USER MOD reduce.3.24.130724 H: found=0, std=0, add=1010, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1011 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 54 SER OG : rot 180:sc= -0.324! USER MOD Set 1.2: A 94 THR OG1 : rot -147:sc= -3.34! USER MOD Set 2.1: A 40 GLN :FLIP amide:sc= -0.536 F(o=-24!,f=-13) USER MOD Set 2.2: A 59 LYS NZ :NH3+ 155:sc= -2.33 (180deg=-0.848) USER MOD Set 2.3: A 89 ASN : amide:sc= -10.3! C(o=-13!,f=-28!) USER MOD Single : A 13 SER OG : rot -94:sc= 0.212 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 89:sc= -3.66! USER MOD Single : A 21 SER OG : rot 67:sc= -2.04! USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ -150:sc= -3.93! (180deg=-4.74!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -104:sc= 0.725 USER MOD Single : A 31 CYS SG : rot 140:sc= -8! USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 55 MET CE :methyl -133:sc= -1.12 (180deg=-3.1!) USER MOD Single : A 61 ASN : amide:sc= -0.0225 X(o=-0.022,f=-0.022) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot -82:sc= 0.388 USER MOD Single : A 77 SER OG : rot -52:sc= 0.411 USER MOD Single : A 79 THR OG1 : rot 170:sc= -4.87! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN :FLIP amide:sc= -4.55 F(o=-6.9!,f=-4.5) USER MOD Single : A 85 LYS NZ :NH3+ 160:sc= -2.51! (180deg=-3.36!) USER MOD Single : A 86 THR OG1 : rot -120:sc= -0.678 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=-0.054) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 11:sc= -5.47! USER MOD Single : A 99 GLN :FLIP amide:sc= -8.08! C(o=-9.1!,f=-8.1!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 TYR OH : rot -30:sc= -1.17 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN :FLIP amide:sc= -0.443 F(o=-3!,f=-0.44) USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 SER OG : rot -48:sc= -0.0623 USER MOD Single : A 125 GLN : amide:sc= -4.48! C(o=-4.5!,f=-7.4!) USER MOD Single : A 126 HIS : no HE2:sc= -3.77! C(o=-3.8!,f=-5.8!) USER MOD Single : A 129 THR OG1 : rot 49:sc= -1.25 USER MOD Single : A 130 TYR OH : rot -122:sc= 1.27 USER MOD Single : A 131 ASN : amide:sc= -9.65! C(o=-9.6!,f=-18!) USER MOD ----------------------------------------------------------------- ATOM 157 N LEU A 10 -2.504 13.022 0.185 1.00 0.00 N ATOM 158 CA LEU A 10 -1.465 13.435 1.135 1.00 0.00 C ATOM 159 C LEU A 10 -0.740 14.689 0.682 1.00 0.00 C ATOM 160 O LEU A 10 -0.561 15.620 1.466 1.00 0.00 O ATOM 161 CB LEU A 10 -0.412 12.354 1.379 1.00 0.00 C ATOM 162 CG LEU A 10 -0.434 11.274 0.296 1.00 0.00 C ATOM 163 CD1 LEU A 10 0.703 11.563 -0.682 1.00 0.00 C ATOM 164 CD2 LEU A 10 -0.252 9.897 0.954 1.00 0.00 C ATOM 0 HA LEU A 10 -2.005 13.626 2.062 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.576 12.812 1.413 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.584 11.894 2.352 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.383 11.275 -0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.710 10.806 -1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.558 12.547 -1.129 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.654 11.543 -0.150 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.267 9.123 0.187 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.702 9.868 1.480 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.062 9.722 1.662 1.00 0.00 H new ATOM 176 N PHE A 11 -0.309 14.717 -0.566 1.00 0.00 N ATOM 177 CA PHE A 11 0.407 15.885 -1.050 1.00 0.00 C ATOM 178 C PHE A 11 -0.540 16.861 -1.745 1.00 0.00 C ATOM 179 O PHE A 11 -0.425 18.076 -1.578 1.00 0.00 O ATOM 180 CB PHE A 11 1.535 15.501 -2.005 1.00 0.00 C ATOM 181 CG PHE A 11 0.949 15.334 -3.378 1.00 0.00 C ATOM 182 CD1 PHE A 11 -0.107 14.462 -3.525 1.00 0.00 C ATOM 183 CD2 PHE A 11 1.433 16.051 -4.480 1.00 0.00 C ATOM 184 CE1 PHE A 11 -0.706 14.279 -4.773 1.00 0.00 C ATOM 185 CE2 PHE A 11 0.843 15.873 -5.738 1.00 0.00 C ATOM 186 CZ PHE A 11 -0.230 14.983 -5.885 1.00 0.00 C ATOM 0 H PHE A 11 -0.436 13.968 -1.247 1.00 0.00 H new ATOM 0 HA PHE A 11 0.844 16.371 -0.178 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.306 16.271 -2.012 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.011 14.576 -1.679 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.474 13.916 -2.669 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.258 16.738 -4.360 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.535 13.595 -4.880 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.214 16.420 -6.592 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.688 14.841 -6.853 1.00 0.00 H new ATOM 196 N GLU A 12 -1.475 16.321 -2.524 1.00 0.00 N ATOM 197 CA GLU A 12 -2.434 17.154 -3.240 1.00 0.00 C ATOM 198 C GLU A 12 -3.176 18.057 -2.264 1.00 0.00 C ATOM 199 O GLU A 12 -3.416 19.231 -2.544 1.00 0.00 O ATOM 200 CB GLU A 12 -3.435 16.273 -3.989 1.00 0.00 C ATOM 201 CG GLU A 12 -4.456 17.152 -4.705 1.00 0.00 C ATOM 202 CD GLU A 12 -3.754 18.278 -5.455 1.00 0.00 C ATOM 203 OE1 GLU A 12 -3.022 17.979 -6.384 1.00 0.00 O ATOM 204 OE2 GLU A 12 -3.959 19.425 -5.091 1.00 0.00 O ATOM 0 H GLU A 12 -1.587 15.318 -2.674 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.894 17.773 -3.957 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.913 15.644 -4.710 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.941 15.606 -3.291 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -5.038 16.550 -5.402 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -5.157 17.569 -3.982 1.00 0.00 H new ATOM 211 N SER A 13 -3.530 17.500 -1.112 1.00 0.00 N ATOM 212 CA SER A 13 -4.237 18.264 -0.094 1.00 0.00 C ATOM 213 C SER A 13 -3.256 19.126 0.689 1.00 0.00 C ATOM 214 O SER A 13 -3.655 19.929 1.531 1.00 0.00 O ATOM 215 CB SER A 13 -4.961 17.316 0.863 1.00 0.00 C ATOM 216 OG SER A 13 -5.979 18.031 1.550 1.00 0.00 O ATOM 0 H SER A 13 -3.341 16.530 -0.861 1.00 0.00 H new ATOM 0 HA SER A 13 -4.967 18.908 -0.584 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.395 16.484 0.309 1.00 0.00 H new ATOM 0 HB3 SER A 13 -4.255 16.891 1.576 1.00 0.00 H new ATOM 0 HG SER A 13 -5.628 18.361 2.403 1.00 0.00 H new ATOM 222 N ALA A 14 -1.968 18.953 0.405 1.00 0.00 N ATOM 223 CA ALA A 14 -0.936 19.713 1.085 1.00 0.00 C ATOM 224 C ALA A 14 -0.313 20.720 0.145 1.00 0.00 C ATOM 225 O ALA A 14 -0.557 20.699 -1.061 1.00 0.00 O ATOM 226 CB ALA A 14 0.170 18.774 1.554 1.00 0.00 C ATOM 0 H ALA A 14 -1.620 18.293 -0.291 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.396 20.224 1.930 1.00 0.00 H new ATOM 0 HB1 ALA A 14 0.943 19.349 2.064 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.246 18.036 2.240 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.604 18.265 0.694 1.00 0.00 H new ATOM 232 N SER A 15 0.537 21.566 0.698 1.00 0.00 N ATOM 233 CA SER A 15 1.238 22.531 -0.114 1.00 0.00 C ATOM 234 C SER A 15 2.351 21.794 -0.839 1.00 0.00 C ATOM 235 O SER A 15 2.884 20.796 -0.335 1.00 0.00 O ATOM 236 CB SER A 15 1.819 23.646 0.755 1.00 0.00 C ATOM 237 OG SER A 15 1.858 24.853 0.004 1.00 0.00 O ATOM 0 H SER A 15 0.754 21.602 1.694 1.00 0.00 H new ATOM 0 HA SER A 15 0.555 22.993 -0.827 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.211 23.780 1.650 1.00 0.00 H new ATOM 0 HB3 SER A 15 2.822 23.379 1.088 1.00 0.00 H new ATOM 0 HG SER A 15 2.228 25.571 0.558 1.00 0.00 H new ATOM 243 N ARG A 16 2.705 22.256 -2.019 1.00 0.00 N ATOM 244 CA ARG A 16 3.749 21.581 -2.751 1.00 0.00 C ATOM 245 C ARG A 16 4.908 21.304 -1.808 1.00 0.00 C ATOM 246 O ARG A 16 5.746 20.439 -2.064 1.00 0.00 O ATOM 247 CB ARG A 16 4.210 22.426 -3.937 1.00 0.00 C ATOM 248 CG ARG A 16 3.542 21.911 -5.212 1.00 0.00 C ATOM 249 CD ARG A 16 2.062 22.288 -5.202 1.00 0.00 C ATOM 250 NE ARG A 16 1.568 22.429 -6.567 1.00 0.00 N ATOM 251 CZ ARG A 16 0.322 22.830 -6.809 1.00 0.00 C ATOM 252 NH1 ARG A 16 -0.482 23.096 -5.816 1.00 0.00 N ATOM 253 NH2 ARG A 16 -0.094 22.957 -8.038 1.00 0.00 N ATOM 0 H ARG A 16 2.299 23.071 -2.479 1.00 0.00 H new ATOM 0 HA ARG A 16 3.366 20.640 -3.145 1.00 0.00 H new ATOM 0 HB2 ARG A 16 3.953 23.473 -3.775 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.294 22.376 -4.035 1.00 0.00 H new ATOM 0 HG2 ARG A 16 4.030 22.337 -6.088 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.652 20.829 -5.281 1.00 0.00 H new ATOM 0 HD2 ARG A 16 1.488 21.524 -4.677 1.00 0.00 H new ATOM 0 HD3 ARG A 16 1.921 23.222 -4.658 1.00 0.00 H new ATOM 0 HE ARG A 16 2.187 22.217 -7.349 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -0.156 22.997 -4.855 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -1.437 23.403 -6.001 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.535 22.749 -8.813 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -1.049 23.264 -8.224 1.00 0.00 H new ATOM 267 N GLY A 17 4.935 22.041 -0.701 1.00 0.00 N ATOM 268 CA GLY A 17 5.979 21.864 0.296 1.00 0.00 C ATOM 269 C GLY A 17 5.971 20.432 0.815 1.00 0.00 C ATOM 270 O GLY A 17 7.028 19.820 0.976 1.00 0.00 O ATOM 0 H GLY A 17 4.249 22.761 -0.475 1.00 0.00 H new ATOM 0 HA2 GLY A 17 6.951 22.096 -0.139 1.00 0.00 H new ATOM 0 HA3 GLY A 17 5.826 22.559 1.122 1.00 0.00 H new ATOM 274 N CYS A 18 4.778 19.884 1.053 1.00 0.00 N ATOM 275 CA CYS A 18 4.679 18.509 1.524 1.00 0.00 C ATOM 276 C CYS A 18 5.099 17.581 0.410 1.00 0.00 C ATOM 277 O CYS A 18 5.662 16.518 0.653 1.00 0.00 O ATOM 278 CB CYS A 18 3.248 18.177 1.942 1.00 0.00 C ATOM 279 SG CYS A 18 3.271 17.247 3.495 1.00 0.00 S ATOM 0 H CYS A 18 3.886 20.363 0.929 1.00 0.00 H new ATOM 0 HA CYS A 18 5.329 18.386 2.390 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.672 19.094 2.064 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.757 17.593 1.164 1.00 0.00 H new ATOM 0 HG CYS A 18 3.236 18.075 4.497 1.00 0.00 H new ATOM 285 N LEU A 19 4.828 17.989 -0.820 1.00 0.00 N ATOM 286 CA LEU A 19 5.207 17.165 -1.953 1.00 0.00 C ATOM 287 C LEU A 19 6.723 17.027 -1.986 1.00 0.00 C ATOM 288 O LEU A 19 7.254 15.944 -2.235 1.00 0.00 O ATOM 289 CB LEU A 19 4.697 17.776 -3.259 1.00 0.00 C ATOM 290 CG LEU A 19 5.019 16.841 -4.432 1.00 0.00 C ATOM 291 CD1 LEU A 19 4.622 15.400 -4.086 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.246 17.297 -5.673 1.00 0.00 C ATOM 0 H LEU A 19 4.359 18.864 -1.055 1.00 0.00 H new ATOM 0 HA LEU A 19 4.756 16.179 -1.846 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.621 17.941 -3.198 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.160 18.750 -3.421 1.00 0.00 H new ATOM 0 HG LEU A 19 6.090 16.876 -4.630 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.856 14.746 -4.926 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.175 15.071 -3.206 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.553 15.357 -3.879 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.474 16.634 -6.508 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.176 17.267 -5.467 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.537 18.316 -5.929 1.00 0.00 H new ATOM 304 N ARG A 20 7.414 18.125 -1.693 1.00 0.00 N ATOM 305 CA ARG A 20 8.869 18.106 -1.650 1.00 0.00 C ATOM 306 C ARG A 20 9.305 17.315 -0.424 1.00 0.00 C ATOM 307 O ARG A 20 10.329 16.637 -0.430 1.00 0.00 O ATOM 308 CB ARG A 20 9.415 19.536 -1.587 1.00 0.00 C ATOM 309 CG ARG A 20 10.779 19.544 -0.909 1.00 0.00 C ATOM 310 CD ARG A 20 10.613 19.411 0.607 1.00 0.00 C ATOM 311 NE ARG A 20 11.260 20.530 1.284 1.00 0.00 N ATOM 312 CZ ARG A 20 10.935 20.862 2.528 1.00 0.00 C ATOM 313 NH1 ARG A 20 10.029 20.178 3.170 1.00 0.00 N ATOM 314 NH2 ARG A 20 11.524 21.872 3.107 1.00 0.00 N ATOM 0 H ARG A 20 6.993 19.030 -1.484 1.00 0.00 H new ATOM 0 HA ARG A 20 9.262 17.635 -2.551 1.00 0.00 H new ATOM 0 HB2 ARG A 20 9.498 19.947 -2.593 1.00 0.00 H new ATOM 0 HB3 ARG A 20 8.723 20.174 -1.038 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.388 18.724 -1.289 1.00 0.00 H new ATOM 0 HG3 ARG A 20 11.306 20.468 -1.145 1.00 0.00 H new ATOM 0 HD2 ARG A 20 9.554 19.384 0.863 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.047 18.471 0.947 1.00 0.00 H new ATOM 0 HE ARG A 20 11.975 21.067 0.793 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.570 19.388 2.717 1.00 0.00 H new ATOM 0 HH12 ARG A 20 9.779 20.433 4.126 1.00 0.00 H new ATOM 0 HH21 ARG A 20 12.233 22.406 2.604 1.00 0.00 H new ATOM 0 HH22 ARG A 20 11.275 22.128 4.062 1.00 0.00 H new ATOM 328 N SER A 21 8.485 17.400 0.616 1.00 0.00 N ATOM 329 CA SER A 21 8.729 16.684 1.862 1.00 0.00 C ATOM 330 C SER A 21 8.698 15.177 1.605 1.00 0.00 C ATOM 331 O SER A 21 9.674 14.465 1.881 1.00 0.00 O ATOM 332 CB SER A 21 7.642 17.122 2.848 1.00 