27.859 -4.774 -11.713 1.00 0.00 C ATOM 749 O ASP A 45 27.125 -5.608 -12.244 1.00 0.00 O ATOM 750 CB ASP A 45 30.023 -5.674 -12.589 1.00 0.00 C ATOM 751 CG ASP A 45 31.127 -4.758 -13.080 1.00 0.00 C ATOM 752 OD1 ASP A 45 32.070 -4.498 -12.305 1.00 0.00 O ATOM 753 OD2 ASP A 45 31.047 -4.301 -14.240 1.00 0.00 O ATOM 0 H ASP A 45 29.254 -7.045 -10.545 1.00 0.00 H new ATOM 0 HA ASP A 45 29.806 -4.201 -11.039 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.445 -6.649 -12.347 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.300 -5.829 -13.390 1.00 0.00 H new ATOM 758 N THR A 46 27.456 -3.543 -11.413 1.00 0.00 N ATOM 759 CA THR A 46 26.099 -3.093 -11.696 1.00 0.00 C ATOM 760 C THR A 46 26.100 -1.930 -12.681 1.00 0.00 C ATOM 761 O THR A 46 26.966 -1.058 -12.625 1.00 0.00 O ATOM 762 CB THR A 46 25.371 -2.660 -10.409 1.00 0.00 C ATOM 763 OG1 THR A 46 25.940 -1.445 -9.909 1.00 0.00 O ATOM 764 CG2 THR A 46 25.462 -3.744 -9.345 1.00 0.00 C ATOM 0 H THR A 46 28.050 -2.840 -10.974 1.00 0.00 H new ATOM 0 HA THR A 46 25.571 -3.939 -12.137 1.00 0.00 H new ATOM 0 HB THR A 46 24.321 -2.496 -10.650 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.572 -0.683 -10.404 1.00 0.00 H new ATOM 0 HG21 THR A 46 24.941 -3.416 -8.446 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.002 -4.659 -9.718 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.509 -3.935 -9.109 1.00 0.00 H new ATOM 772 N GLU A 47 25.122 -1.924 -13.583 1.00 0.00 N ATOM 773 CA GLU A 47 25.012 -0.867 -14.581 1.00 0.00 C ATOM 774 C GLU A 47 23.569 -0.714 -15.054 1.00 0.00 C ATOM 775 O GLU A 47 22.848 -1.700 -15.208 1.00 0.00 O ATOM 776 CB GLU A 47 25.923 -1.164 -15.774 1.00 0.00 C ATOM 777 CG GLU A 47 27.317 -0.577 -15.636 1.00 0.00 C ATOM 778 CD GLU A 47 27.953 -0.261 -16.976 1.00 0.00 C ATOM 779 OE1 GLU A 47 28.490 -1.193 -17.611 1.00 0.00 O ATOM 780 OE2 GLU A 47 27.914 0.916 -17.389 1.00 0.00 O ATOM 0 H GLU A 47 24.396 -2.638 -13.642 1.00 0.00 H new ATOM 0 HA GLU A 47 25.326 0.069 -14.118 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.003 -2.244 -15.899 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.461 -0.772 -16.680 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.266 0.333 -15.039 1.00 0.00 H new ATOM 0 HG3 GLU A 47 27.951 -1.279 -15.094 1.00 0.00 H new ATOM 787 N ARG A 48 23.156 0.528 -15.283 1.00 0.00 N ATOM 788 CA ARG A 48 21.799 0.811 -15.736 1.00 0.00 C ATOM 789 C ARG A 48 21.689 0.656 -17.250 1.00 0.00 C ATOM 790 O ARG A 48 22.484 1.221 -18.002 1.00 0.00 O ATOM 791 CB ARG A 48 21.386 2.225 -15.327 1.00 0.00 C ATOM 792 CG ARG A 48 21.440 2.465 -13.827 1.00 0.00 C ATOM 793 CD ARG A 48 22.199 3.740 -13.493 1.00 0.00 C ATOM 794 NE ARG A 48 23.615 3.639 -13.834 1.00 0.00 N ATOM 795 CZ ARG A 48 24.407 4.692 -14.006 1.00 0.00 C ATOM 796 NH1 ARG A 48 23.923 5.918 -13.868 1.00 0.00 N ATOM 797 NH2 ARG A 48 25.685 4.518 -14.315 1.00 0.00 N ATOM 0 H ARG A 48 23.741 1.355 -15.162 1.00 0.00 H new ATOM 0 HA ARG A 48 21.128 0.093 -15.264 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.037 2.943 -15.825 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.373 2.415 -15.681 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.426 2.530 -13.431 1.00 0.00 H new ATOM 0 HG3 ARG A 48 21.919 1.617 -13.339 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.755 4.578 -14.031 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.097 3.955 -12.429 1.00 0.00 H new ATOM 0 HE ARG A 48 24.019 2.709 -13.946 1.00 0.00 H new ATOM 0 HH11 ARG A 48 22.941 6.055 -13.629 1.00 0.00 H new ATOM 0 HH12 ARG A 48 24.533 6.725 -14.000 1.00 0.00 H new ATOM 0 HH21 ARG A 48 26.060 3.575 -14.421 1.00 0.00 H new ATOM 0 HH22 ARG A 48 26.292 5.327 -14.447 1.00 0.00 H new ATOM 811 N ASP A 49 20.700 -0.114 -17.691 1.00 0.00 N ATOM 812 CA ASP A 49 20.485 -0.343 -19.115 1.00 0.00 C ATOM 813 C ASP A 49 18.997 -0.454 -19.429 1.00 0.00 C ATOM 814 O ASP A 49 18.354 -1.450 -19.096 1.00 0.00 O ATOM 815 CB ASP A 49 21.210 -1.613 -19.563 1.00 0.00 C ATOM 816 CG ASP A 49 21.622 -1.560 -21.021 1.00 0.00 C ATOM 817 OD1 ASP A 49 20.782 -1.178 -21.863 1.00 0.00 O ATOM 818 OD2 ASP A 49 22.786 -1.900 -21.321 1.00 0.00 O ATOM 0 H ASP A 49 20.034 -0.590 -17.082 1.00 0.00 H new ATOM 0 HA ASP A 49 20.890 0.509 -19.661 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.095 -1.761 -18.944 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.561 -2.474 -19.403 1.00 0.00 H new ATOM 823 N ASP A 50 18.455 0.575 -20.071 1.00 0.00 N ATOM 824 CA ASP A 50 17.041 0.594 -20.430 1.00 0.00 C ATOM 825 C ASP A 50 16.163 0.529 -19.184 1.00 0.00 C ATOM 826 O ASP A 50 15.019 0.082 -19.242 1.00 0.00 O ATOM 827 CB ASP A 50 16.714 -0.575 -21.361 1.00 0.00 C ATOM 828 CG ASP A 50 17.719 -0.716 -22.488 1.00 0.00 C ATOM 829 OD1 ASP A 50 18.170 0.323 -23.013 1.00 0.00 O ATOM 830 OD2 ASP A 50 18.053 -1.865 -22.844 1.00 0.00 O ATOM 0 H ASP A 50 18.973 1.407 -20.354 1.00 0.00 H new ATOM 0 HA ASP A 50 16.835 1.530 -20.949 1.00 0.00 H new ATOM 0 HB2 ASP A 50 16.688 -1.499 -20.784 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.718 -0.433 -21.781 1.00 0.00 H new ATOM 835 N GLY A 51 16.708 0.978 -18.058 1.00 0.00 N ATOM 836 CA GLY A 51 15.961 0.962 -16.814 1.00 0.00 C ATOM 837 C GLY A 51 16.262 -0.263 -15.973 1.00 0.00 C ATOM 838 O GLY A 51 16.048 -0.260 -14.760 1.00 0.00 O ATOM 0 H GLY A 51 17.654 1.353 -17.985 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.196 1.859 -16.241 1.00 0.00 H new ATOM 0 HA3 GLY A 51 14.894 0.995 -17.034 1.00 0.00 H new ATOM 842 N ASP A 52 16.759 -1.313 -16.617 1.00 0.00 N ATOM 843 CA ASP A 52 17.090 -2.551 -15.921 1.00 0.00 C ATOM 844 C ASP A 52 18.506 -2.495 -15.355 1.00 0.00 C ATOM 845 O ASP A 52 19.273 -1.582 -15.664 1.00 0.00 O