0.00 C ATOM 333 OG SER A 21 7.497 18.534 2.765 1.00 0.00 O ATOM 0 H SER A 21 7.636 17.965 0.620 1.00 0.00 H new ATOM 0 HA SER A 21 9.711 16.912 2.277 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.698 16.630 2.613 1.00 0.00 H new ATOM 0 HB3 SER A 21 7.911 16.828 3.863 1.00 0.00 H new ATOM 0 HG SER A 21 7.140 18.775 1.885 1.00 0.00 H new ATOM 339 N LEU A 22 7.612 14.694 1.030 1.00 0.00 N ATOM 340 CA LEU A 22 7.509 13.279 0.721 1.00 0.00 C ATOM 341 C LEU A 22 8.609 12.872 -0.247 1.00 0.00 C ATOM 342 O LEU A 22 9.362 11.928 0.003 1.00 0.00 O ATOM 343 CB LEU A 22 6.161 12.982 0.078 1.00 0.00 C ATOM 344 CG LEU A 22 5.420 11.945 0.906 1.00 0.00 C ATOM 345 CD1 LEU A 22 4.880 12.587 2.174 1.00 0.00 C ATOM 346 CD2 LEU A 22 4.262 11.402 0.097 1.00 0.00 C ATOM 0 H LEU A 22 6.798 15.252 0.770 1.00 0.00 H new ATOM 0 HA LEU A 22 7.609 12.717 1.650 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.571 13.896 0.008 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.304 12.616 -0.939 1.00 0.00 H new ATOM 0 HG LEU A 22 6.104 11.139 1.171 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.350 11.839 2.763 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.707 12.990 2.758 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.195 13.393 1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.725 10.657 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.585 12.216 -0.162 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.640 10.941 -0.815 1.00 0.00 H new ATOM 358 N SER A 23 8.682 13.581 -1.367 1.00 0.00 N ATOM 359 CA SER A 23 9.678 13.265 -2.368 1.00 0.00 C ATOM 360 C SER A 23 11.071 13.288 -1.770 1.00 0.00 C ATOM 361 O SER A 23 11.946 12.534 -2.194 1.00 0.00 O ATOM 362 CB SER A 23 9.562 14.189 -3.571 1.00 0.00 C ATOM 363 OG SER A 23 10.862 14.567 -4.006 1.00 0.00 O ATOM 0 H SER A 23 8.072 14.365 -1.598 1.00 0.00 H new ATOM 0 HA SER A 23 9.492 12.252 -2.724 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.028 13.687 -4.378 1.00 0.00 H new ATOM 0 HB3 SER A 23 8.983 15.074 -3.308 1.00 0.00 H new ATOM 0 HG SER A 23 10.787 15.161 -4.782 1.00 0.00 H new ATOM 369 N LEU A 24 11.270 14.118 -0.757 1.00 0.00 N ATOM 370 CA LEU A 24 12.556 14.165 -0.098 1.00 0.00 C ATOM 371 C LEU A 24 12.878 12.774 0.430 1.00 0.00 C ATOM 372 O LEU A 24 14.039 12.366 0.470 1.00 0.00 O ATOM 373 CB LEU A 24 12.526 15.168 1.046 1.00 0.00 C ATOM 374 CG LEU A 24 13.534 16.286 0.775 1.00 0.00 C ATOM 375 CD1 LEU A 24 14.957 15.740 0.911 1.00 0.00 C ATOM 376 CD2 LEU A 24 13.339 16.842 -0.640 1.00 0.00 C ATOM 0 H LEU A 24 10.568 14.756 -0.382 1.00 0.00 H new ATOM 0 HA LEU A 24 13.323 14.481 -0.805 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.524 15.585 1.151 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.764 14.670 1.986 1.00 0.00 H new ATOM 0 HG LEU A 24 13.376 17.085 1.499 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.673 16.539 0.717 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.105 15.357 1.921 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.108 14.935 0.192 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.062 17.637 -0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.487 16.044 -1.368 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.329 17.241 -0.738 1.00 0.00 H new ATOM 388 N ILE A 25 11.834 12.041 0.825 1.00 0.00 N ATOM 389 CA ILE A 25 12.031 10.685 1.335 1.00 0.00 C ATOM 390 C ILE A 25 11.347 9.625 0.466 1.00 0.00 C ATOM 391 O ILE A 25 11.070 8.522 0.938 1.00 0.00 O ATOM 392 CB ILE A 25 11.513 10.558 2.763 1.00 0.00 C ATOM 393 CG1 ILE A 25 12.167 9.333 3.409 1.00 0.00 C ATOM 394 CG2 ILE A 25 10.009 10.336 2.743 1.00 0.00 C ATOM 395 CD1 ILE A 25 13.068 9.768 4.565 1.00 0.00 C ATOM 0 H ILE A 25 10.864 12.356 0.802 1.00 0.00 H new ATOM 0 HA ILE A 25 13.106 10.507 1.311 1.00 0.00 H new ATOM 0 HB ILE A 25 11.747 11.466 3.319 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.399 8.650 3.773 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.751 8.789 2.667 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.641 10.245 3.765 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.523 11.181 2.256 1.00 0.00 H new ATOM 0 HG23 ILE A 25 9.783 9.422 2.194 1.00 0.00 H new ATOM 0 HD11 ILE A 25 13.528 8.890 5.018 1.00 0.00 H new ATOM 0 HD12 ILE A 25 13.846 10.433 4.190 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.473 10.292 5.313 1.00 0.00 H new ATOM 407 N ILE A 26 11.076 9.950 -0.791 1.00 0.00 N ATOM 408 CA ILE A 26 10.433 9.017 -1.690 1.00 0.00 C ATOM 409 C ILE A 26 11.335 7.810 -1.950 1.00 0.00 C ATOM 410 O ILE A 26 12.509 7.968 -2.286 1.00 0.00 O ATOM 411 CB ILE A 26 10.139 9.745 -3.009 1.00 0.00 C ATOM 412 CG1 ILE A 26 8.658 10.105 -3.101 1.00 0.00 C ATOM 413 CG2 ILE A 26 10.502 8.868 -4.189 1.00 0.00 C ATOM 414 CD1 ILE A 26 7.857 8.865 -3.416 1.00 0.00 C ATOM 0 H ILE A 26 11.294 10.856 -1.206 1.00 0.00 H new ATOM 0 HA ILE A 26 9.508 8.655 -1.242 1.00 0.00 H new ATOM 0 HB ILE A 26 10.739 10.655 -3.031 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.320 10.540 -2.161 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.503 10.857 -3.875 1.00 0.00 H new ATOM 0 HG21 ILE A 26 10.287 9.399 -5.116 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.563 8.624 -4.148 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.917 7.949 -4.153 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.800 9.122 -3.482 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.189 8.449 -4.367 1.00 0.00 H new ATOM 0 HD13 ILE A 26 8.003 8.127 -2.627 1.00 0.00 H new ATOM 426 N LYS A 27 10.779 6.608 -1.828 1.00 0.00 N ATOM 427 CA LYS A 27 11.562 5.403 -2.095 1.00 0.00 C ATOM 428 C LYS A 27 10.906 4.594 -3.213 1.00 0.00 C ATOM 429 O LYS A 27 9.710 4.734 -3.471 1.00 0.00 O ATOM 430 CB LYS A 27 11.710 4.542 -0.832 1.00 0.00 C ATOM 431 CG LYS A 27 12.063 5.430 0.365 1.00 0.00 C ATOM 432 CD LYS A 27 13.581 5.454 0.553 1.00 0.00 C ATOM 433 CE LYS A 27 13.984 6.720 1.311 1.00 0.00 C ATOM 434 NZ LYS A 27 13.619 7.920 0.505 1.00 0.00 N ATOM 0 H LYS A 27 9.811 6.442 -1.552 1.00 0.00 H new ATOM 0 HA LYS A 27 12.560 5.708 -2.409 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.782 4.005 -0.636 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.487 3.792 -0.981 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.690 6.441 0.203 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.580 5.052 1.266 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.903 4.570 1.103 1.00 0.00 H new ATOM 0 HD3 LYS A 27 14.078 5.425 -0.417 1.00 0.00 H new ATOM 0 HE2 LYS A 27 13.483 6.752 2.278 1.00 0.00 H new ATOM 0 HE3 LYS A 27 15.056 6.713 1.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 14.285 8.692 0.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 13.663 7.685 -0.507 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 12.654 8.221 0.749 1.00 0.00 H new ATOM 448 N THR A 28 11.691 3.759 -3.885 1.00 0.00 N ATOM 449 CA THR A 28 11.157 2.952 -4.978 1.00 0.00 C ATOM 450 C THR A 28 11.579 1.490 -4.849 1.00 0.00 C ATOM 451 O THR A 28 12.701 1.188 -4.443 1.00 0.00 O ATOM 452 CB THR A 28 11.643 3.508 -6.319 1.00 0.00 C ATOM 453 OG1 THR A 28 13.049 3.333 -6.420 1.00 0.00 O ATOM 454 CG2 THR A 28 11.304 4.996 -6.410 1.00 0.00 C ATOM 0 H THR A 28 12.684 3.623 -3.697 1.00 0.00 H new ATOM 0 HA THR A 28 10.069 2.999 -4.930 1.00 0.00 H new ATOM 0 HB THR A 28 11.151 2.976 -7.133 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.362 3.687 -7.279 1.00 0.00 H new ATOM 0 HG21 THR A 28 11.651 5.390 -7.365 1.00 0.00 H new ATOM 0 HG22 THR A 28 10.225 5.129 -6.333 1.00 0.00 H new ATOM 0 HG23 THR A 28 11.794 5.531 -5.597 1.00 0.00 H new ATOM 462 N SER A 29 10.667 0.590 -5.210 1.00 0.00 N ATOM 463 CA SER A 29 10.937 -0.843 -5.151 1.00 0.00 C ATOM 464 C SER A 29 10.440 -1.515 -6.431 1.00 0.00 C ATOM 465 O SER A 29 9.423 -1.112 -6.994 1.00 0.00 O ATOM 466 CB SER A 29 10.239 -1.457 -3.935 1.00 0.00 C ATOM 467 OG SER A 29 8.937 -0.899 -3.814 1.00 0.00 O ATOM 0 H SER A 29 9.734 0.829 -5.547 1.00 0.00 H new ATOM 0 HA SER A 29 12.012 -1.000 -5.058 1.00 0.00 H new ATOM 0 HB2 SER A 29 10.175 -2.540 -4.045 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.817 -1.262 -3.032 1.00 0.00 H new ATOM 0 HG SER A 29 8.929 -0.243 -3.086 1.00 0.00 H new ATOM 473 N PHE A 30 11.164 -2.525 -6.902 1.00 0.00 N ATOM 474 CA PHE A 30 10.769 -3.209 -8.132 1.00 0.00 C ATOM 475 C PHE A 30 10.799 -4.728 -7.973 1.00 0.00 C ATOM 476 O PHE A 30 11.680 -5.279 -7.315 1.00 0.00 O ATOM 477 CB PHE A 30 11.702 -2.798 -9.271 1.00 0.00 C ATOM 478 CG PHE A 30 13.022 -2.336 -8.702 1.00 0.00 C ATOM 479 CD1 PHE A 30 13.138 -1.054 -8.151 1.00 0.00 C ATOM 480 CD2 PHE A 30 14.131 -3.188 -8.730 1.00 0.00 C ATOM 481 CE1 PHE A 30 14.363 -0.626 -7.626 1.00 0.00 C ATOM 482 CE2 PHE A 30 15.356 -2.761 -8.207 1.00 0.00 C ATOM 483 CZ PHE A 30 15.473 -1.480 -7.653 1.00 0.00 C ATOM 0 H PHE A 30 12.011 -2.884 -6.462 1.00 0.00 H new ATOM 0 HA PHE A 30 9.744 -2.916 -8.360 1.00 0.00 H new ATOM 0 HB2 PHE A 30 11.860 -3.639 -9.947 1.00 0.00 H new ATOM 0 HB3 PHE A 30 11.247 -1.999 -9.857 1.00 0.00 H new ATOM 0 HD1 PHE A 30 12.282 -0.395 -8.131 1.00 0.00 H new ATOM 0 HD2 PHE A 30 14.041 -4.176 -9.156 1.00 0.00 H new ATOM 0 HE1 PHE A 30 14.452 0.362 -7.200 1.00 0.00 H new ATOM 0 HE2 PHE A 30 16.212 -3.419 -8.230 1.00 0.00 H new ATOM 0 HZ PHE A 30 16.418 -1.151 -7.247 1.00 0.00 H new ATOM 493 N CYS A 31 9.829 -5.398 -8.599 1.00 0.00 N ATOM 494 CA CYS A 31 9.751 -6.857 -8.541 1.00 0.00 C ATOM 495 C CYS A 31 9.706 -7.450 -9.947 1.00 0.00 C ATOM 496 O CYS A 31 9.261 -6.801 -10.894 1.00 0.00 O ATOM 497 CB CYS A 31 8.511 -7.301 -7.766 1.00 0.00 C ATOM 498 SG CYS A 31 8.447 -6.435 -6.178 1.00 0.00 S ATOM 0 H CYS A 31 9.092 -4.956 -9.148 1.00 0.00 H new ATOM 0 HA CYS A 31 10.642 -7.218 -8.028 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.612 -7.088 -8.345 1.00 0.00 H new ATOM 0 HB3 CYS A 31 8.537 -8.379 -7.604 1.00 0.00 H new ATOM 0 HG CYS A 31 7.220 -6.094 -5.919 1.00 0.00 H new ATOM 504 N ALA A 32 10.184 -8.682 -10.074 1.00 0.00 N ATOM 505 CA ALA A 32 10.212 -9.361 -11.365 1.00 0.00 C ATOM 506 C ALA A 32 9.228 -10.531 -11.393 1.00 0.00 C ATOM 507 O ALA A 32 8.677 -10.910 -10.359 1.00 0.00 O ATOM 508 CB ALA A 32 11.625 -9.887 -11.616 1.00 0.00 C ATOM 0 H ALA A 32 10.557 -9.231 -9.300 1.00 0.00 H new ATOM 0 HA ALA A 32 9.923 -8.651 -12.140 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.658 -10.397 -12.579 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.328 -9.054 -11.622 1.00 0.00 H new ATOM 0 HB3 ALA A 32 11.899 -10.586 -10.826 1.00 0.00 H new ATOM 514 N PRO A 33 9.012 -11.125 -12.544 1.00 0.00 N ATOM 515 CA PRO A 33 8.096 -12.295 -12.675 1.00 0.00 C ATOM 516 C PRO A 33 8.606 -13.477 -11.854 1.00 0.00 C ATOM 517 O PRO A 33 9.752 -13.897 -12.008 1.00 0.00 O ATOM 518 CB PRO A 33 8.106 -12.628 -14.173 1.00 0.00 C ATOM 519 CG PRO A 33 8.700 -11.440 -14.857 1.00 0.00 C ATOM 520 CD PRO A 33 9.604 -10.750 -13.838 1.00 0.00 C ATOM 0 HA PRO A 33 7.093 -12.078 -12.307 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.694 -13.525 -14.369 1.00 0.00 H new ATOM 0 HB3 PRO A 33 7.097 -12.823 -14.536 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.269 -11.744 -15.735 1.00 0.00 H new ATOM 0 HG3 PRO A 33 7.919 -10.762 -15.202 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.636 -11.091 -13.921 1.00 0.00 H new ATOM 0 HD3 PRO A 33 9.613 -9.669 -13.977 1.00 0.00 H new ATOM 528 N GLY A 34 7.761 -14.002 -10.976 1.00 0.00 N ATOM 529 CA GLY A 34 8.162 -15.123 -10.138 1.00 0.00 C ATOM 530 C GLY A 34 9.171 -14.665 -9.089 1.00 0.00 C ATOM 531 O GLY A 34 9.708 -15.475 -8.332 1.00 0.00 O ATOM 0 H GLY A 34 6.806 -13.675 -10.827 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.287 -15.551 -9.649 1.00 0.00 H new ATOM 0 HA3 GLY A 34 8.599 -15.909 -10.754 1.00 0.00 H new ATOM 535 N GLU A 35 9.436 -13.358 -9.061 1.00 0.00 N ATOM 536 CA GLU A 35 10.399 -12.801 -8.112 1.00 0.00 C ATOM 537 C GLU A 35 9.816 -12.749 -6.705 1.00 0.00 C ATOM 538 O GLU A 35 8.728 -12.225 -6.495 1.00 0.00 O ATOM 539 CB GLU A 35 10.812 -11.404 -8.552 1.00 0.00 C ATOM 540 CG GLU A 35 12.272 -11.172 -8.184 1.00 0.00 C ATOM 541 CD GLU A 35 13.183 -11.725 -9.275 1.00 0.00 C ATOM 542 OE1 GLU A 35 12.691 -12.465 -10.111 1.00 0.00 O ATOM 543 OE2 GLU A 35 14.359 -11.402 -9.257 1.00 0.00 O ATOM 0 H GLU A 35 9.002 -12.672 -9.678 1.00 0.00 H new ATOM 0 HA GLU A 35 11.274 -13.450 -8.095 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.674 -11.293 -9.628 