ATOM 846 CB ASP A 52 16.952 -3.746 -16.866 1.00 0.00 C ATOM 847 CG ASP A 52 15.790 -3.592 -17.827 1.00 0.00 C ATOM 848 OD1 ASP A 52 14.633 -3.767 -17.391 1.00 0.00 O ATOM 849 OD2 ASP A 52 16.037 -3.298 -19.016 1.00 0.00 O ATOM 0 H ASP A 52 16.942 -1.332 -17.620 1.00 0.00 H new ATOM 0 HA ASP A 52 16.391 -2.670 -15.093 1.00 0.00 H new ATOM 0 HB2 ASP A 52 17.875 -3.866 -17.433 1.00 0.00 H new ATOM 0 HB3 ASP A 52 16.817 -4.655 -16.280 1.00 0.00 H new ATOM 854 N LEU A 53 18.845 -3.475 -14.525 1.00 0.00 N ATOM 855 CA LEU A 53 20.168 -3.537 -13.915 1.00 0.00 C ATOM 856 C LEU A 53 20.844 -4.871 -14.214 1.00 0.00 C ATOM 857 O LEU A 53 20.232 -5.932 -14.080 1.00 0.00 O ATOM 858 CB LEU A 53 20.065 -3.332 -12.403 1.00 0.00 C ATOM 859 CG LEU A 53 21.325 -2.818 -11.707 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.426 -3.866 -11.753 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.795 -1.519 -12.346 1.00 0.00 C ATOM 0 H LEU A 53 18.222 -4.238 -14.259 1.00 0.00 H new ATOM 0 HA LEU A 53 20.775 -2.739 -14.343 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.254 -2.631 -12.206 1.00 0.00 H new ATOM 0 HB3 LEU A 53 19.784 -4.281 -11.946 1.00 0.00 H new ATOM 0 HG LEU A 53 21.085 -2.620 -10.663 1.00 0.00 H new ATOM 0 HD11 LEU A 53 23.315 -3.482 -11.253 1.00 0.00 H new ATOM 0 HD12 LEU A 53 22.088 -4.771 -11.248 1.00 0.00 H new ATOM 0 HD13 LEU A 53 22.665 -4.097 -12.791 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.693 -1.168 -11.838 1.00 0.00 H new ATOM 0 HD22 LEU A 53 22.018 -1.691 -13.399 1.00 0.00 H new ATOM 0 HD23 LEU A 53 21.011 -0.767 -12.259 1.00 0.00 H new ATOM 873 N ILE A 54 22.108 -4.811 -14.617 1.00 0.00 N ATOM 874 CA ILE A 54 22.868 -6.015 -14.932 1.00 0.00 C ATOM 875 C ILE A 54 23.742 -6.436 -13.756 1.00 0.00 C ATOM 876 O ILE A 54 24.490 -5.628 -13.205 1.00 0.00 O ATOM 877 CB ILE A 54 23.757 -5.812 -16.172 1.00 0.00 C ATOM 878 CG1 ILE A 54 22.978 -5.091 -17.274 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.280 -7.150 -16.674 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.709 -5.806 -17.683 1.00 0.00 C ATOM 0 H ILE A 54 22.628 -3.941 -14.733 1.00 0.00 H new ATOM 0 HA ILE A 54 22.142 -6.801 -15.142 1.00 0.00 H new ATOM 0 HB ILE A 54 24.609 -5.193 -15.892 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.726 -4.087 -16.932 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.620 -4.979 -18.148 1.00 0.00 H new ATOM 0 HG21 ILE A 54 24.907 -6.990 -17.551 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.868 -7.628 -15.890 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.440 -7.792 -16.941 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.208 -5.239 -18.468 1.00 0.00 H new ATOM 0 HD12 ILE A 54 21.955 -6.800 -18.055 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.048 -5.895 -16.821 1.00 0.00 H new ATOM 892 N ILE A 55 23.645 -7.707 -13.378 1.00 0.00 N ATOM 893 CA ILE A 55 24.430 -8.236 -12.270 1.00 0.00 C ATOM 894 C ILE A 55 25.160 -9.512 -12.673 1.00 0.00 C ATOM 895 O ILE A 55 24.537 -10.502 -13.058 1.00 0.00 O ATOM 896 CB ILE A 55 23.546 -8.529 -11.043 1.00 0.00 C ATOM 897 CG1 ILE A 55 22.635 -7.335 -10.747 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.409 -8.856 -9.834 1.00 0.00 C ATOM 899 CD1 ILE A 55 21.668 -7.581 -9.610 1.00 0.00 C ATOM 0 H ILE A 55 23.031 -8.389 -13.823 1.00 0.00 H new ATOM 0 HA ILE A 55 25.160 -7.471 -12.007 1.00 0.00 H new ATOM 0 HB ILE A 55 22.920 -9.394 -11.263 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.251 -6.468 -10.508 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.071 -7.087 -11.646 1.00 0.00 H new ATOM 0 HG21 ILE A 55 23.770 -9.061 -8.975 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.019 -9.733 -10.049 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.057 -8.009 -9.610 1.00 0.00 H new ATOM 0 HD11 ILE A 55 21.054 -6.693 -9.456 1.00 0.00 H new ATOM 0 HD12 ILE A 55 21.027 -8.428 -9.855 1.00 0.00 H new ATOM 0 HD13 ILE A 55 22.225 -7.799 -8.699 1.00 0.00 H new ATOM 911 N THR A 56 26.486 -9.484 -12.581 1.00 0.00 N ATOM 912 CA THR A 56 27.302 -10.638 -12.935 1.00 0.00 C ATOM 913 C THR A 56 28.041 -11.184 -11.718 1.00 0.00 C ATOM 914 O THR A 56 28.851 -10.487 -11.108 1.00 0.00 O ATOM 915 CB THR A 56 28.327 -10.287 -14.029 1.00 0.00 C ATOM 916 OG1 THR A 56 27.703 -9.503 -15.052 1.00 0.00 O ATOM 917 CG2 THR A 56 28.919 -11.548 -14.640 1.00 0.00 C ATOM 0 H THR A 56 27.018 -8.673 -12.264 1.00 0.00 H new ATOM 0 HA THR A 56 26.622 -11.400 -13.316 1.00 0.00 H new ATOM 0 HB THR A 56 29.132 -9.712 -13.571 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.365 -8.902 -15.453 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.640 -11.275 -15.410 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.419 -12.128 -13.864 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.123 -12.146 -15.084 1.00 0.00 H new ATOM 925 N VAL A 57 27.756 -12.435 -11.370 1.00 0.00 N ATOM 926 CA VAL A 57 28.396 -13.074 -10.227 1.00 0.00 C ATOM 927 C VAL A 57 28.959 -14.440 -10.605 1.00 0.00 C ATOM 928 O VAL A 57 28.213 -15.357 -10.951 1.00 0.00 O ATOM 929 CB VAL A 57 27.411 -13.244 -9.055 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.144 -11.905 -8.384 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.114 -13.875 -9.537 1.00 0.00 C ATOM 0 H VAL A 57 27.086 -13.025 -11.863 1.00 0.00 H new ATOM 0 HA VAL A 57 29.212 -12.421 -9.915 1.00 0.00 H new ATOM 0 HB VAL A 57 27.861 -13.910 -8.318 1.00 0.00 H new ATOM 0 HG11 VAL A 57 26.446 -12.044 -7.558 1.00 0.00 H new ATOM 0 HG12 VAL A 57 28.080 -11.496 -8.003 1.00 0.00 H new ATOM 0 HG13 VAL A 57 26.715 -11.214 -9.109 1.00 0.00 H new ATOM 0 HG21 VAL A 57 25.430 -13.988 -8.696 1.00 0.00 H new ATOM 0 HG22 VAL A 57 25.658 -13.236 -10.293 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.324 -14.854 -9.968 1.00 0.00 H new ATOM 941 N PHE A 58 30.279 -14.569 -10.536 1.00 0.00 N ATOM 942 CA PHE A 58 30.943 -15.823 -10.871 1.00 0.00 C ATOM 943 C PHE A 58 31.734 -16.356 -9.680 1.00 0.00 C ATOM 944 O PHE A 58 32.286 -15.586 -8.893 1.00 0.00 O ATOM 945 CB PHE A 58 31.875 -15.628 -12.069 1.00 0.00 C ATOM 946 CG PHE A 58 32.709 -14.381 -11.982 1.00 0.00 C ATOM 947 CD1 PHE A 58 33.743 -14.286 -11.065 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.458 -13.304 -12.818 1.00 0.00 C ATOM 949 CE1 PHE A 58 34.513 -13.141 -10.983 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.224 -12.157 -12.740 1.00 0.00 C ATOM 951 CZ PHE A 58 34.252 -12.075 -11.821 1.00 0.00 C ATOM 0 H PHE A 58 30.911 -13.820 -10.251 1.00 0.00 H new ATOM 0 HA PHE A 58 30.175 -16.552 -11.131 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.535 -16.492 -12.151 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.279 -15.594 -12.981 1.00 0.00 H new ATOM 0 HD1 PHE A 58 33.950 -15.116 -10.406 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.655 -13.362 -13.538 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.317 -13.080 -10.265 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.019 -11.325 -13.397 1.00 0.00 H new ATOM 0 HZ PHE A 58 34.851 -11.178 -11.758 1.00 0.00 H new ATOM 961 N TYR A 59 31.783 -17.677 -9.553 1.00 0.00 N ATOM 962 CA TYR A 59 32.503 -18.314 -8.456 1.00 0.00 C ATOM 963 C TYR A 59 33.291 -19.523 -8.951 1.00 0.00 C ATOM 964 O TYR A 59 32.796 -20.313 -9.754 1.00 0.00 O ATOM 965 CB TYR A 59 31.527 -18.741 -7.358 1.00 0.00 C ATOM 966 CG TYR A 59 30.461 -17.711 -7.061 1.00 0.00 C ATOM 967 CD1 TYR A 59 29.294 -17.654 -7.812 1.00 0.00 C ATOM 968 CD2 TYR A 59 30.621 -16.796 -6.028 1.00 0.00 C ATOM 969 CE1 TYR A 59 28.317 -16.714 -7.545 1.00 0.00 C ATOM 970 CE2 TYR A 59 29.649 -15.853 -5.753 1.00 0.00 C ATOM 971 CZ TYR A 59 28.499 -15.816 -6.514 1.00 0.00 C ATOM 972 OH TYR A 59 27.529 -14.879 -6.243 1.00 0.00 O ATOM 0 H TYR A 59 31.333 -18.328 -10.196 1.00 0.00 H new ATOM 0 HA TYR A 59 33.206 -17.589 -8.046 1.00 0.00 H new ATOM 0 HB2 TYR A 59 31.047 -19.674 -7.653 1.00 0.00 H new ATOM 0 HB3 TYR A 59 32.087 -18.946 -6.445 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.148 -18.357 -8.619 1.00 0.00 H new ATOM 0 HD2 TYR A 59 31.520 -16.822 -5.430 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.416 -16.683 -8.140 1.00 0.00 H new ATOM 0 HE2 TYR A 59 29.789 -15.149 -4.946 1.00 0.00 H new ATOM 0 HH TYR A 59 27.812 -14.325 -5.486 1.00 0.00 H new ATOM 982 N GLU A 60 34.520 -19.660 -8.464 1.00 0.00 N ATOM 983 CA GLU A 60 35.377 -20.772 -8.856 1.00 0.00 C ATOM 984 C GLU A 60 35.239 -21.936 -7.879 1.00 0.00 C ATOM 985 O GLU A 60 34.422 -21.895 -6.959 1.00 0.00 O ATOM 986 CB GLU A 60 36.838 -20.321 -8.925 1.00 0.00 C ATOM 987 CG GLU A 60 37.541 -20.328 -7.578 1.00 0.00 C ATOM 988 CD GLU A 60 38.535 -19.192 -7.433 1.00 0.00 C ATOM 989 OE1 GLU A 60 38.130 -18.023 -7.600 1.00 0.00 O ATOM 990 OE2 GLU A 60 39.719 -19.474 -7.151 1.00 0.00 O ATOM 0 H GLU A 60 34.944 -19.015 -7.798 1.00 0.00 H new ATOM 0 HA GLU A 60 35.061 -21.109 -9.843 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.379 -20.973 -9.611 1.00 0.00 H new ATOM 0 HB3 GLU A 60 36.880 -19.315 -9.342 1.00 0.00 H new ATOM 0 HG2 GLU A 60 36.797 -20.259 -6.784 1.00 0.00 H new ATOM 0 HG3 GLU A 60 38.059 -21.278 -7.448 1.00 0.00 H new ATOM 997 N ARG A 61 36.043 -22.974 -8.087 1.00 0.00 N ATOM 998 CA ARG A 61 36.010 -24.151 -7.227 1.00 0.00 C ATOM 999 C ARG A 61 35.945 -23.748 -5.757 1.00 0.00 C ATOM 1000 O ARG A 61 35.272 -24.394 -4.955 1.00 0.00 O ATOM 1001 CB ARG A 61 37.241 -25.024 -7.474 1.00 0.00 C ATOM 1002 CG ARG A 61 38.551 -24.254 -7.441 1.00 0.00 C ATOM 1003 CD ARG A 61 39.701 -25.087 -7.984 1.00 0.00 C ATOM 1004 NE ARG A 61 40.216 -26.023 -6.988 1.00 0.00 N ATOM 1005 CZ ARG A 61 40.996 -25.663 -5.975 1.00 0.00 C ATOM 1006 NH1 ARG A 61 41.348 -24.394 -5.823 1.00 0.00 N ATOM 1007 NH2 ARG A 61 41.425 -26.573 -5.109 1.00 0.00 N ATOM 0 H ARG A 61 36.725 -23.024 -8.844 1.00 0.00 H new ATOM 0 HA ARG A 61 35.114 -24.722 -7.469 1.00 0.00 H new ATOM 0 HB2 ARG A 61 37.274 -25.812 -6.722 1.00 0.00 H new ATOM 0 HB3 ARG A 61 37.141 -25.512 -8.443 1.00 0.00 H new ATOM 0 HG2 ARG A 61 38.453 -23.341 -8.028 1.00 0.00 H new ATOM 0 HG3 ARG A 61 38.771 -23.952 -6.417 1.00 0.00 H new ATOM 0 HD2 ARG A 61 39.366 -25.640 -8.862 1.00 0.00 H new ATOM 0 HD3 ARG A 61 40.504 -24.427 -8.311 1.00 0.00 H new ATOM 0 HE ARG A 61 39.963 -27.007 -7.075 1.00 0.00 H new ATOM 0 HH11 ARG A 61 41.020 -23.691 -6.485 1.00 0.00 H new ATOM 0 HH12 ARG A 61 41.947 -24.121 -5.044 1.00 0.00 H new ATOM 0 HH21 ARG A 61 41.156 -27.550 -5.221 1.00 0.00 H new ATOM 0 HH22 ARG A 61 42.024 -26.295 -4.332 1.00 0.00 H new ATOM 1021 N GLU A 62 36.650 -22.675 -5.411 1.00 0.00 N ATOM 1022 CA GLU A 62 36.674 -22.187 -4.037 1.00 0.00 C ATOM 1023 C GLU A 62 35.258 -22.039 -3.488 1.00 0.00 C ATOM 1024 O GLU A 62 34.999 -22.330 -2.320 1.00 0.00 O ATOM 1025 CB GLU A 62 37.405 -20.845 -3.961 1.00 0.00 C ATOM 1026 CG GLU A 62 38.918 -20.972 -4.018 1.00 0.00 C ATOM 1027 CD GLU A 62 39.515 -21.429 -2.702 1.00 0.00 C ATOM 1028 OE1 GLU A 62 39.478 -22.646 -2.423 1.00 0.00 O ATOM 1029 OE2 GLU A 62 40.021 -20.569 -1.950 1.00 0.00 O ATOM 0 H GLU A 62 37.212 -22.128 -6.063 1.00 0.00 H new ATOM 0 HA GLU A 62 37.207 -22.917 -3.428 1.00 0.00 H new ATOM 0 HB2 GLU A 62 37.071 -20.212 -4.783 1.00 0.00 H new ATOM 0 HB3 GLU A 62 37.126 -20.341 -3.036 1.00 0.00 H new ATOM 0 HG2 GLU A 62 39.190 -21.680 -4.801 1.00 0.00 H new ATOM 0 HG3 GLU A 62 39.349 -20.010 -4.294 1.00 0.00 H new ATOM 1036 N TYR A 63 34.344 -21.585 -4.339 1.00 0.00 N ATOM 1037 CA