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.181 -10.657 -8.071 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.456 -10.106 -8.051 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.496 -11.655 -7.233 1.00 0.00 H new ATOM 550 N PHE A 36 10.554 -13.302 -5.746 1.00 0.00 N ATOM 551 CA PHE A 36 10.104 -13.328 -4.353 1.00 0.00 C ATOM 552 C PHE A 36 10.544 -12.075 -3.598 1.00 0.00 C ATOM 553 O PHE A 36 11.736 -11.838 -3.406 1.00 0.00 O ATOM 554 CB PHE A 36 10.665 -14.570 -3.657 1.00 0.00 C ATOM 555 CG PHE A 36 10.706 -15.720 -4.635 1.00 0.00 C ATOM 556 CD1 PHE A 36 9.567 -16.507 -4.839 1.00 0.00 C ATOM 557 CD2 PHE A 36 11.885 -15.998 -5.340 1.00 0.00 C ATOM 558 CE1 PHE A 36 9.605 -17.572 -5.747 1.00 0.00 C ATOM 559 CE2 PHE A 36 11.922 -17.064 -6.248 1.00 0.00 C ATOM 560 CZ PHE A 36 10.782 -17.851 -6.451 1.00 0.00 C ATOM 0 H PHE A 36 11.463 -13.737 -5.905 1.00 0.00 H new ATOM 0 HA PHE A 36 9.014 -13.358 -4.350 1.00 0.00 H new ATOM 0 HB2 PHE A 36 11.666 -14.366 -3.277 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.045 -14.830 -2.799 1.00 0.00 H new ATOM 0 HD1 PHE A 36 8.658 -16.293 -4.296 1.00 0.00 H new ATOM 0 HD2 PHE A 36 12.764 -15.391 -5.183 1.00 0.00 H new ATOM 0 HE1 PHE A 36 8.725 -18.179 -5.904 1.00 0.00 H new ATOM 0 HE2 PHE A 36 12.830 -17.279 -6.792 1.00 0.00 H new ATOM 0 HZ PHE A 36 10.811 -18.673 -7.151 1.00 0.00 H new ATOM 570 N LEU A 37 9.565 -11.280 -3.172 1.00 0.00 N ATOM 571 CA LEU A 37 9.846 -10.052 -2.435 1.00 0.00 C ATOM 572 C LEU A 37 9.825 -10.287 -0.922 1.00 0.00 C ATOM 573 O LEU A 37 10.734 -9.856 -0.213 1.00 0.00 O ATOM 574 CB LEU A 37 8.815 -8.983 -2.794 1.00 0.00 C ATOM 575 CG LEU A 37 9.486 -7.612 -2.832 1.00 0.00 C ATOM 576 CD1 LEU A 37 10.525 -7.579 -3.953 1.00 0.00 C ATOM 577 CD2 LEU A 37 8.423 -6.544 -3.091 1.00 0.00 C ATOM 0 H LEU A 37 8.573 -11.464 -3.324 1.00 0.00 H new ATOM 0 HA LEU A 37 10.845 -9.717 -2.716 1.00 0.00 H new ATOM 0 HB2 LEU A 37 8.368 -9.206 -3.763 1.00 0.00 H new ATOM 0 HB3 LEU A 37 8.007 -8.983 -2.062 1.00 0.00 H new ATOM 0 HG LEU A 37 9.980 -7.419 -1.880 1.00 0.00 H new ATOM 0 HD11 LEU A 37 11.002 -6.599 -3.978 1.00 0.00 H new ATOM 0 HD12 LEU A 37 11.279 -8.346 -3.773 1.00 0.00 H new ATOM 0 HD13 LEU A 37 10.036 -7.769 -4.908 1.00 0.00 H new ATOM 0 HD21 LEU A 37 8.894 -5.561 -3.120 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.935 -6.740 -4.046 1.00 0.00 H new ATOM 0 HD23 LEU A 37 7.681 -6.568 -2.293 1.00 0.00 H new ATOM 589 N ILE A 38 8.782 -10.961 -0.426 1.00 0.00 N ATOM 590 CA ILE A 38 8.673 -11.220 0.998 1.00 0.00 C ATOM 591 C ILE A 38 8.517 -12.701 1.277 1.00 0.00 C ATOM 592 O ILE A 38 8.051 -13.468 0.439 1.00 0.00 O ATOM 593 CB ILE A 38 7.492 -10.442 1.606 1.00 0.00 C ATOM 594 CG1 ILE A 38 7.920 -9.756 2.897 1.00 0.00 C ATOM 595 CG2 ILE A 38 6.357 -11.389 1.952 1.00 0.00 C ATOM 596 CD1 ILE A 38 8.033 -8.257 2.638 1.00 0.00 C ATOM 0 H ILE A 38 8.015 -11.330 -0.988 1.00 0.00 H new ATOM 0 HA ILE A 38 9.597 -10.879 1.465 1.00 0.00 H new ATOM 0 HB ILE A 38 7.167 -9.707 0.870 1.00 0.00 H new ATOM 0 HG12 ILE A 38 7.194 -9.950 3.687 1.00 0.00 H new ATOM 0 HG13 ILE A 38 8.876 -10.154 3.238 1.00 0.00 H new ATOM 0 HG21 ILE A 38 5.530 -10.824 2.381 1.00 0.00 H new ATOM 0 HG22 ILE A 38 6.020 -11.898 1.049 1.00 0.00 H new ATOM 0 HG23 ILE A 38 6.706 -12.126 2.675 1.00 0.00 H new ATOM 0 HD11 ILE A 38 8.339 -7.752 3.554 1.00 0.00 H new ATOM 0 HD12 ILE A 38 8.774 -8.077 1.859 1.00 0.00 H new ATOM 0 HD13 ILE A 38 7.067 -7.870 2.315 1.00 0.00 H new ATOM 608 N ARG A 39 8.906 -13.086 2.475 1.00 0.00 N ATOM 609 CA ARG A 39 8.798 -14.465 2.887 1.00 0.00 C ATOM 610 C ARG A 39 8.162 -14.552 4.273 1.00 0.00 C ATOM 611 O ARG A 39 8.795 -14.224 5.275 1.00 0.00 O ATOM 612 CB ARG A 39 10.180 -15.085 2.897 1.00 0.00 C ATOM 613 CG ARG A 39 10.094 -16.535 3.345 1.00 0.00 C ATOM 614 CD ARG A 39 9.412 -17.351 2.252 1.00 0.00 C ATOM 615 NE ARG A 39 10.230 -18.507 1.905 1.00 0.00 N ATOM 616 CZ ARG A 39 9.851 -19.365 0.965 1.00 0.00 C ATOM 617 NH1 ARG A 39 8.728 -19.181 0.326 1.00 0.00 N ATOM 618 NH2 ARG A 39 10.602 -20.394 0.679 1.00 0.00 N ATOM 0 H ARG A 39 9.300 -12.461 3.179 1.00 0.00 H new ATOM 0 HA ARG A 39 8.163 -15.009 2.188 1.00 0.00 H new ATOM 0 HB2 ARG A 39 10.621 -15.028 1.902 1.00 0.00 H new ATOM 0 HB3 ARG A 39 10.834 -14.527 3.567 1.00 0.00 H new ATOM 0 HG2 ARG A 39 11.091 -16.928 3.542 1.00 0.00 H new ATOM 0 HG3 ARG A 39 9.532 -16.609 4.276 1.00 0.00 H new ATOM 0 HD2 ARG A 39 8.430 -17.680 2.592 1.00 0.00 H new ATOM 0 HD3 ARG A 39 9.253 -16.731 1.370 1.00 0.00 H new ATOM 0 HE ARG A 39 11.112 -18.660 2.394 1.00 0.00 H new ATOM 0 HH11 ARG A 39 8.140 -18.377 0.548 1.00 0.00 H new ATOM 0 HH12 ARG A 39 8.438 -19.841 -0.396 1.00 0.00 H new ATOM 0 HH21 ARG A 39 11.480 -20.539 1.178 1.00 0.00 H new ATOM 0 HH22 ARG A 39 10.311 -21.053 -0.043 1.00 0.00 H new ATOM 632 N GLN A 40 6.911 -14.990 4.305 1.00 0.00 N ATOM 633 CA GLN A 40 6.156 -15.130 5.555 1.00 0.00 C ATOM 634 C GLN A 40 7.028 -14.884 6.784 1.00 0.00 C ATOM 635 O GLN A 40 8.089 -15.488 6.939 1.00 0.00 O ATOM 636 CB GLN A 40 5.558 -16.541 5.627 1.00 0.00 C ATOM 637 CG GLN A 40 5.406 -16.984 7.087 1.00 0.00 C ATOM 638 CD GLN A 40 4.300 -18.026 7.201 1.00 0.00 C ATOM 639 OE1 GLN A 40 4.611 -19.273 7.431 1.00 0.00 O flip ATOM 640 NE2 GLN A 40 3.121 -17.697 7.073 1.00 0.00 N flip ATOM 0 H GLN A 40 6.387 -15.259 3.472 1.00 0.00 H new ATOM 0 HA GLN A 40 5.367 -14.378 5.555 1.00 0.00 H new ATOM 0 HB2 GLN A 40 4.587 -16.557 5.133 1.00 0.00 H new ATOM 0 HB3 GLN A 40 6.199 -17.242 5.093 1.00 0.00 H new ATOM 0 HG2 GLN A 40 6.347 -17.398 7.450 1.00 0.00 H new ATOM 0 HG3 GLN A 40 5.173 -16.124 7.715 1.00 0.00 H new ATOM 0 HE21 GLN A 40 2.880 -16.722 6.893 1.00 0.00 H new ATOM 0 HE22 GLN A 40 2.385 -18.399 7.147 1.00 0.00 H new ATOM 649 N GLY A 41 6.554 -14.004 7.664 1.00 0.00 N ATOM 650 CA GLY A 41 7.281 -13.692 8.888 1.00 0.00 C ATOM 651 C GLY A 41 8.303 -12.587 8.661 1.00 0.00 C ATOM 652 O GLY A 41 9.110 -12.285 9.540 1.00 0.00 O ATOM 0 H GLY A 41 5.675 -13.498 7.552 1.00 0.00 H new ATOM 0 HA2 GLY A 41 6.578 -13.386 9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 41 7.786 -14.587 9.251 1.00 0.00 H new ATOM 656 N ASP A 42 8.268 -11.989 7.477 1.00 0.00 N ATOM 657 CA ASP A 42 9.204 -10.919 7.155 1.00 0.00 C ATOM 658 C ASP A 42 8.896 -9.674 7.976 1.00 0.00 C ATOM 659 O ASP A 42 7.993 -9.678 8.812 1.00 0.00 O ATOM 660 CB ASP A 42 9.131 -10.581 5.668 1.00 0.00 C ATOM 661 CG ASP A 42 10.336 -11.170 4.941 1.00 0.00 C ATOM 662 OD1 ASP A 42 11.379 -10.538 4.959 1.00 0.00 O ATOM 663 OD2 ASP A 42 10.197 -12.243 4.380 1.00 0.00 O ATOM 0 H ASP A 42 7.611 -12.222 6.732 1.00 0.00 H new ATOM 0 HA ASP A 42 10.210 -11.263 7.396 1.00 0.00 H new ATOM 0 HB2 ASP A 42 8.209 -10.976 5.241 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.107 -9.500 5.533 1.00 0.00 H new ATOM 668 N ALA A 43 9.656 -8.614 7.735 1.00 0.00 N ATOM 669 CA ALA A 43 9.459 -7.369 8.461 1.00 0.00 C ATOM 670 C ALA A 43 9.001 -6.258 7.521 1.00 0.00 C ATOM 671 O ALA A 43 9.754 -5.814 6.655 1.00 0.00 O ATOM 672 CB ALA A 43 10.765 -6.956 9.137 1.00 0.00 C ATOM 0 H ALA A 43 10.409 -8.592 7.047 1.00 0.00 H new ATOM 0 HA ALA A 43 8.687 -7.529 9.214 1.00 0.00 H new ATOM 0 HB1 ALA A 43 10.614 -6.023 9.680 1.00 0.00 H new ATOM 0 HB2 ALA A 43 11.077 -7.735 9.833 1.00 0.00 H new ATOM 0 HB3 ALA A 43 11.537 -6.815 8.381 1.00 0.00 H new ATOM 678 N LEU A 44 7.763 -5.814 7.703 1.00 0.00 N ATOM 679 CA LEU A 44 7.209 -4.751 6.874 1.00 0.00 C ATOM 680 C LEU A 44 7.412 -3.394 7.539 1.00 0.00 C ATOM 681 O LEU A 44 6.987 -3.179 8.674 1.00 0.00 O ATOM 682 CB LEU A 44 5.718 -4.987 6.649 1.00 0.00 C ATOM 683 CG LEU A 44 5.248 -4.132 5.470 1.00 0.00 C ATOM 684 CD1 LEU A 44 4.764 -5.037 4.341 1.00 0.00 C ATOM 685 CD2 LEU A 44 4.107 -3.225 5.926 1.00 0.00 C ATOM 0 H LEU A 44 7.126 -6.172 8.415 1.00 0.00 H new ATOM 0 HA LEU A 44 7.727 -4.758 5.915 1.00 0.00 H new ATOM 0 HB2 LEU A 44 5.531 -6.042 6.447 1.00 0.00 H new ATOM 0 HB3 LEU A 44 5.157 -4.730 7.547 1.00 0.00 H new ATOM 0 HG LEU A 44 6.076 -3.522 5.110 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.430 -4.426 3.503 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.580 -5.683 4.017 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.936 -5.650 4.696 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.770 -2.615 5.088 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.279 -3.835 6.286 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.456 -2.577 6.730 1.00 0.00 H new ATOM 697 N GLN A 45 8.067 -2.482 6.829 1.00 0.00 N ATOM 698 CA GLN A 45 8.322 -1.152 7.369 1.00 0.00 C ATOM 699 C GLN A 45 7.793 -0.070 6.431 1.00 0.00 C ATOM 700 O GLN A 45 7.404 1.010 6.875 1.00 0.00 O ATOM 701 CB GLN A 45 9.824 -0.957 7.580 1.00 0.00 C ATOM 702 CG GLN A 45 10.186 -1.311 9.024 1.00 0.00 C ATOM 703 CD GLN A 45 11.682 -1.583 9.136 1.00 0.00 C ATOM 704 OE1 GLN A 45 12.487 -0.652 9.127 1.00 0.00 O ATOM 705 NE2 GLN A 45 12.107 -2.813 9.245 1.00 0.00 N ATOM 0 H GLN A 45 8.428 -2.637 5.888 1.00 0.00 H new ATOM 0 HA GLN A 45 7.803 -1.066 8.324 1.00 0.00 H new ATOM 0 HB2 GLN A 45 10.384 -1.587 6.889 1.00 0.00 H new ATOM 0 HB3 GLN A 45 10.101 0.075 7.367 1.00 0.00 H new ATOM 0 HG2 GLN A 45 9.906 -0.493 9.688 1.00 0.00 H new ATOM 0 HG3 GLN A 45 9.624 -2.188 9.344 1.00 0.00 H new ATOM 0 HE21 GLN A 45 11.440 -3.584 9.252 1.00 0.00 H new ATOM 0 HE22 GLN A 45 13.106 -3.002 9.323 1.00 0.00 H new ATOM 714 N ALA A 46 7.792 -0.359 5.133 1.00 0.00 N ATOM 715 CA ALA A 46 7.319 0.609 4.150 1.00 0.00 C ATOM 716 C ALA A 46 6.085 0.094 3.414 1.00 0.00 C ATOM 717 O ALA A 46 5.804 -1.104 3.406 1.00 0.00 O ATOM 718 CB ALA A 46 8.429 0.904 3.139 1.00 0.00 C ATOM 0 H ALA A 46 8.110 -1.245 4.741 1.00 0.00 H new ATOM 0 HA ALA A 46 7.047 1.522 4.680 1.00 0.00 H new ATOM 0 HB1 ALA A 46 8.071 1.628 2.407 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.296 1.312 3.659 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.712 -0.017 2.630 1.00 0.00 H new ATOM 724 N ILE A 47 5.358 1.016 2.786 1.00 0.00 N ATOM 725 CA ILE A 47 4.158 0.662 2.032 1.00 0.00 C ATOM 726 C ILE A 47 4.456 0.719 0.538 1.00 0.00 C ATOM 727 O ILE A 47 5.151 1.623 0.080 1.00 0.00 O ATOM 728 CB ILE A 47 3.020 1.629 2.370 1.00 0.00 C ATOM 729 CG1 ILE A 47 1.888 1.466 1.352 1.00 0.00 C ATOM 730 CG2 ILE A 47 3.536 3.069 2.325 1.00 0.00 C ATOM 731 CD1 ILE A 47 0.548 1.396 2.085 1.00 0.00 C ATOM 0 H ILE A 47 5.579 2.012 2.784 1.00 0.00 H new ATOM 0 HA ILE A 47 3.854 -0.349 2.302 1.00 0.00 H new ATOM 0 HB ILE A 47 2.647 1.407 3.370 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.889 2.303 0.654 1.00 0.00 H new ATOM 0 HG13 ILE A 47 2.041 0.561 0.764 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.723 3.754 2.566 1.00 0.00 H new ATOM 0 HG22 ILE A 47 4.340 3.190 3.051 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.912 3.290 1.326 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.258 1.280 1.360 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.549 0.544 2.765 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.396 2.314 2.653 1.00 0.00 H new ATOM 743 N TYR A 48 3.936 -0.249 -0.216 1.00 0.00 N ATOM 744 CA TYR A 48 4.180 -0.288 -1.662 1.00 0.00 C ATOM 745 C TYR A 48 2.901 -0.077 -2.464 1.00 0.00 C ATOM 746 O TYR A 48 1.803 -0.383 -2.006 1.00 0.00 O ATOM 747 CB TYR A 48 4.767 -1.641 -2.098 1.00 0.00 C ATOM 748 CG TYR A 48 5.900 -2.079 -1.198 1.00 0.00 C ATOM 749 CD1 TYR A 48 5.668 -2.347 0.155 1.00 0.00 C ATOM 750 CD2 TYR A 48 7.184 -2.240 -1.731 1.00 0.00 C ATOM 751 CE1 TYR A 48 6.718 -2.775 0.976 1.00 0.00 C ATOM 752 CE2 TYR A 48 8.235 -2.666 -0.911 1.00 0.00 C ATOM 753 CZ TYR A 48 8.003 -2.934 0.442 1.00 0.00 C ATOM 754 OH TYR A 48 9.038 -3.355 1.251 1.00 0.00 O ATOM 0 H TYR A 48 3.352 -1.006 0.140 1.00 0.00 H new ATOM 0 HA TYR A 48 4.885 0.519 -1.861 1.00 0.00 H new ATOM 0 HB2 TYR A 48 3.982 -2.397 -2.088 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.126 -1.567 -3.124 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.677 -2.224 0.567 1.00 0.00 H new ATOM 0 HD2 TYR A 48 7.364 -2.035 -2.776 1.00 0.00 H new ATOM 0 HE1 TYR A 48 6.537 -2.982 2.020 1.00 0.00 H new ATOM 0 HE2 TYR A 48 9.226 -2.788 -1.323 1.00 0.00 H new ATOM 0 HH TYR A 48 9.862 -3.414 0.724 1.00 0.00 H new ATOM 764 N PHE A 49 3.084 0.406 -3.690 1.00 0.00 N ATOM 765 CA PHE A 49 1.983 0.625 -4.625 1.00 0.00 C ATOM 766 C PHE A 49 2.364 -0.018 -5.949 1.00 0.00 C ATOM 767 O PHE A 49 3.520 0.059 -6.365 1.00 0.00 O ATOM 768 CB PHE A 49 1.768 2.117 -4.879 1.00 0.00 C ATOM 769 CG