TYR A 63 32.955 -21.395 -3.939 1.00 0.00 C ATOM 1038 C TYR A 63 32.026 -22.289 -4.755 1.00 0.00 C ATOM 1039 O TYR A 63 30.808 -22.113 -4.745 1.00 0.00 O ATOM 1040 CB TYR A 63 32.549 -19.930 -4.110 1.00 0.00 C ATOM 1041 CG TYR A 63 32.615 -19.130 -2.828 1.00 0.00 C ATOM 1042 CD1 TYR A 63 31.541 -19.103 -1.947 1.00 0.00 C ATOM 1043 CD2 TYR A 63 33.752 -18.403 -2.498 1.00 0.00 C ATOM 1044 CE1 TYR A 63 31.597 -18.374 -0.775 1.00 0.00 C ATOM 1045 CE2 TYR A 63 33.817 -17.671 -1.328 1.00 0.00 C ATOM 1046 CZ TYR A 63 32.737 -17.660 -0.470 1.00 0.00 C ATOM 1047 OH TYR A 63 32.797 -16.933 0.697 1.00 0.00 O ATOM 0 H TYR A 63 34.540 -21.342 -5.310 1.00 0.00 H new ATOM 0 HA TYR A 63 32.865 -21.670 -2.888 1.00 0.00 H new ATOM 0 HB2 TYR A 63 33.199 -19.466 -4.852 1.00 0.00 H new ATOM 0 HB3 TYR A 63 31.534 -19.887 -4.504 1.00 0.00 H new ATOM 0 HD1 TYR A 63 30.647 -19.661 -2.183 1.00 0.00 H new ATOM 0 HD2 TYR A 63 34.599 -18.410 -3.167 1.00 0.00 H new ATOM 0 HE1 TYR A 63 30.753 -18.363 -0.101 1.00 0.00 H new ATOM 0 HE2 TYR A 63 34.708 -17.111 -1.087 1.00 0.00 H new ATOM 0 HH TYR A 63 33.669 -16.490 0.762 1.00 0.00 H new ATOM 1057 N PHE A 64 32.612 -23.252 -5.460 1.00 0.00 N ATOM 1058 CA PHE A 64 31.839 -24.175 -6.282 1.00 0.00 C ATOM 1059 C PHE A 64 31.147 -23.438 -7.425 1.00 0.00 C ATOM 1060 O PHE A 64 30.120 -22.783 -7.244 1.00 0.00 O ATOM 1061 CB PHE A 64 30.800 -24.904 -5.428 1.00 0.00 C ATOM 1062 CG PHE A 64 31.051 -26.380 -5.308 1.00 0.00 C ATOM 1063 CD1 PHE A 64 32.043 -26.861 -4.468 1.00 0.00 C ATOM 1064 CD2 PHE A 64 30.297 -27.287 -6.036 1.00 0.00 C ATOM 1065 CE1 PHE A 64 32.277 -28.219 -4.355 1.00 0.00 C ATOM 1066 CE2 PHE A 64 30.526 -28.645 -5.926 1.00 0.00 C ATOM 1067 CZ PHE A 64 31.518 -29.112 -5.086 1.00 0.00 C ATOM 0 H PHE A 64 33.619 -23.413 -5.478 1.00 0.00 H new ATOM 0 HA PHE A 64 32.527 -24.905 -6.708 1.00 0.00 H new ATOM 0 HB2 PHE A 64 30.787 -24.464 -4.431 1.00 0.00 H new ATOM 0 HB3 PHE A 64 29.811 -24.746 -5.859 1.00 0.00 H new ATOM 0 HD1 PHE A 64 32.640 -26.167 -3.895 1.00 0.00 H new ATOM 0 HD2 PHE A 64 29.522 -26.928 -6.697 1.00 0.00 H new ATOM 0 HE1 PHE A 64 33.052 -28.581 -3.696 1.00 0.00 H new ATOM 0 HE2 PHE A 64 29.929 -29.341 -6.497 1.00 0.00 H new ATOM 0 HZ PHE A 64 31.700 -30.173 -5.001 1.00 0.00 H new ATOM 1077 N PRO A 65 31.722 -23.545 -8.632 1.00 0.00 N ATOM 1078 CA PRO A 65 31.179 -22.895 -9.829 1.00 0.00 C ATOM 1079 C PRO A 65 29.870 -23.528 -10.288 1.00 0.00 C ATOM 1080 O PRO A 65 29.713 -24.749 -10.252 1.00 0.00 O ATOM 1081 CB PRO A 65 32.274 -23.110 -10.877 1.00 0.00 C ATOM 1082 CG PRO A 65 32.997 -24.331 -10.424 1.00 0.00 C ATOM 1083 CD PRO A 65 32.947 -24.309 -8.921 1.00 0.00 C ATOM 0 HA PRO A 65 30.941 -21.846 -9.651 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.849 -23.248 -11.871 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.943 -22.251 -10.932 1.00 0.00 H new ATOM 0 HG2 PRO A 65 32.526 -25.232 -10.817 1.00 0.00 H new ATOM 0 HG3 PRO A 65 34.027 -24.329 -10.780 1.00 0.00 H new ATOM 0 HD2 PRO A 65 32.900 -25.316 -8.506 1.00 0.00 H new ATOM 0 HD3 PRO A 65 33.829 -23.830 -8.496 1.00 0.00 H new ATOM 1091 N PHE A 66 28.933 -22.691 -10.720 1.00 0.00 N ATOM 1092 CA PHE A 66 27.636 -23.169 -11.186 1.00 0.00 C ATOM 1093 C PHE A 66 27.710 -23.603 -12.647 1.00 0.00 C ATOM 1094 O PHE A 66 28.279 -22.904 -13.485 1.00 0.00 O ATOM 1095 CB PHE A 66 26.577 -22.078 -11.019 1.00 0.00 C ATOM 1096 CG PHE A 66 26.677 -20.983 -12.042 1.00 0.00 C ATOM 1097 CD1 PHE A 66 26.023 -21.091 -13.259 1.00 0.00 C ATOM 1098 CD2 PHE A 66 27.426 -19.845 -11.787 1.00 0.00 C ATOM 1099 CE1 PHE A 66 26.114 -20.085 -14.202 1.00 0.00 C ATOM 1100 CE2 PHE A 66 27.519 -18.836 -12.726 1.00 0.00 C ATOM 1101 CZ PHE A 66 26.863 -18.956 -13.936 1.00 0.00 C ATOM 0 H PHE A 66 29.047 -21.678 -10.757 1.00 0.00 H new ATOM 0 HA PHE A 66 27.356 -24.032 -10.582 1.00 0.00 H new ATOM 0 HB2 PHE A 66 25.588 -22.531 -11.079 1.00 0.00 H new ATOM 0 HB3 PHE A 66 26.668 -21.644 -10.024 1.00 0.00 H new ATOM 0 HD1 PHE A 66 25.435 -21.972 -13.473 1.00 0.00 H new ATOM 0 HD2 PHE A 66 27.943 -19.746 -10.844 1.00 0.00 H new ATOM 0 HE1 PHE A 66 25.599 -20.182 -15.147 1.00 0.00 H new ATOM 0 HE2 PHE A 66 28.104 -17.953 -12.514 1.00 0.00 H new ATOM 0 HZ PHE A 66 26.936 -18.169 -14.672 1.00 0.00 H new ATOM 1111 N GLY A 67 27.131 -24.762 -12.944 1.00 0.00 N ATOM 1112 CA GLY A 67 27.142 -25.270 -14.303 1.00 0.00 C ATOM 1113 C GLY A 67 26.768 -26.737 -14.377 1.00 0.00 C ATOM 1114 O GLY A 67 27.334 -27.490 -15.169 1.00 0.00 O ATOM 0 H GLY A 67 26.654 -25.358 -12.268 1.00 0.00 H new ATOM 0 HA2 GLY A 67 26.447 -24.690 -14.910 1.00 0.00 H new ATOM 0 HA3 GLY A 67 28.134 -25.129 -14.732 1.00 0.00 H new ATOM 1118 N SER A 68 25.812 -27.145 -13.548 1.00 0.00 N ATOM 1119 CA SER A 68 25.367 -28.533 -13.518 1.00 0.00 C ATOM 1120 C SER A 68 24.169 -28.739 -14.441 1.00 0.00 C ATOM 1121 O SER A 68 23.202 -29.408 -14.079 1.00 0.00 O ATOM 1122 CB SER A 68 25.002 -28.943 -12.090 1.00 0.00 C ATOM 1123 OG SER A 68 23.858 -28.241 -11.634 1.00 0.00 O ATOM 0 H SER A 68 25.331 -26.534 -12.888 1.00 0.00 H new ATOM 0 HA SER A 68 26.187 -29.160 -13.870 1.00 0.00 H new ATOM 0 HB2 SER A 68 24.813 -30.016 -12.054 1.00 0.00 H new ATOM 0 HB3 SER A 68 25.843 -28.745 -11.425 1.00 0.00 H new ATOM 0 HG SER A 68 23.644 -28.522 -10.720 1.00 0.00 H new ATOM 1129 N GLU A 69 24.242 -28.157 -15.634 1.00 0.00 N ATOM 1130 CA GLU A 69 23.163 -28.275 -16.608 1.00 0.00 C ATOM 1131 C GLU A 69 23.024 -29.716 -17.092 1.00 0.00 C ATOM 1132 O GLU A 69 21.960 -30.124 -17.558 1.00 0.00 O ATOM 1133 CB GLU A 69 23.417 -27.348 -17.798 1.00 0.00 C ATOM 1134 CG GLU A 69 24.645 -27.722 -18.610 1.00 0.00 C ATOM 1135 CD GLU A 69 24.299 -28.189 -20.011 1.00 0.00 C ATOM 1136 