PHE A 49 0.293 2.461 -4.930 1.00 0.00 C ATOM 770 CD1 PHE A 49 -0.518 2.048 -6.009 1.00 0.00 C ATOM 771 CD2 PHE A 49 -0.261 3.237 -3.907 1.00 0.00 C ATOM 772 CE1 PHE A 49 -1.868 2.412 -6.045 1.00 0.00 C ATOM 773 CE2 PHE A 49 -1.614 3.592 -3.946 1.00 0.00 C ATOM 774 CZ PHE A 49 -2.416 3.180 -5.015 1.00 0.00 C ATOM 0 H PHE A 49 3.999 0.657 -4.064 1.00 0.00 H new ATOM 0 HA PHE A 49 1.071 0.199 -4.206 1.00 0.00 H new ATOM 0 HB2 PHE A 49 2.251 2.695 -4.091 1.00 0.00 H new ATOM 0 HB3 PHE A 49 2.242 2.400 -5.819 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.097 1.452 -6.805 1.00 0.00 H new ATOM 0 HD2 PHE A 49 0.358 3.563 -3.084 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.488 2.098 -6.871 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.039 4.185 -3.150 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.460 3.456 -5.044 1.00 0.00 H new ATOM 784 N VAL A 50 1.414 -0.631 -6.618 1.00 0.00 N ATOM 785 CA VAL A 50 1.698 -1.245 -7.886 1.00 0.00 C ATOM 786 C VAL A 50 1.170 -0.345 -9.005 1.00 0.00 C ATOM 787 O VAL A 50 0.016 0.080 -8.972 1.00 0.00 O ATOM 788 CB VAL A 50 1.064 -2.630 -7.883 1.00 0.00 C ATOM 789 CG1 VAL A 50 0.347 -2.863 -9.186 1.00 0.00 C ATOM 790 CG2 VAL A 50 2.139 -3.701 -7.685 1.00 0.00 C ATOM 0 H VAL A 50 0.447 -0.715 -6.305 1.00 0.00 H new ATOM 0 HA VAL A 50 2.768 -1.363 -8.057 1.00 0.00 H new ATOM 0 HB VAL A 50 0.350 -2.691 -7.062 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.105 -3.855 -9.180 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.431 -2.110 -9.313 1.00 0.00 H new ATOM 0 HG13 VAL A 50 1.057 -2.793 -10.010 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.674 -4.687 -7.684 1.00 0.00 H new ATOM 0 HG22 VAL A 50 2.865 -3.642 -8.496 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.644 -3.538 -6.733 1.00 0.00 H new ATOM 800 N CYS A 51 2.021 -0.034 -9.976 1.00 0.00 N ATOM 801 CA CYS A 51 1.615 0.841 -11.074 1.00 0.00 C ATOM 802 C CYS A 51 1.238 0.032 -12.310 1.00 0.00 C ATOM 803 O CYS A 51 0.369 0.431 -13.086 1.00 0.00 O ATOM 804 CB CYS A 51 2.753 1.803 -11.422 1.00 0.00 C ATOM 805 SG CYS A 51 2.817 3.131 -10.194 1.00 0.00 S ATOM 0 H CYS A 51 2.983 -0.368 -10.028 1.00 0.00 H new ATOM 0 HA CYS A 51 0.741 1.406 -10.750 1.00 0.00 H new ATOM 0 HB2 CYS A 51 3.702 1.268 -11.444 1.00 0.00 H new ATOM 0 HB3 CYS A 51 2.599 2.220 -12.417 1.00 0.00 H new ATOM 0 HG CYS A 51 3.785 3.947 -10.488 1.00 0.00 H new ATOM 811 N SER A 52 1.897 -1.104 -12.489 1.00 0.00 N ATOM 812 CA SER A 52 1.626 -1.964 -13.634 1.00 0.00 C ATOM 813 C SER A 52 2.353 -3.289 -13.472 1.00 0.00 C ATOM 814 O SER A 52 3.495 -3.325 -13.024 1.00 0.00 O ATOM 815 CB SER A 52 2.077 -1.284 -14.925 1.00 0.00 C ATOM 816 OG SER A 52 3.091 -2.068 -15.538 1.00 0.00 O ATOM 0 H SER A 52 2.620 -1.451 -11.859 1.00 0.00 H new ATOM 0 HA SER A 52 0.553 -2.147 -13.686 1.00 0.00 H new ATOM 0 HB2 SER A 52 1.231 -1.167 -15.603 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.454 -0.284 -14.711 1.00 0.00 H new ATOM 0 HG SER A 52 3.382 -1.636 -16.368 1.00 0.00 H new ATOM 822 N GLY A 53 1.678 -4.371 -13.830 1.00 0.00 N ATOM 823 CA GLY A 53 2.260 -5.703 -13.709 1.00 0.00 C ATOM 824 C GLY A 53 1.353 -6.599 -12.873 1.00 0.00 C ATOM 825 O GLY A 53 0.160 -6.326 -12.741 1.00 0.00 O ATOM 0 H GLY A 53 0.730 -4.355 -14.206 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.401 -6.138 -14.699 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.245 -5.637 -13.247 1.00 0.00 H new ATOM 829 N SER A 54 1.911 -7.667 -12.308 1.00 0.00 N ATOM 830 CA SER A 54 1.102 -8.575 -11.493 1.00 0.00 C ATOM 831 C SER A 54 1.906 -9.146 -10.329 1.00 0.00 C ATOM 832 O SER A 54 3.096 -9.432 -10.465 1.00 0.00 O ATOM 833 CB SER A 54 0.575 -9.718 -12.358 1.00 0.00 C ATOM 834 OG SER A 54 0.396 -9.255 -13.691 1.00 0.00 O ATOM 0 H SER A 54 2.895 -7.923 -12.394 1.00 0.00 H new ATOM 0 HA SER A 54 0.268 -8.005 -11.084 1.00 0.00 H new ATOM 0 HB2 SER A 54 1.275 -10.554 -12.342 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.370 -10.086 -11.959 1.00 0.00 H new ATOM 0 HG SER A 54 0.059 -9.987 -14.249 1.00 0.00 H new ATOM 840 N MET A 55 1.243 -9.318 -9.184 1.00 0.00 N ATOM 841 CA MET A 55 1.911 -9.868 -8.006 1.00 0.00 C ATOM 842 C MET A 55 0.895 -10.468 -7.039 1.00 0.00 C ATOM 843 O MET A 55 -0.303 -10.197 -7.130 1.00 0.00 O ATOM 844 CB MET A 55 2.720 -8.781 -7.294 1.00 0.00 C ATOM 845 CG MET A 55 1.965 -7.459 -7.361 1.00 0.00 C ATOM 846 SD MET A 55 2.702 -6.272 -6.207 1.00 0.00 S ATOM 847 CE MET A 55 2.477 -7.232 -4.689 1.00 0.00 C ATOM 0 H MET A 55 0.259 -9.088 -9.049 1.00 0.00 H new ATOM 0 HA MET A 55 2.587 -10.656 -8.339 1.00 0.00 H new ATOM 0 HB2 MET A 55 2.891 -9.062 -6.255 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.699 -8.677 -7.761 1.00 0.00 H new ATOM 0 HG2 MET A 55 1.998 -7.062 -8.376 1.00 0.00 H new ATOM 0 HG3 MET A 55 0.915 -7.616 -7.114 1.00 0.00 H new ATOM 0 HE1 MET A 55 2.058 -6.592 -3.912 1.00 0.00 H new ATOM 0 HE2 MET A 55 1.797 -8.062 -4.881 1.00 0.00 H new ATOM 0 HE3 MET A 55 3.440 -7.621 -4.358 1.00 0.00 H new ATOM 857 N GLU A 56 1.382 -11.295 -6.120 1.00 0.00 N ATOM 858 CA GLU A 56 0.501 -11.931 -5.151 1.00 0.00 C ATOM 859 C GLU A 56 1.297 -12.511 -3.982 1.00 0.00 C ATOM 860 O GLU A 56 2.478 -12.826 -4.122 1.00 0.00 O ATOM 861 CB GLU A 56 -0.290 -13.041 -5.839 1.00 0.00 C ATOM 862 CG GLU A 56 0.624 -13.824 -6.793 1.00 0.00 C ATOM 863 CD GLU A 56 1.824 -14.390 -6.039 1.00 0.00 C ATOM 864 OE1 GLU A 56 1.661 -14.754 -4.888 1.00 0.00 O ATOM 865 OE2 GLU A 56 2.890 -14.457 -6.628 1.00 0.00 O ATOM 0 H GLU A 56 2.368 -11.537 -6.027 1.00 0.00 H new ATOM 0 HA GLU A 56 -0.182 -11.179 -4.756 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.712 -13.714 -5.093 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -1.126 -12.614 -6.392 1.00 0.00 H new ATOM 0 HG2 GLU A 56 0.064 -14.635 -7.259 1.00 0.00 H new ATOM 0 HG3 GLU A 56 0.966 -13.171 -7.596 1.00 0.00 H new ATOM 872 N VAL A 57 0.638 -12.666 -2.832 1.00 0.00 N ATOM 873 CA VAL A 57 1.304 -13.226 -1.659 1.00 0.00 C ATOM 874 C VAL A 57 1.023 -14.727 -1.577 1.00 0.00 C ATOM 875 O VAL A 57 -0.125 -15.159 -1.733 1.00 0.00 O ATOM 876 CB VAL A 57 0.872 -12.501 -0.373 1.00 0.00 C ATOM 877 CG1 VAL A 57 0.203 -11.172 -0.725 1.00 0.00 C ATOM 878 CG2 VAL A 57 -0.104 -13.362 0.429 1.00 0.00 C ATOM 0 H VAL A 57 -0.341 -12.416 -2.690 1.00 0.00 H new ATOM 0 HA VAL A 57 2.379 -13.078 -1.760 1.00 0.00 H new ATOM 0 HB VAL A 57 1.760 -12.316 0.232 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -0.100 -10.664 0.190 1.00 0.00 H new ATOM 0 HG12 VAL A 57 0.906 -10.544 -1.272 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -0.674 -11.359 -1.344 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.398 -12.832 1.335 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.988 -13.567 -0.174 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.377 -14.302 0.699 1.00 0.00 H new ATOM 888 N LEU A 58 2.092 -15.511 -1.377 1.00 0.00 N ATOM 889 CA LEU A 58 1.978 -16.971 -1.337 1.00 0.00 C ATOM 890 C LEU A 58 2.090 -17.558 0.071 1.00 0.00 C ATOM 891 O LEU A 58 3.085 -17.358 0.768 1.00 0.00 O ATOM 892 CB LEU A 58 3.076 -17.585 -2.216 1.00 0.00 C ATOM 893 CG LEU A 58 2.460 -18.544 -3.245 1.00 0.00 C ATOM 894 CD1 LEU A 58 3.559 -19.417 -3.853 1.00 0.00 C ATOM 895 CD2 LEU A 58 1.420 -19.443 -2.568 1.00 0.00 C ATOM 0 H LEU A 58 3.039 -15.158 -1.241 1.00 0.00 H new ATOM 0 HA LEU A 58 0.982 -17.216 -1.705 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.626 -16.795 -2.728 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.793 -18.120 -1.593 1.00 0.00 H new ATOM 0 HG LEU A 58 1.977 -17.960 -4.028 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.121 -20.097 -4.583 1.00 0.00 H new ATOM 0 HD12 LEU A 58 4.297 -18.783 -4.345 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.043 -19.994 -3.065 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.989 -20.120 -3.306 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.899 -20.023 -1.779 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.632 -18.826 -2.137 1.00 0.00 H new ATOM 907 N LYS A 59 1.065 -18.323 0.456 1.00 0.00 N ATOM 908 CA LYS A 59 1.047 -18.992 1.756 1.00 0.00 C ATOM 909 C LYS A 59 0.009 -20.123 1.760 1.00 0.00 C ATOM 910 O LYS A 59 -1.056 -19.998 1.160 1.00 0.00 O ATOM 911 CB LYS A 59 0.752 -17.992 2.882 1.00 0.00 C ATOM 912 CG LYS A 59 1.915 -17.971 3.883 1.00 0.00 C ATOM 913 CD LYS A 59 2.238 -19.398 4.351 1.00 0.00 C ATOM 914 CE LYS A 59 3.608 -19.850 3.820 1.00 0.00 C ATOM 915 NZ LYS A 59 4.628 -19.699 4.896 1.00 0.00 N ATOM 0 H LYS A 59 0.237 -18.493 -0.115 1.00 0.00 H new ATOM 0 HA LYS A 59 2.033 -19.421 1.932 1.00 0.00 H new ATOM 0 HB2 LYS A 59 0.602 -16.996 2.465 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -0.172 -18.267 3.391 1.00 0.00 H new ATOM 0 HG2 LYS A 59 2.795 -17.524 3.420 1.00 0.00 H new ATOM 0 HG3 LYS A 59 1.656 -17.349 4.740 1.00 0.00 H new ATOM 0 HD2 LYS A 59 2.234 -19.438 5.440 1.00 0.00 H new ATOM 0 HD3 LYS A 59 1.464 -20.083 4.004 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.559 -20.889 3.493 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.888 -19.255 2.951 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 5.414 -20.358 4.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 4.989 -18.724 4.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 4.194 -19.909 5.818 1.00 0.00 H new ATOM 929 N ASP A 60 0.338 -21.220 2.441 1.00 0.00 N ATOM 930 CA ASP A 60 -0.549 -22.385 2.541 1.00 0.00 C ATOM 931 C ASP A 60 -0.900 -22.979 1.173 1.00 0.00 C ATOM 932 O ASP A 60 -2.061 -23.270 0.890 1.00 0.00 O ATOM 933 CB ASP A 60 -1.832 -22.016 3.297 1.00 0.00 C ATOM 934 CG ASP A 60 -2.759 -21.179 2.422 1.00 0.00 C ATOM 935 OD1 ASP A 60 -3.471 -21.757 1.618 1.00 0.00 O ATOM 936 OD2 ASP A 60 -2.749 -19.970 2.576 1.00 0.00 O ATOM 0 H ASP A 60 1.222 -21.329 2.938 1.00 0.00 H new ATOM 0 HA ASP A 60 -0.004 -23.150 3.095 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.346 -22.924 3.614 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -1.579 -21.461 4.201 1.00 0.00 H new ATOM 941 N ASN A 61 0.122 -23.197 0.353 1.00 0.00 N ATOM 942 CA ASN A 61 -0.063 -23.806 -0.966 1.00 0.00 C ATOM 943 C ASN A 61 -0.849 -22.906 -1.919 1.00 0.00 C ATOM 944 O ASN A 61 -0.851 -23.137 -3.128 1.00 0.00 O ATOM 945 CB ASN A 61 -0.790 -25.143 -0.819 1.00 0.00 C ATOM 946 CG ASN A 61 -0.074 -26.011 0.212 1.00 0.00 C ATOM 947 OD1 ASN A 61 1.114 -26.295 0.067 1.00 0.00 O ATOM 948 ND2 ASN A 61 -0.731 -26.451 1.252 1.00 0.00 N ATOM 0 H ASN A 61 1.089 -22.962 0.575 1.00 0.00 H new ATOM 0 HA ASN A 61 0.928 -23.955 -1.394 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.822 -24.974 -0.512 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -0.823 -25.657 -1.780 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.259 -27.031 1.946 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -1.716 -26.214 1.370 1.00 0.00 H new ATOM 955 N THR A 62 -1.500 -21.881 -1.390 1.00 0.00 N ATOM 956 CA THR A 62 -2.260 -20.969 -2.240 1.00 0.00 C ATOM 957 C THR A 62 -1.880 -19.537 -1.946 1.00 0.00 C ATOM 958 O THR A 62 -1.333 -19.227 -0.889 1.00 0.00 O ATOM 959 CB THR A 62 -3.765 -21.125 -2.032 1.00 0.00 C ATOM 960 OG1 THR A 62 -4.103 -22.506 -2.035 1.00 0.00 O ATOM 961 CG2 THR A 62 -4.524 -20.403 -3.162 1.00 0.00 C ATOM 0 H THR A 62 -1.520 -21.660 -0.395 1.00 0.00 H new ATOM 0 HA THR A 62 -2.019 -21.219 -3.273 1.00 0.00 H new ATOM 0 HB THR A 62 -4.045 -20.685 -1.075 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.068 -22.607 -1.900 1.00 0.00 H new ATOM 0 HG21 THR A 62 -5.597 -20.517 -3.010 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.267 -19.344 -3.154 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.246 -20.837 -4.122 1.00 0.00 H new ATOM 969 N VAL A 63 -2.186 -18.667 -2.885 1.00 0.00 N ATOM 970 CA VAL A 63 -1.889 -17.265 -2.719 1.00 0.00 C ATOM 971 C VAL A 63 -2.861 -16.643 -1.728 1.00 0.00 C ATOM 972 O VAL A 63 -4.078 -16.740 -1.893 1.00 0.00 O ATOM 973 CB VAL A 63 -1.975 -16.566 -4.066 1.00 0.00 C ATOM 974 CG1 VAL A 63 -0.570 -16.205 -4.543 1.00 0.00 C ATOM 975 CG2 VAL A 63 -2.614 -17.518 -5.075 1.00 0.00 C ATOM 0 H VAL A 63 -2.639 -18.907 -3.767 1.00 0.00 H new ATOM 0 HA VAL A 63 -0.879 -17.150 -2.327 1.00 0.00 H new ATOM 0 HB VAL A 63 -2.573 -15.659 -3.973 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -0.631 -15.704 -5.509 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -0.099 -15.540 -3.819 1.00 0.00 H new ATOM 0 HG13 VAL A 63 0.025 -17.113 -4.642 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -2.681 -17.027 -6.046 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.004 -18.417 -5.164 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -3.614 -17.790 -4.736 1.00 0.00 H new ATOM 985 N LEU A 64 -2.321 -16.012 -0.691 1.00 0.00 N ATOM 986 CA LEU A 64 -3.163 -15.390 0.320 1.00 0.00 C ATOM 987 C LEU A 64 -3.747 -14.099 -0.220 1.00 0.00 C ATOM 988 O LEU A 64 -4.709 -13.564 0.331 1.00 0.00 O ATOM 989 CB LEU A 64 -2.349 -15.100 1.586 1.00 0.00 C ATOM 990 CG LEU A 64 -2.885 -15.935 2.748 1.00 0.00 C ATOM 991 CD1 LEU A 64 -2.482 -17.395 2.547 1.00 0.00 C ATOM 992 CD2 LEU A 64 -2.294 -15.422 4.063 1.00 0.00 C ATOM 0 H LEU A 64 -1.318 -15.919 -0.531 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.973 -16.075 0.571 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.298 -15.331 1.414 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.406 -14.040 1.831 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.971 -15.855 2.783 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.862 -17.995 3.374 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.900 -17.762 1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.395 -17.471 2.514 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.677 -16.018 4.891 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.208 -15.503 4.030 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.576 -14.379 4.206 1.00 0.00 H new ATOM 1004 N ALA A 65 -3.174 -13.604 -1.311 1.00 0.00 N ATOM 1005 CA ALA A 65 -3.682 -12.378 -1.909 1.00 0.00 C ATOM 1006 C ALA A 65 -3.386 -12.339 -3.401 1.00 0.00 C ATOM 1007 O ALA A 65 -2.271 -12.632 -3.836 1.00 0.00 O ATOM 1008 CB ALA A 65 -3.064 -11.159 -1.222 1.00 0.00 C ATOM 0 H ALA A 65 -2.376 -14.022 -1.790 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.763 -12.355 -1.771 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -3.452 -10.248 -1.678 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -3.319 -11.171 -0.162 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.980 -11.188 -1.335 1.00 0.00 H new ATOM 1014 N ILE A 66 -4.395 -11.966 -4.178 1.00 0.00 N ATOM 1015 CA ILE A 66 -4.248 -11.878 -5.623 1.00 0.00 C ATOM 1016 C ILE A 66 -4.539 -10.446 -6.070 1.00 0.00 C ATOM 1017 O ILE A 66 -5.695 -10.022 -6.064 1.00 0.00 O ATOM 1018 CB ILE A 66 -5.225 -12.831 -6.316 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -5.464 -14.080 -5.457 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -4.647 -13.252 -7.668 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -4.394 -15.139 -5.744 1.00 0.00 C ATOM 0 H ILE A 66 -5.322 -11.720 -3.831 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.230 -12.156 -5.894 1.00 0.00 H new ATOM 0 HB ILE A 66 -6.175 -12.316 -6.458 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.445 -13.812 -4.401 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -6.453 -14.488 -5.664 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -5.340 -13.931 -8.165 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -4.495 -12.370 -8.290 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -3.693 -13.756 -7.515 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.578 -16.018 -5.127 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.433 -15.420 -6.797 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -3.409 -14.733 -5.513 1.00 0.00 H new ATOM 1033 N LEU A 67 -3.504 -9.689 -6.440 1.00 0.00 N ATOM 1034 CA LEU A 67 -3.728 -8.305 -6.858 1.00 0.00 C ATOM 1035 C LEU A 67 -3.001 -7.959 -8.157 1.00 0.00 C ATOM 1036 O LEU A 67 -2.064 -8.650 -8.576 1.00 0.00 O ATOM 1037 CB LEU A 67 -3.310 -7.333 -5.747 1.00 0.00 C ATOM 1038 CG LEU A 67 -2.313 -8.004 -4.805 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -0.992 -8.182 -5.538 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -2.095 -7.118 -3.576 1.00 0.00 C ATOM 0 H LEU A 67 -2.532 -9.998 -6.459 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.797 -8.203 -7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.863 -6.440 -6.184 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -4.188 -7.009 -5.188 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.698 -8.973 -4.487 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -0.270 -8.661 -4.876 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -1.146 -8.806 -6.419 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.612 -7.208 -5.845 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -1.383 -7.597 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.703 -6.151 -3.890 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -3.043 -6.974 -3.058 1.00 0.00 H new ATOM 1052 N GLY A 68 -3.450 -6.872 -8.788 1.00 0.00 N ATOM 1053 CA GLY A 68 -2.861 -6.415 -10.040 1.00 0.00 C ATOM 1054 C GLY A 68 -2.548 -4.918 -10.002 1.00 0.00 C ATOM 1055 O GLY A 68 -2.283 -4.351 -8.943 1.00 0.00 O ATOM 0 H GLY A 68 -4.220 -6.295 -8.449 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.946 -6.974 -10.238 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.546 -6.623 -10.862 1.00 0.00 H new ATOM 1059 N LYS A 69 -2.560 -4.299 -11.181 1.00 0.00 N ATOM 1060 CA LYS A 69 -2.257 -2.881 -11.333 1.00 0.00 C ATOM 1061 C LYS A 69 -3.037 -1.984 -10.366 1.00 0.00 C ATOM 1062 O LYS A 69 -4.258 -2.085 -10.245 1.00 0.00 O ATOM 1063 CB LYS A 69 -2.584 -2.467 -12.762 1.00 0.00 C ATOM 1064 CG LYS A 69 -2.084 -3.541 -13.731 1.00 0.00 C ATOM 1065 CD LYS A 69 -2.196 -3.032 -15.169 1.00 0.00 C ATOM 1066 CE LYS A 69 -1.988 -4.198 -16.137 1.00 0.00 C ATOM 1067 NZ LYS A 69 -1.339 -3.702 -17.383 1.00 0.00 N ATOM 0 H LYS A 69 -2.781 -4.770 -12.059 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.200 -2.750 -11.103 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.660 -2.332 -12.876 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.116 -1.509 -12.991 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.048 -3.795 -13.505 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.669 -4.453 -13.611 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.174 -2.580 -15.331 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.452 -2.256 -15.351 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -1.368 -4.964 -15.672 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.945 -4.663 -16.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.198 -4.495 -18.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.947 -2.986 -17.830 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -0.418 -3.278 -17.150 1.00 0.00 H new ATOM 1081 N GLY A 70 -2.309 -1.072 -9.717 1.00 0.00 N ATOM 1082 CA GLY A 70 -2.907 -0.108 -8.796 1.00 0.00 C ATOM 1083 C GLY A 70 -3.075 -0.666 -7.388 1.00 0.00 C ATOM 1084 O GLY A 70 -3.057 0.082 -6.412 1.00 0.00 O ATOM 0 H GLY A 70 -1.298 -0.983 -9.815 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.284 0.785 -8.756 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -3.880 0.199 -9.179 1.00 0.00 H new ATOM 1088 N ASP A 71 -3.255 -1.971 -7.269 1.00 0.00 N ATOM 1089 CA ASP A 71 -3.437 -2.557 -5.951 1.00 0.00 C ATOM 1090 C ASP A 71 -2.373 -2.035 -4.999 1.00 0.00 C ATOM 1091 O ASP A 71 -1.199 -1.937 -5.357 1.00 0.00 O ATOM 1092 CB ASP A 71 -3.355 -4.078 -6.025 1.00 0.00 C ATOM 1093 CG ASP A 71 -4.190 -4.590 -7.194 1.00 0.00 C ATOM 1094 OD1 ASP A 71 -4.301 -3.875 -8.176 1.00 0.00 O ATOM 1095 OD2 ASP A 71 -4.712 -5.687 -7.086 1.00 0.00 O ATOM 0 H ASP A 71 -3.279 -2.631 -8.047 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.423 -2.275 -5.582 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -2.317 -4.389 -6.145 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.713 -4.515 -5.093 1.00 0.00 H new ATOM 1100 N LEU A 72 -2.790 -1.693 -3.786 1.00 0.00 N ATOM 1101 CA LEU A 72 -1.860 -1.173 -2.799 1.00 0.00 C ATOM 1102 C LEU A 72 -1.515 -2.251 -1.780 1.00 0.00 C ATOM 1103 O LEU A 72 -2.311 -3.152 -1.512 1.00 0.00 O ATOM 1104 CB LEU A 72 -2.476 0.045 -2.097 1.00 0.00 C ATOM 1105 CG LEU A 72 -1.587 0.507 -0.935 1.00 0.00 C ATOM 1106 CD1 LEU A 72 -0.360 1.237 -1.473 1.00 0.00 C ATOM 1107 CD2 LEU A 72 -2.385 1.458 -0.038 1.00 0.00 C ATOM 0 H LEU A 72 -3.756 -1.766 -3.467 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.943 -0.867 -3.302 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.601 0.858 -2.812 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.469 -0.207 -1.724 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.264 -0.363 -0.363 1.00 0.00 H new ATOM 0 HD11 LEU A 72 0.265 1.561 -0.641 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.210 0.566 -2.115 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.677 2.107 -2.048 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.758 1.789 0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.706 2.323 -0.619 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.260 0.940 0.355 1.00 0.00 H new ATOM 1119 N ILE A 73 -0.311 -2.154 -1.230 1.00 0.00 N ATOM 1120 CA ILE A 73 0.155 -3.128 -0.255 1.00 0.00 C ATOM 1121 C ILE A 73 0.457 -2.455 1.071 1.00 0.00 C ATOM 1122 O ILE A 73 1.085 -1.394 1.128 1.00 0.00 O ATOM 1123 CB ILE A 73 1.401 -3.835 -0.803 1.00 0.00 C ATOM 1124 CG1 ILE A 73 2.656 -3.356 -0.088 1.00 0.00 C ATOM 1125 CG2 ILE A 73 1.493 -3.526 -2.286 1.00 0.00 C ATOM 1126 CD1 ILE A 73 2.654 -3.861 1.357 1.00 0.00 C ATOM 0 H ILE A 73 0.357 -1.413 -1.442 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.628 -3.866 -0.081 1.00 0.00 H new ATOM 0 HB ILE A 73 1.321 -4.910 -0.638 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.543 -3.718 -0.608 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.701 -2.267 -0.102 1.00 0.00 H new ATOM 0 HG21 ILE A 73 2.371 -4.016 -2.706 1.00 0.00 H new ATOM 0 HG22 ILE A 73 0.598 -3.891 -2.790 1.00 0.00 H new ATOM 0 HG23 ILE A 73 1.576 -2.449 -2.429 1.00 0.00 H new ATOM 0 HD11 ILE A 73 3.555 -3.515 1.864 1.00 0.00 H new ATOM 0 HD12 ILE A 73 1.775 -3.477 1.875 1.00 0.00 H new ATOM 0 HD13 ILE A 73 2.631 -4.951 1.362 1.00 0.00 H new ATOM 1138 N GLY A 74 0.010 -3.103 2.129 1.00 0.00 N ATOM 1139 CA GLY A 74 0.222 -2.599 3.484 1.00 0.00 C ATOM 1140 C GLY A 74 -1.085 -2.577 4.272 1.00 0.00 C ATOM 1141 O GLY A 74 -2.160 -2.401 3.699 1.00 0.00 O ATOM 0 H GLY A 74 -0.504 -3.983 2.082 1.00 0.00 H new ATOM 0 HA2 GLY A 74 0.950 -3.226 3.999 1.00 0.00 H new ATOM 0 HA3 GLY A 74 0.641 -1.594 3.440 1.00 0.00 H new ATOM 1145 N SER A 75 -0.988 -2.751 5.589 1.00 0.00 N ATOM 1146 CA SER A 75 -2.175 -2.741 6.441 1.00 0.00 C ATOM 1147 C SER A 75 -2.629 -1.308 6.703 1.00 0.00 C ATOM 1148 O SER A 75 -1.818 -0.439 7.022 1.00 0.00 O ATOM 1149 CB SER A 75 -1.877 -3.426 7.779 1.00 0.00 C ATOM 1150 OG SER A 75 -0.478 -3.645 7.893 1.00 0.00 O ATOM 0 H SER A 75 -0.109 -2.899 6.085 1.00 0.00 H new ATOM 0 HA SER A 75 -2.967 -3.283 5.925 1.00 0.00 H new ATOM 0 HB2 SER A 75 -2.228 -2.806 8.604 1.00 0.00 H new ATOM 0 HB3 SER A 75 -2.411 -4.374 7.842 1.00 0.00 H new ATOM 0 HG SER A 75 -0.233 -4.458 7.403 1.00 0.00 H new ATOM 1156 N ASP A 76 -3.929 -1.070 6.570 1.00 0.00 N ATOM 1157 CA ASP A 76 -4.480 0.259 6.802 1.00 0.00 C ATOM 1158 C ASP A 76 -4.244 0.685 8.248 1.00 0.00 C ATOM 1159 O ASP A 76 -3.507 0.029 8.985 1.00 0.00 O ATOM 1160 CB ASP A 76 -5.981 0.261 6.504 1.00 0.00 C ATOM 1161 CG ASP A 76 -6.405 1.624 5.965 1.00 0.00 C ATOM 1162 OD1 ASP A 76 -6.592 2.524 6.767 1.00 0.00 O ATOM 1163 OD2 ASP A 76 -6.538 1.745 4.759 1.00 0.00 O ATOM 0 H ASP A 76 -4.617 -1.775 6.305 1.00 0.00 H new ATOM 0 HA ASP A 76 -3.979 0.964 6.139 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -6.217 -0.516 5.777 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -6.540 0.029 7.410 1.00 0.00 H new ATOM 1168 N SER A 77 -4.871 1.785 8.645 1.00 0.00 N ATOM 1169 CA SER A 77 -4.721 2.290 10.004 1.00 0.00 C ATOM 1170 C SER A 77 -3.285 2.742 10.247 1.00 0.00 C ATOM 1171 O SER A 77 -2.714 2.487 11.307 1.00 0.00 O ATOM 1172 CB SER A 77 -5.092 1.202 11.012 1.00 0.00 C ATOM 1173 OG SER A 77 -5.165 1.773 12.312 1.00 0.00 O ATOM 0 H SER A 77 -5.484 2.342 8.050 1.00 0.00 H new ATOM 0 HA SER A 77 -5.388 3.143 10.131 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.049 0.753 10.745 1.00 0.00 H new ATOM 0 HB3 SER A 77 -4.350 0.404 10.994 1.00 0.00 H new ATOM 0 HG SER A 77 -4.336 2.260 12.502 1.00 0.00 H new ATOM 1179 N LEU A 78 -2.708 3.414 9.256 1.00 0.00 N ATOM 1180 CA LEU A 78 -1.337 3.896 9.370 1.00 0.00 C ATOM 1181 C LEU A 78 -1.181 4.785 10.599 1.00 0.00 C ATOM 1182 O LEU A 78 -0.064 5.070 11.033 1.00 0.00 O ATOM 1183 CB LEU A 78 -0.954 4.678 8.114 1.00 0.00 C ATOM 1184 CG LEU A 78 -0.366 3.719 7.078 