OE1 GLU A 69 23.439 -27.551 -20.654 1.00 0.00 O ATOM 1137 OE2 GLU A 69 24.889 -29.192 -20.464 1.00 0.00 O ATOM 0 H GLU A 69 25.036 -27.600 -15.949 1.00 0.00 H new ATOM 0 HA GLU A 69 22.233 -27.982 -16.121 1.00 0.00 H new ATOM 0 HB2 GLU A 69 22.543 -27.360 -18.450 1.00 0.00 H new ATOM 0 HB3 GLU A 69 23.530 -26.327 -17.434 1.00 0.00 H new ATOM 0 HG2 GLU A 69 25.311 -26.861 -18.672 1.00 0.00 H new ATOM 0 HG3 GLU A 69 25.191 -28.511 -18.093 1.00 0.00 H new ATOM 1144 N GLU A 70 24.106 -30.480 -16.979 1.00 0.00 N ATOM 1145 CA GLU A 70 24.104 -31.874 -17.407 1.00 0.00 C ATOM 1146 C GLU A 70 22.986 -32.652 -16.719 1.00 0.00 C ATOM 1147 O GLU A 70 22.513 -33.665 -17.234 1.00 0.00 O ATOM 1148 CB GLU A 70 25.455 -32.525 -17.104 1.00 0.00 C ATOM 1149 CG GLU A 70 26.570 -32.075 -18.034 1.00 0.00 C ATOM 1150 CD GLU A 70 27.770 -33.000 -17.996 1.00 0.00 C ATOM 1151 OE1 GLU A 70 27.720 -34.009 -17.262 1.00 0.00 O ATOM 1152 OE2 GLU A 70 28.761 -32.715 -18.701 1.00 0.00 O ATOM 0 H GLU A 70 24.994 -30.158 -16.595 1.00 0.00 H new ATOM 0 HA GLU A 70 23.931 -31.898 -18.483 1.00 0.00 H new ATOM 0 HB2 GLU A 70 25.736 -32.297 -16.076 1.00 0.00 H new ATOM 0 HB3 GLU A 70 25.351 -33.608 -17.173 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.189 -32.023 -19.054 1.00 0.00 H new ATOM 0 HG3 GLU A 70 26.883 -31.068 -17.759 1.00 0.00 H new ATOM 1159 N SER A 71 22.570 -32.172 -15.552 1.00 0.00 N ATOM 1160 CA SER A 71 21.511 -32.824 -14.791 1.00 0.00 C ATOM 1161 C SER A 71 20.184 -32.760 -15.541 1.00 0.00 C ATOM 1162 O SER A 71 19.575 -33.788 -15.840 1.00 0.00 O ATOM 1163 CB SER A 71 21.365 -32.170 -13.416 1.00 0.00 C ATOM 1164 OG SER A 71 20.038 -32.288 -12.933 1.00 0.00 O ATOM 0 H SER A 71 22.950 -31.334 -15.113 1.00 0.00 H new ATOM 0 HA SER A 71 21.784 -33.871 -14.660 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.054 -32.637 -12.713 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.640 -31.117 -13.480 1.00 0.00 H new ATOM 0 HG SER A 71 19.972 -31.863 -12.052 1.00 0.00 H new ATOM 1170 N LYS A 72 19.740 -31.544 -15.842 1.00 0.00 N ATOM 1171 CA LYS A 72 18.486 -31.342 -16.558 1.00 0.00 C ATOM 1172 C LYS A 72 18.631 -31.723 -18.028 1.00 0.00 C ATOM 1173 O LYS A 72 17.647 -32.028 -18.701 1.00 0.00 O ATOM 1174 CB LYS A 72 18.037 -29.884 -16.440 1.00 0.00 C ATOM 1175 CG LYS A 72 16.533 -29.721 -16.298 1.00 0.00 C ATOM 1176 CD LYS A 72 16.160 -28.297 -15.921 1.00 0.00 C ATOM 1177 CE LYS A 72 15.812 -28.185 -14.445 1.00 0.00 C ATOM 1178 NZ LYS A 72 14.343 -28.084 -14.227 1.00 0.00 N ATOM 0 H LYS A 72 20.231 -30.683 -15.601 1.00 0.00 H new ATOM 0 HA LYS A 72 17.731 -31.986 -16.107 1.00 0.00 H new ATOM 0 HB2 LYS A 72 18.526 -29.430 -15.578 1.00 0.00 H new ATOM 0 HB3 LYS A 72 18.372 -29.337 -17.321 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.047 -29.989 -17.236 1.00 0.00 H new ATOM 0 HG3 LYS A 72 16.162 -30.409 -15.538 1.00 0.00 H new ATOM 0 HD2 LYS A 72 16.990 -27.629 -16.152 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.311 -27.971 -16.522 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.199 -29.055 -13.914 1.00 0.00 H new ATOM 0 HE3 LYS A 72 16.303 -27.309 -14.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.148 -28.009 -13.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 13.977 -27.240 -14.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.876 -28.932 -14.608 1.00 0.00 H new ATOM 1192 N VAL A 73 19.866 -31.705 -18.520 1.00 0.00 N ATOM 1193 CA VAL A 73 20.141 -32.051 -19.910 1.00 0.00 C ATOM 1194 C VAL A 73 19.540 -31.022 -20.861 1.00 0.00 C ATOM 1195 O VAL A 73 18.899 -31.375 -21.851 1.00 0.00 O ATOM 1196 CB VAL A 73 19.586 -33.444 -20.261 1.00 0.00 C ATOM 1197 CG1 VAL A 73 20.174 -33.938 -21.574 1.00 0.00 C ATOM 1198 CG2 VAL A 73 19.869 -34.430 -19.137 1.00 0.00 C ATOM 0 H VAL A 73 20.692 -31.454 -17.977 1.00 0.00 H new ATOM 0 HA VAL A 73 21.225 -32.060 -20.026 1.00 0.00 H new ATOM 0 HB VAL A 73 18.505 -33.365 -20.381 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.770 -34.924 -21.806 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.915 -33.243 -22.373 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.259 -34.002 -21.486 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.470 -35.409 -19.403 1.00 0.00 H new ATOM 0 HG22 VAL A 73 20.945 -34.507 -18.983 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.395 -34.082 -18.219 1.00 0.00 H new ATOM 1208 N LYS A 74 19.753 -29.747 -20.555 1.00 0.00 N ATOM 1209 CA LYS A 74 19.235 -28.664 -21.383 1.00 0.00 C ATOM 1210 C LYS A 74 19.635 -27.306 -20.816 1.00 0.00 C ATOM 1211 O LYS A 74 20.142 -27.215 -19.698 1.00 0.00 O ATOM 1212 CB LYS A 74 17.711 -28.757 -21.485 1.00 0.00 C ATOM 1213 CG LYS A 74 17.215 -29.121 -22.874 1.00 0.00 C ATOM 1214 CD LYS A 74 15.868 -28.483 -23.170 1.00 0.00 C ATOM 1215 CE LYS A 74 15.123 -29.237 -24.261 1.00 0.00 C ATOM 1216 NZ LYS A 74 14.811 -30.635 -23.855 1.00 0.00 N ATOM 0 H LYS A 74 20.281 -29.438 -19.739 1.00 0.00 H new ATOM 0 HA LYS A 74 19.667 -28.763 -22.379 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.352 -29.501 -20.774 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.277 -27.801 -21.192 1.00 0.00 H new ATOM 0 HG2 LYS A 74 17.943 -28.797 -23.618 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.132 -30.204 -22.959 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.265 -28.465 -22.262 1.00 0.00 H new ATOM 0 HD3 LYS A 74 16.014 -27.447 -23.477 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.197 -28.712 -24.498 1.00 0.00 H new ATOM 0 HE3 LYS A 74 15.724 -29.248 -25.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 13.963 -30.962 -24.