1.00 0.00 C ATOM 1185 CD1 LEU A 78 -1.361 2.593 6.799 1.00 0.00 C ATOM 1186 CD2 LEU A 78 -0.080 4.478 5.781 1.00 0.00 C ATOM 0 H LEU A 78 -3.165 3.636 8.371 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.676 3.036 9.476 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -1.830 5.181 7.704 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.228 5.453 8.362 1.00 0.00 H new ATOM 0 HG LEU A 78 0.562 3.296 7.464 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.940 1.910 6.060 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.563 2.049 7.722 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.290 3.015 6.415 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.339 3.793 5.044 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.007 4.903 5.396 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.632 5.279 5.978 1.00 0.00 H new ATOM 1198 N THR A 79 -2.307 5.218 11.156 1.00 0.00 N ATOM 1199 CA THR A 79 -2.284 6.071 12.337 1.00 0.00 C ATOM 1200 C THR A 79 -1.554 5.379 13.484 1.00 0.00 C ATOM 1201 O THR A 79 -0.785 6.007 14.210 1.00 0.00 O ATOM 1202 CB THR A 79 -3.716 6.404 12.766 1.00 0.00 C ATOM 1203 OG1 THR A 79 -4.462 6.824 11.633 1.00 0.00 O ATOM 1204 CG2 THR A 79 -3.693 7.523 13.807 1.00 0.00 C ATOM 0 H THR A 79 -3.240 4.994 10.811 1.00 0.00 H new ATOM 0 HA THR A 79 -1.755 6.991 12.089 1.00 0.00 H new ATOM 0 HB THR A 79 -4.180 5.518 13.200 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.411 6.882 11.870 1.00 0.00 H new ATOM 0 HG21 THR A 79 -4.713 7.758 14.111 1.00 0.00 H new ATOM 0 HG22 THR A 79 -3.121 7.199 14.677 1.00 0.00 H new ATOM 0 HG23 THR A 79 -3.229 8.410 13.377 1.00 0.00 H new ATOM 1212 N LYS A 80 -1.801 4.083 13.638 1.00 0.00 N ATOM 1213 CA LYS A 80 -1.160 3.315 14.700 1.00 0.00 C ATOM 1214 C LYS A 80 0.256 2.921 14.292 1.00 0.00 C ATOM 1215 O LYS A 80 0.770 1.888 14.722 1.00 0.00 O ATOM 1216 CB LYS A 80 -1.978 2.060 15.005 1.00 0.00 C ATOM 1217 CG LYS A 80 -1.663 1.576 16.422 1.00 0.00 C ATOM 1218 CD LYS A 80 -1.336 0.081 16.393 1.00 0.00 C ATOM 1219 CE LYS A 80 -2.619 -0.720 16.165 1.00 0.00 C ATOM 1220 NZ LYS A 80 -2.848 -1.623 17.329 1.00 0.00 N ATOM 0 H LYS A 80 -2.435 3.545 13.047 1.00 0.00 H new ATOM 0 HA LYS A 80 -1.108 3.936 15.594 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.042 2.275 14.911 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.746 1.278 14.282 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.821 2.135 16.829 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.514 1.760 17.078 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -0.618 -0.129 15.600 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.870 -0.218 17.332 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.466 -0.045 16.041 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -2.539 -1.303 15.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -3.720 -2.170 17.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -2.043 -2.274 17.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -2.941 -1.056 18.196 1.00 0.00 H new ATOM 1234 N GLU A 81 0.873 3.751 13.455 1.00 0.00 N ATOM 1235 CA GLU A 81 2.230 3.497 12.981 1.00 0.00 C ATOM 1236 C GLU A 81 2.967 2.538 13.913 1.00 0.00 C ATOM 1237 O GLU A 81 3.612 2.962 14.873 1.00 0.00 O ATOM 1238 CB GLU A 81 3.003 4.814 12.888 1.00 0.00 C ATOM 1239 CG GLU A 81 2.564 5.745 14.022 1.00 0.00 C ATOM 1240 CD GLU A 81 3.216 7.115 13.854 1.00 0.00 C ATOM 1241 OE1 GLU A 81 2.918 7.774 12.871 1.00 0.00 O ATOM 1242 OE2 GLU A 81 3.999 7.485 14.712 1.00 0.00 O ATOM 0 H GLU A 81 0.454 4.607 13.091 1.00 0.00 H new ATOM 0 HA GLU A 81 2.164 3.038 11.995 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.074 4.624 12.953 1.00 0.00 H new ATOM 0 HB3 GLU A 81 2.821 5.288 11.923 1.00 0.00 H new ATOM 0 HG2 GLU A 81 1.479 5.847 14.021 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.843 5.316 14.984 1.00 0.00 H new ATOM 1249 N GLN A 82 2.869 1.246 13.620 1.00 0.00 N ATOM 1250 CA GLN A 82 3.531 0.232 14.434 1.00 0.00 C ATOM 1251 C GLN A 82 4.329 -0.722 13.551 1.00 0.00 C ATOM 1252 O GLN A 82 4.224 -0.683 12.325 1.00 0.00 O ATOM 1253 CB GLN A 82 2.490 -0.557 15.236 1.00 0.00 C ATOM 1254 CG GLN A 82 2.637 -0.253 16.725 1.00 0.00 C ATOM 1255 CD GLN A 82 2.725 1.252 16.959 1.00 0.00 C ATOM 1256 OE1 GLN A 82 1.634 1.966 16.956 1.00 0.00 O flip ATOM 1257 NE2 GLN A 82 3.815 1.789 17.150 1.00 0.00 N flip ATOM 0 H GLN A 82 2.341 0.877 12.829 1.00 0.00 H new ATOM 0 HA GLN A 82 4.214 0.731 15.121 1.00 0.00 H new ATOM 0 HB2 GLN A 82 1.486 -0.296 14.901 1.00 0.00 H new ATOM 0 HB3 GLN A 82 2.617 -1.625 15.060 1.00 0.00 H new ATOM 0 HG2 GLN A 82 1.787 -0.662 17.271 1.00 0.00 H new ATOM 0 HG3 GLN A 82 3.531 -0.740 17.115 1.00 0.00 H new ATOM 0 HE21 GLN A 82 4.667 1.228 17.152 1.00 0.00 H new ATOM 0 HE22 GLN A 82 3.867 2.796 17.307 1.00 0.00 H new ATOM 1266 N VAL A 83 5.125 -1.579 14.182 1.00 0.00 N ATOM 1267 CA VAL A 83 5.937 -2.539 13.443 1.00 0.00 C ATOM 1268 C VAL A 83 5.087 -3.709 12.961 1.00 0.00 C ATOM 1269 O VAL A 83 4.635 -4.531 13.758 1.00 0.00 O ATOM 1270 CB VAL A 83 7.072 -3.057 14.325 1.00 0.00 C ATOM 1271 CG1 VAL A 83 6.511 -3.417 15.695 1.00 0.00 C ATOM 1272 CG2 VAL A 83 7.696 -4.298 13.682 1.00 0.00 C ATOM 0 H VAL A 83 5.225 -1.629 15.196 1.00 0.00 H new ATOM 0 HA VAL A 83 6.357 -2.032 12.574 1.00 0.00 H new ATOM 0 HB VAL A 83 7.837 -2.287 14.432 1.00 0.00 H new ATOM 0 HG11 VAL A 83 7.315 -3.788 16.331 1.00 0.00 H new ATOM 0 HG12 VAL A 83 6.067 -2.532 16.150 1.00 0.00 H new ATOM 0 HG13 VAL A 83 5.750 -4.189 15.585 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.505 -4.666 14.312 1.00 0.00 H new ATOM 0 HG22 VAL A 83 6.937 -5.073 13.576 1.00 0.00 H new ATOM 0 HG23 VAL A 83 8.090 -4.039 12.699 1.00 0.00 H new ATOM 1282 N ILE A 84 4.875 -3.776 11.651 1.00 0.00 N ATOM 1283 CA ILE A 84 4.078 -4.849 11.068 1.00 0.00 C ATOM 1284 C ILE A 84 4.977 -5.858 10.370 1.00 0.00 C ATOM 1285 O ILE A 84 5.880 -5.488 9.624 1.00 0.00 O ATOM 1286 CB ILE A 84 3.078 -4.271 10.065 1.00 0.00 C ATOM 1287 CG1 ILE A 84 1.892 -3.668 10.821 1.00 0.00 C ATOM 1288 CG2 ILE A 84 2.579 -5.382 9.139 1.00 0.00 C ATOM 1289 CD1 ILE A 84 2.305 -2.326 11.428 1.00 0.00 C ATOM 0 H ILE A 84 5.241 -3.104 10.976 1.00 0.00 H new ATOM 0 HA ILE A 84 3.536 -5.353 11.868 1.00 0.00 H new ATOM 0 HB ILE A 84 3.566 -3.497 9.472 1.00 0.00 H new ATOM 0 HG12 ILE A 84 1.048 -3.529 10.145 1.00 0.00 H new ATOM 0 HG13 ILE A 84 1.563 -4.349 11.606 1.00 0.00 H new ATOM 0 HG21 ILE A 84 1.867 -4.968 8.425 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.423 -5.814 8.601 1.00 0.00 H new ATOM 0 HG23 ILE A 84 2.091 -6.157 9.730 1.00 0.00 H new ATOM 0 HD11 ILE A 84 1.461 -1.895 11.967 1.00 0.00 H new ATOM 0 HD12 ILE A 84 3.136 -2.479 12.117 1.00 0.00 H new ATOM 0 HD13 ILE A 84 2.613 -1.647 10.633 1.00 0.00 H new ATOM 1301 N LYS A 85 4.719 -7.137 10.619 1.00 0.00 N ATOM 1302 CA LYS A 85 5.510 -8.192 10.005 1.00 0.00 C ATOM 1303 C LYS A 85 4.681 -8.938 8.971 1.00 0.00 C ATOM 1304 O LYS A 85 3.514 -9.252 9.202 1.00 0.00 O ATOM 1305 CB LYS A 85 6.006 -9.168 11.071 1.00 0.00 C ATOM 1306 CG LYS A 85 5.093 -9.100 12.291 1.00 0.00 C ATOM 1307 CD LYS A 85 5.121 -10.441 13.026 1.00 0.00 C ATOM 1308 CE LYS A 85 6.536 -10.721 13.521 1.00 0.00 C ATOM 1309 NZ LYS A 85 7.228 -9.434 13.814 1.00 0.00 N ATOM 0 H LYS A 85 3.975 -7.464 11.236 1.00 0.00 H new ATOM 0 HA LYS A 85 6.369 -7.738 9.511 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.021 -10.182 10.671 1.00 0.00 H new ATOM 0 HB3 LYS A 85 7.029 -8.922 11.356 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.418 -8.301 12.958 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.074 -8.863 11.983 1.00 0.00 H new ATOM 0 HD2 LYS A 85 4.428 -10.421 13.867 1.00 0.00 H new ATOM 0 HD3 LYS A 85 4.793 -11.239 12.361 1.00 0.00 H new ATOM 0 HE2 LYS A 85 6.502 -11.340 14.418 1.00 0.00 H new ATOM 0 HE3 LYS A 85 7.091 -11.281 12.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 8.031 -9.609 14.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 7.574 -9.016 12.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 6.562 -8.778 14.269 1.00 0.00 H new ATOM 1323 N THR A 86 5.289 -9.215 7.828 1.00 0.00 N ATOM 1324 CA THR A 86 4.594 -9.921 6.758 1.00 0.00 C ATOM 1325 C THR A 86 4.329 -11.366 7.155 1.00 0.00 C ATOM 1326 O THR A 86 5.259 -12.120 7.445 1.00 0.00 O ATOM 1327 CB THR A 86 5.422 -9.882 5.468 1.00 0.00 C ATOM 1328 OG1 THR A 86 6.568 -9.068 5.667 1.00 0.00 O ATOM 1329 CG2 THR A 86 4.576 -9.306 4.330 1.00 0.00 C ATOM 0 H THR A 86 6.255 -8.965 7.616 1.00 0.00 H new ATOM 0 HA THR A 86 3.640 -9.423 6.584 1.00 0.00 H new ATOM 0 HB THR A 86 5.734 -10.893 5.208 1.00 0.00 H new ATOM 0 HG1 THR A 86 6.554 -8.322 5.032 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.167 -9.280 3.415 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.697 -9.933 4.177 1.00 0.00 H new ATOM 0 HG23 THR A 86 4.260 -8.295 4.587 1.00 0.00 H new ATOM 1337 N ASN A 87 3.052 -11.738 7.169 1.00 0.00 N ATOM 1338 CA ASN A 87 2.653 -13.091 7.537 1.00 0.00 C ATOM 1339 C ASN A 87 2.932 -14.073 6.404 1.00 0.00 C ATOM 1340 O ASN A 87 3.549 -15.116 6.616 1.00 0.00 O ATOM 1341 CB ASN A 87 1.163 -13.117 7.877 1.00 0.00 C ATOM 1342 CG ASN A 87 0.689 -14.558 8.032 1.00 0.00 C ATOM 1343 OD1 ASN A 87 1.321 -15.349 8.732 1.00 0.00 O ATOM 1344 ND2 ASN A 87 -0.392 -14.947 7.416 1.00 0.00 N ATOM 0 H ASN A 87 2.276 -11.120 6.929 1.00 0.00 H new ATOM 0 HA ASN A 87 3.236 -13.392 8.407 1.00 0.00 H new ATOM 0 HB2 ASN A 87 0.982 -12.565 8.799 1.00 0.00 H new ATOM 0 HB3 ASN A 87 0.593 -12.621 7.091 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -0.716 -15.909 7.513 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -0.914 -14.289 6.837 1.00 0.00 H new ATOM 1351 N ALA A 88 2.469 -13.745 5.202 1.00 0.00 N ATOM 1352 CA ALA A 88 2.678 -14.619 4.059 1.00 0.00 C ATOM 1353 C ALA A 88 3.931 -14.216 3.289 1.00 0.00 C ATOM 1354 O ALA A 88 4.709 -13.371 3.728 1.00 0.00 O ATOM 1355 CB ALA A 88 1.469 -14.564 3.118 1.00 0.00 C ATOM 0 H ALA A 88 1.952 -12.890 4.998 1.00 0.00 H new ATOM 0 HA ALA A 88 2.803 -15.635 4.434 1.00 0.00 H new ATOM 0 HB1 ALA A 88 1.640 -15.223 2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 88 0.576 -14.887 3.653 1.00 0.00 H new ATOM 0 HB3 ALA A 88 1.330 -13.543 2.763 1.00 0.00 H new ATOM 1361 N ASN A 89 4.106 -14.823 2.130 1.00 0.00 N ATOM 1362 CA ASN A 89 5.245 -14.521 1.277 1.00 0.00 C ATOM 1363 C ASN A 89 4.748 -13.702 0.097 1.00 0.00 C ATOM 1364 O ASN A 89 3.545 -13.608 -0.116 1.00 0.00 O ATOM 1365 CB ASN A 89 5.887 -15.818 0.776 1.00 0.00 C ATOM 1366 CG ASN A 89 5.974 -16.833 1.911 1.00 0.00 C ATOM 1367 OD1 ASN A 89 5.682 -16.507 3.061 1.00 0.00 O ATOM 1368 ND2 ASN A 89 6.357 -18.053 1.654 1.00 0.00 N ATOM 0 H ASN A 89 3.473 -15.530 1.755 1.00 0.00 H new ATOM 0 HA ASN A 89 5.994 -13.962 1.838 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.301 -16.229 -0.046 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.883 -15.612 0.385 1.00 0.00 H new ATOM 0 HD21 ASN A 89 6.415 -18.739 2.407 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.599 -18.321 0.700 1.00 0.00 H new ATOM 1375 N VAL A 90 5.657 -13.089 -0.645 1.00 0.00 N ATOM 1376 CA VAL A 90 5.277 -12.272 -1.764 1.00 0.00 C ATOM 1377 C VAL A 90 6.098 -12.652 -2.975 1.00 0.00 C ATOM 1378 O VAL A 90 7.324 -12.750 -2.900 1.00 0.00 O ATOM 1379 CB VAL A 90 5.484 -10.812 -1.400 1.00 0.00 C ATOM 1380 CG1 VAL A 90 5.797 -10.032 -2.656 1.00 0.00 C ATOM 1381 CG2 VAL A 90 4.219 -10.255 -0.743 1.00 0.00 C ATOM 0 H VAL A 90 6.663 -13.148 -0.484 1.00 0.00 H new ATOM 0 HA VAL A 90 4.226 -12.429 -2.006 1.00 0.00 H new ATOM 0 HB VAL A 90 6.312 -10.723 -0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.947 -8.982 -2.404 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.703 -10.429 -3.114 1.00 0.00 H new ATOM 0 HG13 VAL A 90 4.967 -10.122 -3.357 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.374 -9.208 -0.484 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.382 -10.337 -1.437 1.00 0.00 H new ATOM 0 HG23 VAL A 90 3.998 -10.823 0.161 1.00 0.00 H new ATOM 1391 N LYS A 91 5.410 -12.852 -4.088 1.00 0.00 N ATOM 1392 CA LYS A 91 6.072 -13.213 -5.326 1.00 0.00 C ATOM 1393 C LYS A 91 5.416 -12.505 -6.502 1.00 0.00 C ATOM 1394 O LYS A 91 4.235 -12.709 -6.782 1.00 0.00 O ATOM 1395 CB LYS A 91 6.002 -14.728 -5.536 1.00 0.00 C ATOM 1396 CG LYS A 91 6.480 -15.072 -6.948 1.00 0.00 C ATOM 1397 CD LYS A 91 6.651 -16.588 -7.076 1.00 0.00 C ATOM 1398 CE LYS A 91 5.475 -17.173 -7.861 1.00 0.00 C ATOM 1399 NZ LYS A 91 5.655 -18.645 -8.005 1.00 0.00 N ATOM 0 H LYS A 91 4.396 -12.770 -4.157 1.00 0.00 H new ATOM 0 HA LYS A 91 7.116 -12.905 -5.263 1.00 0.00 H new ATOM 0 HB2 LYS A 91 6.621 -15.237 -4.797 1.00 0.00 H new ATOM 0 HB3 LYS A 91 4.980 -15.079 -5.391 1.00 0.00 H new ATOM 0 HG2 LYS A 91 5.760 -14.713 -7.684 1.00 0.00 H new ATOM 0 HG3 LYS A 91 7.425 -14.570 -7.155 1.00 0.00 H new ATOM 0 HD2 LYS A 91 7.589 -16.817 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 91 6.703 -17.043 -6.087 1.00 0.00 H new ATOM 0 HE2 LYS A 91 4.538 -16.959 -7.346 1.00 0.00 H new ATOM 0 HE3 LYS A 91 5.412 -16.706 -8.844 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 4.855 -19.042 -8.