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.614 -31.252 -24.091 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.638 -30.668 -22.830 1.00 0.00 H new ATOM 1230 N MET A 75 19.403 -26.253 -21.593 1.00 0.00 N ATOM 1231 CA MET A 75 19.738 -24.900 -21.166 1.00 0.00 C ATOM 1232 C MET A 75 18.818 -24.443 -20.038 1.00 0.00 C ATOM 1233 O MET A 75 19.191 -23.598 -19.224 1.00 0.00 O ATOM 1234 CB MET A 75 19.638 -23.930 -22.345 1.00 0.00 C ATOM 1235 CG MET A 75 20.395 -22.630 -22.129 1.00 0.00 C ATOM 1236 SD MET A 75 20.223 -21.488 -23.513 1.00 0.00 S ATOM 1237 CE MET A 75 21.844 -21.619 -24.263 1.00 0.00 C ATOM 0 H MET A 75 18.984 -26.311 -22.521 1.00 0.00 H new ATOM 0 HA MET A 75 20.763 -24.906 -20.796 1.00 0.00 H new ATOM 0 HB2 MET A 75 20.021 -24.419 -23.241 1.00 0.00 H new ATOM 0 HB3 MET A 75 18.588 -23.703 -22.530 1.00 0.00 H new ATOM 0 HG2 MET A 75 20.033 -22.150 -21.220 1.00 0.00 H new ATOM 0 HG3 MET A 75 21.451 -22.851 -21.974 1.00 0.00 H new ATOM 0 HE1 MET A 75 21.895 -20.968 -25.136 1.00 0.00 H new ATOM 0 HE2 MET A 75 22.604 -21.318 -23.542 1.00 0.00 H new ATOM 0 HE3 MET A 75 22.021 -22.650 -24.568 1.00 0.00 H new ATOM 1247 N ALA A 76 17.616 -25.007 -19.996 1.00 0.00 N ATOM 1248 CA ALA A 76 16.644 -24.658 -18.966 1.00 0.00 C ATOM 1249 C ALA A 76 17.262 -24.747 -17.575 1.00 0.00 C ATOM 1250 O ALA A 76 16.870 -24.019 -16.664 1.00 0.00 O ATOM 1251 CB ALA A 76 15.425 -25.563 -19.063 1.00 0.00 C ATOM 0 H ALA A 76 17.291 -25.707 -20.663 1.00 0.00 H new ATOM 0 HA ALA A 76 16.332 -23.627 -19.131 1.00 0.00 H new ATOM 0 HB1 ALA A 76 14.708 -25.292 -18.288 1.00 0.00 H new ATOM 0 HB2 ALA A 76 14.962 -25.446 -20.043 1.00 0.00 H new ATOM 0 HB3 ALA A 76 15.730 -26.600 -18.927 1.00 0.00 H new ATOM 1257 N ASP A 77 18.229 -25.645 -17.419 1.00 0.00 N ATOM 1258 CA ASP A 77 18.902 -25.829 -16.138 1.00 0.00 C ATOM 1259 C ASP A 77 19.673 -24.573 -15.744 1.00 0.00 C ATOM 1260 O ASP A 77 19.631 -24.143 -14.591 1.00 0.00 O ATOM 1261 CB ASP A 77 19.852 -27.026 -16.204 1.00 0.00 C ATOM 1262 CG ASP A 77 20.075 -27.664 -14.847 1.00 0.00 C ATOM 1263 OD1 ASP A 77 19.756 -27.016 -13.828 1.00 0.00 O ATOM 1264 OD2 ASP A 77 20.567 -28.810 -14.805 1.00 0.00 O ATOM 0 H ASP A 77 18.564 -26.257 -18.163 1.00 0.00 H new ATOM 0 HA ASP A 77 18.142 -26.020 -15.380 1.00 0.00 H new ATOM 0 HB2 ASP A 77 19.447 -27.770 -16.890 1.00 0.00 H new ATOM 0 HB3 ASP A 77 20.810 -26.704 -16.613 1.00 0.00 H new ATOM 1269 N PHE A 78 20.377 -23.990 -16.708 1.00 0.00 N ATOM 1270 CA PHE A 78 21.160 -22.785 -16.462 1.00 0.00 C ATOM 1271 C PHE A 78 20.260 -21.631 -16.028 1.00 0.00 C ATOM 1272 O PHE A 78 20.497 -20.998 -14.999 1.00 0.00 O ATOM 1273 CB PHE A 78 21.941 -22.392 -17.717 1.00 0.00 C ATOM 1274 CG PHE A 78 23.384 -22.809 -17.680 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.211 -22.399 -16.647 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.913 -23.611 -18.679 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.539 -22.781 -16.610 1.00 0.00 C ATOM 1278 CE2 PHE A 78 25.240 -23.996 -18.646 1.00 0.00 C ATOM 1279 CZ PHE A 78 26.054 -23.580 -17.611 1.00 0.00 C ATOM 0 H PHE A 78 20.421 -24.333 -17.668 1.00 0.00 H new ATOM 0 HA PHE A 78 21.863 -22.998 -15.657 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.464 -22.841 -18.588 1.00 0.00 H new ATOM 0 HB3 PHE A 78 21.887 -21.311 -17.846 1.00 0.00 H new ATOM 0 HD1 PHE A 78 23.814 -21.774 -15.861 1.00 0.00 H new ATOM 0 HD2 PHE A 78 23.282 -23.939 -19.492 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.173 -22.455 -15.799 1.00 0.00 H new ATOM 0 HE2 PHE A 78 25.640 -24.622 -19.430 1.00 0.00 H new ATOM 0 HZ PHE A 78 27.091 -23.879 -17.585 1.00 0.00 H new ATOM 1289 N ILE A 79 19.227 -21.364 -16.821 1.00 0.00 N ATOM 1290 CA ILE A 79 18.292 -20.288 -16.519 1.00 0.00 C ATOM 1291 C ILE A 79 17.509 -20.581 -15.244 1.00 0.00 C ATOM 1292 O ILE A 79 17.162 -19.670 -14.493 1.00 0.00 O ATOM 1293 CB ILE A 79 17.301 -20.063 -17.676 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.220 -19.061 -17.263 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.673 -21.382 -18.100 1.00 0.00 C ATOM 1296 CD1 ILE A 79 14.942 -19.714 -16.784 1.00 0.00 C ATOM 0 H ILE A 79 19.017 -21.878 -17.677 1.00 0.00 H new ATOM 0 HA ILE A 79 18.885 -19.385 -16.378 1.00 0.00 H new ATOM 0 HB ILE A 79 17.846 -19.652 -18.526 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.611 -18.423 -16.471 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.993 -18.414 -18.110 1.00 0.00 H new ATOM 0 HG21 ILE A 79 15.975 -21.206 -18.919 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.454 -22.067 -18.430 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.140 -21.819 -17.256 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.221 -18.944 -16.508 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.527 -20.330 -17.582 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.156 -20.339 -15.917 1.00 0.00 H new ATOM 1308 N ALA A 80 17.236 -21.860 -15.004 1.00 0.00 N ATOM 1309 CA ALA A 80 16.498 -22.274 -13.818 1.00 0.00 C ATOM 1310 C ALA A 80 17.339 -22.097 -12.558 1.00 0.00 C ATOM 1311 O ALA A 80 16.873 -21.543 -11.562 1.00 0.00 O ATOM 1312 CB ALA A 80 16.048 -23.721 -13.955 1.00 0.00 C ATOM 0 H ALA A 80 17.515 -22.627 -15.616 1.00 0.00 H new ATOM 0 HA ALA A 80 15.618 -21.638 -13.728 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.498 -24.017 -13.062 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.403 -23.820 -14.828 1.00 0.00 H new ATOM 0 HB3 ALA A 80 16.920 -24.364 -14.073 1.00 0.00 H new ATOM 1318 N ARG A 81 18.580 -22.570 -12.609 1.00 0.00 N ATOM 1319 CA ARG A 81 19.485 -22.465 -11.471 1.00 0.00 C ATOM 1320 C ARG A 81 19.955 -21.026 -11.281 1.00 0.00 C ATOM 1321 O ARG A 81 20.203 -20.588 -10.158 1.00 0.00 O ATOM 1322 CB ARG A 81 20.692 -23.385 -11.666 1.00 0.00 C ATOM 1323 CG ARG A 81 21.711 -23.299 -10.541 1.00 0.00 C ATOM 1324 CD ARG A 81 22.151 -24.681 -10.082 1.00 0.00 C ATOM 1325 NE ARG A 81 23.590 -24.744 -9.839 1.00 0.00 N ATOM 1326 CZ ARG A 81 24.170 -24.289 -8.735 1.00 0.00 C ATOM 1327 NH1 ARG A 81 23.438 -23.740 -7.775 1.00 0.00 N ATOM 1328 NH2 ARG A 81 25.485 -24.383 -8.588 1.00 0.00 N ATOM 0 H ARG A 81 18.982 -23.030 -13.426 1.00 0.00 H new ATOM 0 HA ARG A 81 18.942 -22.773 -10.577 1.00 0.00 H new ATOM 0 HB2 ARG A 81 20.344 -24.414 -11.751 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.181 -23.135 -12.608 1.00 0.00 H new ATOM 0 HG2 ARG A 81 22.579 -22.732 -10.877 1.00 0.00 H new ATOM 0 HG3 ARG A 81 21.281 -22.755 -9.700 1.00 0.00 H new ATOM 0 HD2 ARG A 81 21.617 -24.947 -9.170 1.00 0.00 H new ATOM 0 HD3 ARG A 81 21.878 -25.418 -10.837 1.00 0.00 H new ATOM 0 HE ARG A 81 24.182 -25.161 -10.557 1.00 0.00 H new ATOM 0 HH11 ARG A 81 22.426 -23.666 -7.884 1.00 0.00 H new ATOM 0 HH12 ARG A 81 23.887 -23.391 -6.928 1.00 0.00 H new ATOM 0 HH21 ARG A 81 26.052 -24.805 -9.324 1.00 0.00 H new ATOM 0 HH22 ARG A 81 25.930 -24.033 -7.739 1.00 0.00 H new ATOM 1342 N GLU A 82 20.076 -20.297 -12.386 1.00 0.00 N ATOM 1343 CA GLU A 82 20.517 -18.908 -12.340 1.00 0.00 C ATOM 1344 C GLU A 82 19.425 -18.009 -11.769 1.00 0.00 C ATOM 1345 O GLU A 82 19.688 -17.161 -10.917 1.00 0.00 O ATOM 1346 CB GLU A 82 20.909 -18.428 -13.739 1.00 0.00 C ATOM 1347 CG GLU A 82 22.269 -18.928 -14.196 1.00 0.00 C ATOM 1348 CD GLU A 82 22.465 -18.799 -15.694 1.00 0.00 C ATOM 1349 OE1 GLU A 82 21.452 -18.723 -16.420 1.00 0.00 O ATOM 1350 OE2 GLU A 82 23.631 -18.775 -16.140 1.00 0.00 O ATOM 0 H GLU A 82 19.875 -20.645 -13.323 1.00 0.00 H new ATOM 0 HA GLU A 82 21.388 -18.851 -11.687 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.152 -18.756 -14.452 1.00 0.00 H new ATOM 0 HB3 GLU A 82 20.909 -17.338 -13.753 1.00 0.00 H new ATOM 0 HG2 GLU A 82 23.050 -18.367 -13.682 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.384 -19.973 -13.907 1.00 0.00 H new ATOM 1357 N GLU A 83 18.199 -18.201 -12.246 1.00 0.00 N ATOM 1358 CA GLU A 83 17.067 -17.406 -11.784 1.00 0.00 C ATOM 1359 C GLU A 83 16.810 -17.638 -10.297 1.00 0.00 C ATOM 1360 O GLU A 83 16.734 -16.690 -9.515 1.00 0.00 O ATOM 1361 CB GLU A 83 15.812 -17.749 -12.589 1.00 0.00 C ATOM 1362 CG GLU A 83 15.742 -17.050 -13.935 1.00 0.00 C ATOM 1363 CD GLU A 83 14.383 -17.186 -14.594 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.566 -17.996 -14.109 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.137 -16.482 -15.596 1.00 0.00 O ATOM 0 H GLU A 83 17.964 -18.899 -12.951 1.00 0.00 H new ATOM 0 HA GLU A 83 17.310 -16.354 -11.934 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.775 -18.827 -12.747 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.932 -17.482 -12.004 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.974 -15.993 -13.804 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.505 -17.464 -14.595 1.00 0.00 H new ATOM 1372 N ILE A 84 16.677 -18.904 -9.916 1.00 0.00 N ATOM 1373 CA ILE A 84 16.429 -19.260 -8.525 1.00 0.00 C ATOM 1374 C ILE A 84 17.598 -18.849 -7.636 1.00 0.00 C ATOM 1375 O ILE A 84 17.414 -18.525 -6.463 1.00 0.00 O ATOM 1376 CB ILE A 84 16.185 -20.773 -8.366 1.00 0.00 C ATOM 1377 CG1 ILE A 84 17.452 -21.556 -8.719 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.021 -21.216 -9.239 1.00 0.00 C ATOM 1379 CD1 ILE A 84 18.205 -22.063 -7.509 1.00 0.00 C ATOM 0 H ILE A 84 16.737 -19.700 -10.551 1.00 0.00 H new ATOM 0 HA ILE A 84 15.533 -18.721 -8.216 1.00 0.00 H new ATOM 0 HB ILE A 84 15.932 -20.978 -7.326 1.00 0.00 H new ATOM 0 HG12 ILE A 84 17.182 -22.403 -9.350 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.112 -20.918 -9.307 1.00 0.00 H new ATOM 0 HG21 ILE A 84 14.861 -22.287 -9.116 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.120 -20.678 -8.944 1.00 0.00 H new ATOM 0 HG23 ILE A 84 15.247 -21.001 -10.283 1.00 0.00 H new ATOM 0 HD11 ILE A 84 19.091 -22.608 -7.834 1.00 0.00 H new ATOM 0 HD12 ILE A 84 18.506 -21.219 -6.888 1.00 0.00 H new ATOM 0 HD13 ILE A 84 17.562 -22.727 -6.932 1.00 0.00 H new ATOM 1391 N GLU A 85 18.800 -18.863 -8.203 1.00 0.00 N ATOM 1392 CA GLU A 85 19.999 -18.491 -7.462 1.00 0.00 C ATOM 1393 C GLU A 85 19.866 -17.084 -6.884 1.00 0.00 C ATOM 1394 O GLU A 85 20.156 -16.854 -5.711 1.00 0.00 O ATOM 1395 CB GLU A 85 21.230 -18.568 -8.366 1.00 0.00 C ATOM 1396 CG GLU A 85 22.456 -17.882 -7.787 1.00 0.00 C ATOM 1397 CD GLU A 85 23.747 -18.589 -8.152 1.00 0.00 C ATOM 1398 OE1 GLU A 85 23.932 -18.906 -9.345 1.00 0.00 O ATOM 1399 OE2 GLU A 85 24.572 -18.825 -7.244 1.00 0.00 O ATOM 0 H GLU A 85 18.969 -19.128 -9.173 1.00 0.00 H new ATOM 0 HA GLU A 85 20.119 -19.195 -6.638 1.00 0.00 H new ATOM 0 HB2 GLU A 85 21.466 -19.615 -8.556 1.00 0.00 H new ATOM 0 HB3 GLU A 85 20.992 -18.116 -9.329 1.00 0.00 H new ATOM 0 HG2 GLU A 85 22.495 -16.853 -8.146 1.00 0.00 H new ATOM 0 HG3 GLU A 85 22.365 -17.838 -6.702 1.00 0.00 H new ATOM 1406 N MET A 86 19.427 -16.148 -7.719 1.00 0.00 N ATOM 1407 CA MET A 86 19.255 -14.764 -7.292 1.00 0.00 C ATOM 1408 C MET A 86 17.977 -14.601 -6.477 1.00 0.00 C ATOM 1409 O MET A 86 17.980 -13.973 -5.418 1.00 0.00 O ATOM 1410 CB MET A 86 19.222 -13.833 -8.506 1.00 0.00 C ATOM 1411 CG MET A 86 19.812 -12.459 -8.234 1.00 0.00 C ATOM 1412 SD MET A 86 21.591 -12.510 -7.947 1.00 0.00 S ATOM 1413 CE MET A 86 21.650 -12.388 -6.161 1.00 0.00 C ATOM 0 H MET A 86 19.184 -16.322 -8.694 1.00 0.00 H new ATOM 0 HA MET A 86 20.103 -14.497 -6.662 1.00 0.00 H new ATOM 0 HB2 MET A 86 19.769 -14.299 -9.326 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.190 -13.717 -8.837 1.00 0.00 H new ATOM 0 HG2 MET A 86 19.603 -11.805 -9.080 1.00 0.00 H