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 6.541 -18.838 -8.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 5.694 -19.084 -7.063 1.00 0.00 H new ATOM 1413 N ALA A 92 6.190 -11.682 -7.194 1.00 0.00 N ATOM 1414 CA ALA A 92 5.672 -10.967 -8.346 1.00 0.00 C ATOM 1415 C ALA A 92 5.404 -11.959 -9.465 1.00 0.00 C ATOM 1416 O ALA A 92 6.320 -12.647 -9.918 1.00 0.00 O ATOM 1417 CB ALA A 92 6.682 -9.917 -8.814 1.00 0.00 C ATOM 0 H ALA A 92 7.169 -11.495 -6.979 1.00 0.00 H new ATOM 0 HA ALA A 92 4.746 -10.461 -8.072 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.282 -9.387 -9.679 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.869 -9.207 -8.008 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.616 -10.408 -9.089 1.00 0.00 H new ATOM 1423 N LEU A 93 4.143 -12.035 -9.891 1.00 0.00 N ATOM 1424 CA LEU A 93 3.752 -12.961 -10.947 1.00 0.00 C ATOM 1425 C LEU A 93 4.296 -12.484 -12.287 1.00 0.00 C ATOM 1426 O LEU A 93 4.903 -13.248 -13.037 1.00 0.00 O ATOM 1427 CB LEU A 93 2.225 -13.041 -11.018 1.00 0.00 C ATOM 1428 CG LEU A 93 1.752 -14.412 -10.529 1.00 0.00 C ATOM 1429 CD1 LEU A 93 2.434 -14.752 -9.203 1.00 0.00 C ATOM 1430 CD2 LEU A 93 0.235 -14.381 -10.326 1.00 0.00 C ATOM 0 H LEU A 93 3.380 -11.468 -9.521 1.00 0.00 H new ATOM 0 HA LEU A 93 4.161 -13.947 -10.725 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.782 -12.255 -10.407 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.891 -12.875 -12.042 1.00 0.00 H new ATOM 0 HG LEU A 93 2.009 -15.168 -11.271 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.094 -15.729 -8.859 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.515 -14.773 -9.344 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.180 -13.997 -8.459 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -0.105 -15.356 -9.978 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -0.018 -13.623 -9.585 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.254 -14.142 -11.271 1.00 0.00 H new ATOM 1442 N THR A 94 4.087 -11.205 -12.566 1.00 0.00 N ATOM 1443 CA THR A 94 4.569 -10.607 -13.801 1.00 0.00 C ATOM 1444 C THR A 94 5.389 -9.371 -13.464 1.00 0.00 C ATOM 1445 O THR A 94 5.117 -8.699 -12.468 1.00 0.00 O ATOM 1446 CB THR A 94 3.391 -10.219 -14.698 1.00 0.00 C ATOM 1447 OG1 THR A 94 2.620 -9.213 -14.055 1.00 0.00 O ATOM 1448 CG2 THR A 94 2.519 -11.448 -14.957 1.00 0.00 C ATOM 0 H THR A 94 3.586 -10.562 -11.953 1.00 0.00 H new ATOM 0 HA THR A 94 5.188 -11.328 -14.335 1.00 0.00 H new ATOM 0 HB THR A 94 3.766 -9.837 -15.648 1.00 0.00 H new ATOM 0 HG1 THR A 94 1.675 -9.325 -14.290 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.680 -11.171 -15.596 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.112 -12.218 -15.451 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.142 -11.833 -14.009 1.00 0.00 H new ATOM 1456 N TYR A 95 6.392 -9.070 -14.281 1.00 0.00 N ATOM 1457 CA TYR A 95 7.227 -7.910 -14.013 1.00 0.00 C ATOM 1458 C TYR A 95 6.346 -6.720 -13.673 1.00 0.00 C ATOM 1459 O TYR A 95 5.525 -6.289 -14.482 1.00 0.00 O ATOM 1460 CB TYR A 95 8.094 -7.580 -15.230 1.00 0.00 C ATOM 1461 CG TYR A 95 7.750 -8.512 -16.367 1.00 0.00 C ATOM 1462 CD1 TYR A 95 6.423 -8.639 -16.791 1.00 0.00 C ATOM 1463 CD2 TYR A 95 8.761 -9.247 -17.000 1.00 0.00 C ATOM 1464 CE1 TYR A 95 6.104 -9.502 -17.847 1.00 0.00 C ATOM 1465 CE2 TYR A 95 8.443 -10.110 -18.056 1.00 0.00 C ATOM 1466 CZ TYR A 95 7.115 -10.236 -18.480 1.00 0.00 C ATOM 1467 OH TYR A 95 6.800 -11.086 -19.521 1.00 0.00 O ATOM 0 H TYR A 95 6.642 -9.601 -15.116 1.00 0.00 H new ATOM 0 HA TYR A 95 7.882 -8.134 -13.171 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.933 -6.546 -15.534 1.00 0.00 H new ATOM 0 HB3 TYR A 95 9.149 -7.677 -14.974 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.644 -8.071 -16.304 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.786 -9.148 -16.673 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.079 -9.601 -18.173 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.222 -10.678 -18.543 1.00 0.00 H new ATOM 0 HH TYR A 95 7.616 -11.518 -19.849 1.00 0.00 H new ATOM 1477 N CYS A 96 6.503 -6.211 -12.458 1.00 0.00 N ATOM 1478 CA CYS A 96 5.695 -5.089 -12.013 1.00 0.00 C ATOM 1479 C CYS A 96 6.548 -4.013 -11.355 1.00 0.00 C ATOM 1480 O CYS A 96 7.417 -4.309 -10.534 1.00 0.00 O ATOM 1481 CB CYS A 96 4.647 -5.581 -11.012 1.00 0.00 C ATOM 1482 SG CYS A 96 3.449 -4.263 -10.687 1.00 0.00 S ATOM 0 H CYS A 96 7.175 -6.554 -11.772 1.00 0.00 H new ATOM 0 HA CYS A 96 5.211 -4.655 -12.888 1.00 0.00 H new ATOM 0 HB2 CYS A 96 4.137 -6.460 -11.407 1.00 0.00 H new ATOM 0 HB3 CYS A 96 5.131 -5.883 -10.083 1.00 0.00 H new ATOM 0 HG CYS A 96 3.624 -3.297 -11.540 1.00 0.00 H new ATOM 1488 N ASP A 97 6.269 -2.761 -11.701 1.00 0.00 N ATOM 1489 CA ASP A 97 6.990 -1.639 -11.117 1.00 0.00 C ATOM 1490 C ASP A 97 6.217 -1.142 -9.904 1.00 0.00 C ATOM 1491 O ASP A 97 5.013 -0.897 -9.991 1.00 0.00 O ATOM 1492 CB ASP A 97 7.138 -0.511 -12.140 1.00 0.00 C ATOM 1493 CG ASP A 97 8.470 0.204 -11.940 1.00 0.00 C ATOM 1494 OD1 ASP A 97 8.976 0.173 -10.831 1.00 0.00 O ATOM 1495 OD2 ASP A 97 8.965 0.772 -12.900 1.00 0.00 O ATOM 0 H ASP A 97 5.553 -2.500 -12.379 1.00 0.00 H new ATOM 0 HA ASP A 97 7.987 -1.962 -10.817 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.081 -0.916 -13.150 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.316 0.197 -12.034 1.00 0.00 H new ATOM 1500 N LEU A 98 6.891 -1.020 -8.770 1.00 0.00 N ATOM 1501 CA LEU A 98 6.214 -0.580 -7.559 1.00 0.00 C ATOM 1502 C LEU A 98 6.945 0.578 -6.897 1.00 0.00 C ATOM 1503 O LEU A 98 8.166 0.699 -6.988 1.00 0.00 O ATOM 1504 CB LEU A 98 6.113 -1.742 -6.564 1.00 0.00 C ATOM 1505 CG LEU A 98 5.984 -3.069 -7.320 1.00 0.00 C ATOM 1506 CD1 LEU A 98 7.368 -3.565 -7.748 1.00 0.00 C ATOM 1507 CD2 LEU A 98 5.338 -4.114 -6.407 1.00 0.00 C ATOM 0 H LEU A 98 7.886 -1.215 -8.663 1.00 0.00 H new ATOM 0 HA LEU A 98 5.218 -0.242 -7.845 1.00 0.00 H new ATOM 0 HB2 LEU A 98 6.996 -1.762 -5.925 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.251 -1.600 -5.912 1.00 0.00 H new ATOM 0 HG LEU A 98 5.366 -2.915 -8.205 1.00 0.00 H new ATOM 0 HD11 LEU A 98 7.267 -4.508 -8.284 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.834 -2.826 -8.399 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.990 -3.715 -6.865 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.246 -5.058 -6.943 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.959 -4.258 -5.523 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.349 -3.771 -6.104 1.00 0.00 H new ATOM 1519 N GLN A 99 6.179 1.412 -6.206 1.00 0.00 N ATOM 1520 CA GLN A 99 6.744 2.546 -5.496 1.00 0.00 C ATOM 1521 C GLN A 99 6.419 2.411 -4.016 1.00 0.00 C ATOM 1522 O GLN A 99 5.284 2.110 -3.648 1.00 0.00 O ATOM 1523 CB GLN A 99 6.168 3.856 -6.038 1.00 0.00 C ATOM 1524 CG GLN A 99 6.701 5.026 -5.208 1.00 0.00 C ATOM 1525 CD GLN A 99 5.852 5.205 -3.954 1.00 0.00 C ATOM 1526 OE1 GLN A 99 4.878 4.371 -3.712 1.00 0.00 O flip ATOM 1527 NE2 GLN A 99 6.082 6.129 -3.175 1.00 0.00 N flip ATOM 0 H GLN A 99 5.166 1.323 -6.124 1.00 0.00 H new ATOM 0 HA GLN A 99 7.824 2.561 -5.639 1.00 0.00 H new ATOM 0 HB2 GLN A 99 6.444 3.982 -7.085 1.00 0.00 H new ATOM 0 HB3 GLN A 99 5.079 3.832 -5.996 1.00 0.00 H new ATOM 0 HG2 GLN A 99 7.739 4.843 -4.931 1.00 0.00 H new ATOM 0 HG3 GLN A 99 6.686 5.940 -5.801 1.00 0.00 H new ATOM 0 HE21 GLN A 99 6.844 6.780 -3.366 1.00 0.00 H new ATOM 0 HE22 GLN A 99 5.511 6.244 -2.338 1.00 0.00 H new ATOM 1536 N TYR A 100 7.413 2.625 -3.167 1.00 0.00 N ATOM 1537 CA TYR A 100 7.198 2.508 -1.734 1.00 0.00 C ATOM 1538 C TYR A 100 7.989 3.552 -0.970 1.00 0.00 C ATOM 1539 O TYR A 100 8.858 4.228 -1.520 1.00 0.00 O ATOM 1540 CB TYR A 100 7.565 1.101 -1.232 1.00 0.00 C ATOM 1541 CG TYR A 100 9.069 0.902 -1.180 1.00 0.00 C ATOM 1542 CD1 TYR A 100 9.938 1.675 -1.964 1.00 0.00 C ATOM 1543 CD2 TYR A 100 9.591 -0.088 -0.339 1.00 0.00 C ATOM 1544 CE1 TYR A 100 11.321 1.455 -1.899 1.00 0.00 C ATOM 1545 CE2 TYR A 100 10.970 -0.306 -0.280 1.00 0.00 C ATOM 1546 CZ TYR A 100 11.835 0.464 -1.059 1.00 0.00 C ATOM 1547 OH TYR A 100 13.196 0.248 -1.000 1.00 0.00 O ATOM 0 H TYR A 100 8.363 2.877 -3.440 1.00 0.00 H new ATOM 0 HA TYR A 100 6.137 2.678 -1.552 1.00 0.00 H new ATOM 0 HB2 TYR A 100 7.142 0.946 -0.239 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.121 0.352 -1.888 1.00 0.00 H new ATOM 0 HD1 TYR A 100 9.542 2.439 -2.617 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.925 -0.685 0.266 1.00 0.00 H new ATOM 0 HE1 TYR A 100 11.991 2.053 -2.500 1.00 0.00 H new ATOM 0 HE2 TYR A 100 11.367 -1.072 0.370 1.00 0.00 H new ATOM 0 HH TYR A 100 13.385 -0.476 -0.367 1.00 0.00 H new ATOM 1557 N ILE A 101 7.659 3.688 0.303 1.00 0.00 N ATOM 1558 CA ILE A 101 8.326 4.653 1.155 1.00 0.00 C ATOM 1559 C ILE A 101 8.242 4.202 2.606 1.00 0.00 C ATOM 1560 O ILE A 101 7.348 3.440 2.976 1.00 0.00 O ATOM 1561 CB ILE A 101 7.686 6.033 0.962 1.00 0.00 C ATOM 1562 CG1 ILE A 101 7.272 6.632 2.307 1.00 0.00 C ATOM 1563 CG2 ILE A 101 6.444 5.871 0.099 1.00 0.00 C ATOM 1564 CD1 ILE A 101 6.103 5.825 2.882 1.00 0.00 C ATOM 0 H ILE A 101 6.933 3.142 0.768 1.00 0.00 H new ATOM 0 HA ILE A 101 9.379 4.723 0.884 1.00 0.00 H new ATOM 0 HB ILE A 101 8.409 6.697 0.489 1.00 0.00 H new ATOM 0 HG12 ILE A 101 8.114 6.618 2.999 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.981 7.675 2.180 1.00 0.00 H new ATOM 0 HG21 ILE A 101 5.975 6.844 -0.049 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.725 5.452 -0.867 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.741 5.201 0.595 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.805 6.249 3.841 1.00 0.00 H new ATOM 0 HD12 ILE A 101 5.261 5.862 2.191 1.00 0.00 H new ATOM 0 HD13 ILE A 101 6.411 4.789 3.023 1.00 0.00 H new ATOM 1576 N SER A 102 9.162 4.676 3.430 1.00 0.00 N ATOM 1577 CA SER A 102 9.142 4.308 4.833 1.00 0.00 C ATOM 1578 C SER A 102 8.071 5.112 5.555 1.00 0.00 C ATOM 1579 O SER A 102 8.046 6.341 5.484 1.00 0.00 O ATOM 1580 CB SER A 102 10.507 4.567 5.469 1.00 0.00 C ATOM 1581 OG SER A 102 10.881 5.920 5.249 1.00 0.00 O ATOM 0 H SER A 102 9.918 5.304 3.158 1.00 0.00 H new ATOM 0 HA SER A 102 8.915 3.245 4.918 1.00 0.00 H new ATOM 0 HB2 SER A 102 10.468 4.358 6.538 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.253 3.898 5.041 1.00 0.00 H new ATOM 0 HG SER A 102 11.756 6.088 5.658 1.00 0.00 H new ATOM 1587 N LEU A 103 7.177 4.410 6.238 1.00 0.00 N ATOM 1588 CA LEU A 103 6.094 5.070 6.957 1.00 0.00 C ATOM 1589 C LEU A 103 6.644 6.213 7.800 1.00 0.00 C ATOM 1590 O LEU A 103 5.997 7.248 7.960 1.00 0.00 O ATOM 1591 CB LEU A 103 5.384 4.061 7.863 1.00 0.00 C ATOM 1592 CG LEU A 103 3.871 4.249 7.752 1.00 0.00 C ATOM 1593 CD1 LEU A 103 3.507 5.684 8.135 1.00 0.00 C ATOM 1594 CD2 LEU A 103 3.428 3.979 6.313 1.00 0.00 C ATOM 0 H LEU A 103 7.179 3.393 6.310 1.00 0.00 H new ATOM 0 HA LEU A 103 5.384 5.471 6.234 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.656 3.045 7.577 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.703 4.197 8.896 1.00 0.00 H new ATOM 0 HG LEU A 103 3.368 3.554 8.424 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.428 5.819 8.056 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.823 5.878 9.160 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.010 6.379 7.462 1.00 0.00 H new ATOM 0 HD21 LEU A 103 2.349 4.113 6.233 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.931 4.675 5.641 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.688 2.957 6.038 1.00 0.00 H new ATOM 1606 N LYS A 104 7.851 6.030 8.322 1.00 0.00 N ATOM 1607 CA LYS A 104 8.484 7.064 9.128 1.00 0.00 C ATOM 1608 C LYS A 104 8.840 8.263 8.253 1.00 0.00 C ATOM 1609 O LYS A 104 8.795 9.410 8.699 1.00 0.00 O ATOM 1610 CB LYS A 104 9.750 6.512 9.784 1.00 0.00 C ATOM 1611 CG LYS A 104 9.400 5.264 10.597 1.00 0.00 C ATOM 1612 CD LYS A 104 10.330 5.161 11.807 1.00 0.00 C ATOM 1613 CE LYS A 104 9.986 3.908 12.614 1.00 0.00 C ATOM 1614 NZ LYS A 104 10.701 2.733 12.039 1.00 0.00 N ATOM 0 H LYS A 104 8.406 5.183 8.203 1.00 0.00 H new ATOM 0 HA LYS A 104 7.787 7.382 9.904 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.490 6.267 9.022 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.196 7.267 10.431 1.00 0.00 H new ATOM 0 HG2 LYS A 104 8.362 5.312 10.927 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.496 4.374 9.975 1.00 0.00 H new ATOM 0 HD2 LYS A 104 11.368 5.120 11.478 1.00 0.00 H new ATOM 0 HD3 LYS A 104 10.229 6.048 12.433 1.00 0.00 H new ATOM 0 HE2 LYS A 104 10.271 4.045 13.657 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.910 3.736 12.