new ATOM 0 HG3 MET A 86 19.320 -12.023 -7.365 1.00 0.00 H new ATOM 0 HE1 MET A 86 22.051 -11.416 -5.876 1.00 0.00 H new ATOM 0 HE2 MET A 86 20.644 -12.499 -5.755 1.00 0.00 H new ATOM 0 HE3 MET A 86 22.290 -13.175 -5.763 1.00 0.00 H new ATOM 1423 N MET A 87 16.885 -15.170 -6.977 1.00 0.00 N ATOM 1424 CA MET A 87 15.599 -15.089 -6.293 1.00 0.00 C ATOM 1425 C MET A 87 15.713 -15.593 -4.858 1.00 0.00 C ATOM 1426 O MET A 87 15.251 -14.941 -3.922 1.00 0.00 O ATOM 1427 CB MET A 87 14.544 -15.898 -7.048 1.00 0.00 C ATOM 1428 CG MET A 87 14.173 -15.305 -8.398 1.00 0.00 C ATOM 1429 SD MET A 87 12.390 -15.223 -8.654 1.00 0.00 S ATOM 1430 CE MET A 87 11.988 -13.724 -7.760 1.00 0.00 C ATOM 0 H MET A 87 16.865 -15.692 -7.853 1.00 0.00 H new ATOM 0 HA MET A 87 15.295 -14.043 -6.268 1.00 0.00 H new ATOM 0 HB2 MET A 87 14.913 -16.913 -7.196 1.00 0.00 H new ATOM 0 HB3 MET A 87 13.646 -15.972 -6.434 1.00 0.00 H new ATOM 0 HG2 MET A 87 14.594 -14.303 -8.478 1.00 0.00 H new ATOM 0 HG3 MET A 87 14.623 -15.904 -9.190 1.00 0.00 H new ATOM 0 HE1 MET A 87 10.916 -13.538 -7.826 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.273 -13.837 -6.714 1.00 0.00 H new ATOM 0 HE3 MET A 87 12.530 -12.884 -8.195 1.00 0.00 H new ATOM 1440 N VAL A 88 16.331 -16.758 -4.692 1.00 0.00 N ATOM 1441 CA VAL A 88 16.507 -17.349 -3.371 1.00 0.00 C ATOM 1442 C VAL A 88 17.534 -16.573 -2.554 1.00 0.00 C ATOM 1443 O VAL A 88 17.376 -16.396 -1.346 1.00 0.00 O ATOM 1444 CB VAL A 88 16.950 -18.821 -3.469 1.00 0.00 C ATOM 1445 CG1 VAL A 88 17.308 -19.364 -2.094 1.00 0.00 C ATOM 1446 CG2 VAL A 88 15.862 -19.663 -4.118 1.00 0.00 C ATOM 0 H VAL A 88 16.718 -17.311 -5.456 1.00 0.00 H new ATOM 0 HA VAL A 88 15.539 -17.302 -2.871 1.00 0.00 H new ATOM 0 HB VAL A 88 17.840 -18.873 -4.096 1.00 0.00 H new ATOM 0 HG11 VAL A 88 17.618 -20.405 -2.183 1.00 0.00 H new ATOM 0 HG12 VAL A 88 18.124 -18.777 -1.672 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.439 -19.300 -1.440 1.00 0.00 H new ATOM 0 HG21 VAL A 88 16.192 -20.700 -4.179 1.00 0.00 H new ATOM 0 HG22 VAL A 88 14.953 -19.606 -3.520 1.00 0.00 H new ATOM 0 HG23 VAL A 88 15.660 -19.287 -5.121 1.00 0.00 H new ATOM 1456 N PHE A 89 18.586 -16.112 -3.221 1.00 0.00 N ATOM 1457 CA PHE A 89 19.641 -15.355 -2.556 1.00 0.00 C ATOM 1458 C PHE A 89 19.089 -14.066 -1.956 1.00 0.00 C ATOM 1459 O PHE A 89 19.248 -13.805 -0.762 1.00 0.00 O ATOM 1460 CB PHE A 89 20.764 -15.031 -3.543 1.00 0.00 C ATOM 1461 CG PHE A 89 21.844 -14.166 -2.959 1.00 0.00 C ATOM 1462 CD1 PHE A 89 21.736 -12.785 -2.989 1.00 0.00 C ATOM 1463 CD2 PHE A 89 22.968 -14.734 -2.380 1.00 0.00 C ATOM 1464 CE1 PHE A 89 22.728 -11.986 -2.452 1.00 0.00 C ATOM 1465 CE2 PHE A 89 23.962 -13.940 -1.841 1.00 0.00 C ATOM 1466 CZ PHE A 89 23.843 -12.565 -1.878 1.00 0.00 C ATOM 0 H PHE A 89 18.731 -16.249 -4.221 1.00 0.00 H new ATOM 0 HA PHE A 89 20.041 -15.969 -1.749 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.207 -15.962 -3.896 1.00 0.00 H new ATOM 0 HB3 PHE A 89 20.339 -14.530 -4.413 1.00 0.00 H new ATOM 0 HD1 PHE A 89 20.866 -12.327 -3.437 1.00 0.00 H new ATOM 0 HD2 PHE A 89 23.068 -15.809 -2.350 1.00 0.00 H new ATOM 0 HE1 PHE A 89 22.631 -10.911 -2.481 1.00 0.00 H new ATOM 0 HE2 PHE A 89 24.832 -14.395 -1.391 1.00 0.00 H new ATOM 0 HZ PHE A 89 24.620 -11.943 -1.459 1.00 0.00 H new ATOM 1476 N LEU A 90 18.440 -13.262 -2.791 1.00 0.00 N ATOM 1477 CA LEU A 90 17.863 -11.998 -2.344 1.00 0.00 C ATOM 1478 C LEU A 90 16.728 -12.238 -1.354 1.00 0.00 C ATOM 1479 O LEU A 90 16.521 -11.452 -0.430 1.00 0.00 O ATOM 1480 CB LEU A 90 17.351 -11.197 -3.542 1.00 0.00 C ATOM 1481 CG LEU A 90 16.249 -11.859 -4.370 1.00 0.00 C ATOM 1482 CD1 LEU A 90 14.878 -11.406 -3.894 1.00 0.00 C ATOM 1483 CD2 LEU A 90 16.432 -11.546 -5.848 1.00 0.00 C ATOM 0 H LEU A 90 18.300 -13.462 -3.781 1.00 0.00 H new ATOM 0 HA LEU A 90 18.644 -11.427 -1.841 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.980 -10.238 -3.181 1.00 0.00 H new ATOM 0 HB3 LEU A 90 18.194 -10.985 -4.199 1.00 0.00 H new ATOM 0 HG LEU A 90 16.319 -12.938 -4.236 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.107 -11.888 -4.495 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.747 -11.681 -2.847 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.796 -10.324 -3.998 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.639 -12.025 -6.422 1.00 0.00 H new ATOM 0 HD22 LEU A 90 16.389 -10.467 -6.000 1.00 0.00 H new ATOM 0 HD23 LEU A 90 17.399 -11.921 -6.182 1.00 0.00 H new ATOM 1495 N SER A 91 15.996 -13.329 -1.553 1.00 0.00 N ATOM 1496 CA SER A 91 14.880 -13.672 -0.679 1.00 0.00 C ATOM 1497 C SER A 91 15.379 -14.080 0.703 1.00 0.00 C ATOM 1498 O SER A 91 14.760 -13.760 1.718 1.00 0.00 O ATOM 1499 CB SER A 91 14.055 -14.805 -1.292 1.00 0.00 C ATOM 1500 OG SER A 91 13.192 -15.386 -0.328 1.00 0.00 O ATOM 0 H SER A 91 16.156 -13.991 -2.312 1.00 0.00 H new ATOM 0 HA SER A 91 14.249 -12.790 -0.572 1.00 0.00 H new ATOM 0 HB2 SER A 91 13.468 -14.421 -2.126 1.00 0.00 H new ATOM 0 HB3 SER A 91 14.721 -15.568 -1.695 1.00 0.00 H new ATOM 0 HG SER A 91 12.674 -16.106 -0.744 1.00 0.00 H new ATOM 1506 N SER A 92 16.502 -14.790 0.735 1.00 0.00 N ATOM 1507 CA SER A 92 17.083 -15.246 1.992 1.00 0.00 C ATOM 1508 C SER A 92 17.620 -14.069 2.801 1.00 0.00 C ATOM 1509 O SER A 92 17.612 -14.092 4.032 1.00 0.00 O ATOM 1510 CB SER A 92 18.206 -16.250 1.725 1.00 0.00 C ATOM 1511 OG SER A 92 18.795 -16.692 2.936 1.00 0.00 O ATOM 0 H SER A 92 17.028 -15.062 -0.096 1.00 0.00 H new ATOM 0 HA SER A 92 16.298 -15.734 2.570 1.00 0.00 H new ATOM 0 HB2 SER A 92 17.811 -17.105 1.176 1.00 0.00 H new ATOM 0 HB3 SER A 92 18.966 -15.790 1.094 1.00 0.00 H new ATOM 0 HG SER A 92 19.509 -17.334 2.738 1.00 0.00 H new