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 10.467 1.881 12.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 10.409 2.599 11.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 11.727 2.898 12.077 1.00 0.00 H new ATOM 1628 N GLY A 105 9.195 7.981 7.003 1.00 0.00 N ATOM 1629 CA GLY A 105 9.562 9.028 6.057 1.00 0.00 C ATOM 1630 C GLY A 105 8.355 9.851 5.641 1.00 0.00 C ATOM 1631 O GLY A 105 8.414 11.080 5.600 1.00 0.00 O ATOM 0 H GLY A 105 9.236 7.036 6.622 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.311 9.680 6.507 1.00 0.00 H new ATOM 0 HA3 GLY A 105 10.019 8.579 5.175 1.00 0.00 H new ATOM 1635 N LEU A 106 7.269 9.160 5.310 1.00 0.00 N ATOM 1636 CA LEU A 106 6.053 9.826 4.868 1.00 0.00 C ATOM 1637 C LEU A 106 5.377 10.580 6.002 1.00 0.00 C ATOM 1638 O LEU A 106 4.860 11.670 5.799 1.00 0.00 O ATOM 1639 CB LEU A 106 5.079 8.802 4.287 1.00 0.00 C ATOM 1640 CG LEU A 106 3.667 9.386 4.250 1.00 0.00 C ATOM 1641 CD1 LEU A 106 2.950 8.889 2.993 1.00 0.00 C ATOM 1642 CD2 LEU A 106 2.892 8.931 5.487 1.00 0.00 C ATOM 0 H LEU A 106 7.208 8.142 5.340 1.00 0.00 H new ATOM 0 HA LEU A 106 6.335 10.549 4.102 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.391 8.520 3.281 1.00 0.00 H new ATOM 0 HB3 LEU A 106 5.090 7.894 4.890 1.00 0.00 H new ATOM 0 HG LEU A 106 3.723 10.474 4.237 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.942 9.303 2.962 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.501 9.209 2.109 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.895 7.801 3.012 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.885 9.348 5.459 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.834 7.843 5.500 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.404 9.277 6.385 1.00 0.00 H new ATOM 1654 N ARG A 107 5.344 9.988 7.182 1.00 0.00 N ATOM 1655 CA ARG A 107 4.686 10.630 8.313 1.00 0.00 C ATOM 1656 C ARG A 107 5.457 11.851 8.817 1.00 0.00 C ATOM 1657 O ARG A 107 4.863 12.792 9.336 1.00 0.00 O ATOM 1658 CB ARG A 107 4.464 9.640 9.454 1.00 0.00 C ATOM 1659 CG ARG A 107 3.884 10.379 10.660 1.00 0.00 C ATOM 1660 CD ARG A 107 2.630 11.132 10.227 1.00 0.00 C ATOM 1661 NE ARG A 107 1.600 11.039 11.255 1.00 0.00 N ATOM 1662 CZ ARG A 107 0.994 9.887 11.519 1.00 0.00 C ATOM 1663 NH1 ARG A 107 1.322 8.811 10.857 1.00 0.00 N ATOM 1664 NH2 ARG A 107 0.071 9.830 12.440 1.00 0.00 N ATOM 0 H ARG A 107 5.757 9.078 7.384 1.00 0.00 H new ATOM 0 HA ARG A 107 3.717 10.977 7.953 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.785 8.849 9.137 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.406 9.162 9.724 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.643 9.672 11.454 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.620 11.074 11.065 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.873 12.178 10.040 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.256 10.719 9.290 1.00 0.00 H new ATOM 0 HE ARG A 107 1.340 11.874 11.781 1.00 0.00 H new ATOM 0 HH11 ARG A 107 2.043 8.855 10.137 1.00 0.00 H new ATOM 0 HH12 ARG A 107 0.857 7.926 11.059 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -0.185 10.671 12.958 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -0.394 8.945 12.642 1.00 0.00 H new ATOM 1678 N GLU A 108 6.777 11.823 8.679 1.00 0.00 N ATOM 1679 CA GLU A 108 7.615 12.935 9.139 1.00 0.00 C ATOM 1680 C GLU A 108 7.342 14.164 8.287 1.00 0.00 C ATOM 1681 O GLU A 108 7.021 15.242 8.791 1.00 0.00 O ATOM 1682 CB GLU A 108 9.095 12.556 9.041 1.00 0.00 C ATOM 1683 CG GLU A 108 9.950 13.825 9.051 1.00 0.00 C ATOM 1684 CD GLU A 108 11.319 13.527 9.651 1.00 0.00 C ATOM 1685 OE1 GLU A 108 11.360 12.989 10.746 1.00 0.00 O ATOM 1686 OE2 GLU A 108 12.309 13.840 9.009 1.00 0.00 O ATOM 0 H GLU A 108 7.292 11.051 8.256 1.00 0.00 H new ATOM 0 HA GLU A 108 7.376 13.154 10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.372 11.912 9.875 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.276 11.990 8.127 1.00 0.00 H new ATOM 0 HG2 GLU A 108 10.064 14.205 8.036 1.00 0.00 H new ATOM 0 HG3 GLU A 108 9.452 14.604 9.629 1.00 0.00 H new ATOM 1693 N VAL A 109 7.435 13.968 6.985 1.00 0.00 N ATOM 1694 CA VAL A 109 7.163 15.030 6.034 1.00 0.00 C ATOM 1695 C VAL A 109 5.756 15.548 6.307 1.00 0.00 C ATOM 1696 O VAL A 109 5.490 16.758 6.368 1.00 0.00 O ATOM 1697 CB VAL A 109 7.273 14.436 4.624 1.00 0.00 C ATOM 1698 CG1 VAL A 109 8.752 14.235 4.288 1.00 0.00 C ATOM 1699 CG2 VAL A 109 6.574 13.087 4.585 1.00 0.00 C ATOM 0 H VAL A 109 7.698 13.079 6.560 1.00 0.00 H new ATOM 0 HA VAL A 109 7.868 15.857 6.124 1.00 0.00 H new ATOM 0 HB VAL A 109 6.809 15.110 3.905 1.00 0.00 H new ATOM 0 HG11 VAL A 109 8.844 13.813 3.287 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.267 15.195 4.326 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.200 13.554 5.011 1.00 0.00 H new ATOM 0 HG21 VAL A 109 6.652 12.665 3.583 1.00 0.00 H new ATOM 0 HG22 VAL A 109 7.045 12.413 5.300 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.523 13.214 4.844 1.00 0.00 H new ATOM 1709 N LEU A 110 4.871 14.603 6.531 1.00 0.00 N ATOM 1710 CA LEU A 110 3.500 14.907 6.859 1.00 0.00 C ATOM 1711 C LEU A 110 3.454 15.638 8.196 1.00 0.00 C ATOM 1712 O LEU A 110 2.568 16.458 8.438 1.00 0.00 O ATOM 1713 CB LEU A 110 2.730 13.591 6.896 1.00 0.00 C ATOM 1714 CG LEU A 110 1.848 13.474 5.651 1.00 0.00 C ATOM 1715 CD1 LEU A 110 2.713 13.541 4.392 1.00 0.00 C ATOM 1716 CD2 LEU A 110 1.127 12.131 5.673 1.00 0.00 C ATOM 0 H LEU A 110 5.082 13.606 6.491 1.00 0.00 H new ATOM 0 HA LEU A 110 3.042 15.561 6.117 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.425 12.753 6.941 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.115 13.543 7.795 1.00 0.00 H new ATOM 0 HG LEU A 110 1.128 14.292 5.646 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.078 13.457 3.510 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.246 14.492 4.367 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.432 12.722 4.401 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.497 12.042 4.788 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.860 11.324 5.679 1.00 0.00 H new ATOM 0 HD23 LEU A 110 0.508 12.065 6.568 1.00 0.00 H new ATOM 1728 N ARG A 111 4.443 15.373 9.048 1.00 0.00 N ATOM 1729 CA ARG A 111 4.514 16.054 10.330 1.00 0.00 C ATOM 1730 C ARG A 111 4.557 17.551 10.068 1.00 0.00 C ATOM 1731 O ARG A 111 3.948 18.339 10.790 1.00 0.00 O ATOM 1732 CB ARG A 111 5.759 15.621 11.109 1.00 0.00 C ATOM 1733 CG ARG A 111 5.560 15.922 12.598 1.00 0.00 C ATOM 1734 CD ARG A 111 6.626 15.190 13.416 1.00 0.00 C ATOM 1735 NE ARG A 111 7.145 16.063 14.465 1.00 0.00 N ATOM 1736 CZ ARG A 111 8.131 15.666 15.266 1.00 0.00 C ATOM 1737 NH1 ARG A 111 8.655 14.480 15.118 1.00 0.00 N ATOM 1738 NH2 ARG A 111 8.576 16.465 16.197 1.00 0.00 N ATOM 0 H ARG A 111 5.192 14.703 8.874 1.00 0.00 H new ATOM 0 HA ARG A 111 3.641 15.797 10.931 1.00 0.00 H new ATOM 0 HB2 ARG A 111 5.940 14.556 10.963 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.637 16.148 10.735 1.00 0.00 H new ATOM 0 HG2 ARG A 111 5.625 16.996 12.774 1.00 0.00 H new ATOM 0 HG3 ARG A 111 4.565 15.607 12.913 1.00 0.00 H new ATOM 0 HD2 ARG A 111 6.200 14.290 13.860 1.00 0.00 H new ATOM 0 HD3 ARG A 111 7.439 14.870 12.764 1.00 0.00 H new ATOM 0 HE ARG A 111 6.745 16.993 14.586 1.00 0.00 H new ATOM 0 HH11 ARG A 111 8.309 13.857 14.388 1.00 0.00 H new ATOM 0 HH12 ARG A 111 9.411 14.176 15.732 1.00 0.00 H new ATOM 0 HH21 ARG A 111 8.168 17.393 16.310 1.00 0.00 H new ATOM 0 HH22 ARG A 111 9.332 16.161 16.811 1.00 0.00 H new ATOM 1752 N LEU A 112 5.251 17.928 8.994 1.00 0.00 N ATOM 1753 CA LEU A 112 5.325 19.330 8.612 1.00 0.00 C ATOM 1754 C LEU A 112 3.914 19.801 8.297 1.00 0.00 C ATOM 1755 O LEU A 112 3.560 20.958 8.522 1.00 0.00 O ATOM 1756 CB LEU A 112 6.225 19.508 7.387 1.00 0.00 C ATOM 1757 CG LEU A 112 7.196 20.665 7.630 1.00 0.00 C ATOM 1758 CD1 LEU A 112 8.265 20.673 6.536 1.00 0.00 C ATOM 1759 CD2 LEU A 112 6.428 21.988 7.599 1.00 0.00 C ATOM 0 H LEU A 112 5.762 17.290 8.384 1.00 0.00 H new ATOM 0 HA LEU A 112 5.752 19.917 9.425 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.779 18.589 7.193 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.619 19.708 6.503 1.00 0.00 H new ATOM 0 HG LEU A 112 7.672 20.541 8.603 1.00 0.00 H new ATOM 0 HD11 LEU A 112 8.957 21.497 6.709 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.812 19.730 6.555 1.00 0.00 H new ATOM 0 HD13 LEU A 112 7.789 20.797 5.563 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.118 22.814 7.772 1.00 0.00 H new ATOM 0 HD22 LEU A 112 5.953 22.110 6.626 1.00 0.00 H new ATOM 0 HD23 LEU A 112 5.665 21.984 8.377 1.00 0.00 H new ATOM 1771 N TYR A 113 3.105 18.863 7.804 1.00 0.00 N ATOM 1772 CA TYR A 113 1.701 19.143 7.493 1.00 0.00 C ATOM 1773 C TYR A 113 0.806 18.259 8.369 1.00 0.00 C ATOM 1774 O TYR A 113 0.379 17.188 7.950 1.00 0.00 O ATOM 1775 CB TYR A 113 1.424 18.867 6.013 1.00 0.00 C ATOM 1776 CG TYR A 113 2.112 19.916 5.173 1.00 0.00 C ATOM 1777 CD1 TYR A 113 3.470 19.782 4.861 1.00 0.00 C ATOM 1778 CD2 TYR A 113 1.393 21.023 4.711 1.00 0.00 C ATOM 1779 CE1 TYR A 113 4.108 20.756 4.084 1.00 0.00 C ATOM 1780 CE2 TYR A 113 2.030 21.997 3.935 1.00 0.00 C ATOM 1781 CZ TYR A 113 3.388 21.863 3.621 1.00 0.00 C ATOM 1782 OH TYR A 113 4.017 22.824 2.855 1.00 0.00 O ATOM 0 H TYR A 113 3.396 17.905 7.611 1.00 0.00 H new ATOM 0 HA TYR A 113 1.487 20.192 7.696 1.00 0.00 H new ATOM 0 HB2 TYR A 113 1.784 17.874 5.743 1.00 0.00 H new ATOM 0 HB3 TYR A 113 0.351 18.879 5.824 1.00 0.00 H new ATOM 0 HD1 TYR A 113 4.025 18.928 5.220 1.00 0.00 H new ATOM 0 HD2 TYR A 113 0.346 21.126 4.953 1.00 0.00 H new ATOM 0 HE1 TYR A 113 5.155 20.653 3.842 1.00 0.00 H new ATOM 0 HE2 TYR A 113 1.475 22.852 3.578 1.00 0.00 H new ATOM 0 HH TYR A 113 4.963 22.876 3.107 1.00 0.00 H new ATOM 1792 N PRO A 114 0.568 18.677 9.587 1.00 0.00 N ATOM 1793 CA PRO A 114 -0.237 17.904 10.593 1.00 0.00 C ATOM 1794 C PRO A 114 -1.707 17.665 10.226 1.00 0.00 C ATOM 1795 O PRO A 114 -2.236 16.586 10.488 1.00 0.00 O ATOM 1796 CB PRO A 114 -0.154 18.749 11.872 1.00 0.00 C ATOM 1797 CG PRO A 114 0.942 19.737 11.652 1.00 0.00 C ATOM 1798 CD PRO A 114 1.046 19.946 10.146 1.00 0.00 C ATOM 0 HA PRO A 114 0.171 16.897 10.677 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -1.100 19.255 12.066 1.00 0.00 H new ATOM 0 HB3 PRO A 114 0.056 18.122 12.739 1.00 0.00 H new ATOM 0 HG2 PRO A 114 0.724 20.677 12.159 1.00 0.00 H new ATOM 0 HG3 PRO A 114 1.884 19.367 12.058 1.00 0.00 H new ATOM 0 HD2 PRO A 114 0.435 20.785 9.815 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.071 20.158 9.841 1.00 0.00 H new ATOM 1806 N GLU A 115 -2.380 18.659 9.661 1.00 0.00 N ATOM 1807 CA GLU A 115 -3.795 18.489 9.330 1.00 0.00 C ATOM 1808 C GLU A 115 -3.969 17.485 8.203 1.00 0.00 C ATOM 1809 O GLU A 115 -4.722 16.514 8.318 1.00 0.00 O ATOM 1810 CB GLU A 115 -4.398 19.830 8.918 1.00 0.00 C ATOM 1811 CG GLU A 115 -4.877 20.573 10.165 1.00 0.00 C ATOM 1812 CD GLU A 115 -6.069 19.846 10.778 1.00 0.00 C ATOM 1813 OE1 GLU A 115 -7.185 20.130 10.373 1.00 0.00 O ATOM 1814 OE2 GLU A 115 -5.849 19.015 11.643 1.00 0.00 O ATOM 0 H GLU A 115 -1.985 19.570 9.426 1.00 0.00 H new ATOM 0 HA GLU A 115 -4.310 18.113 10.214 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.657 20.427 8.387 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -5.231 19.672 8.232 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.068 20.640 10.892 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -5.157 21.594 9.905 1.00 0.00 H new ATOM 1821 N TYR A 116 -3.247 17.717 7.125 1.00 0.00 N ATOM 1822 CA TYR A 116 -3.301 16.832 5.978 1.00 0.00 C ATOM 1823 C TYR A 116 -2.696 15.482 6.335 1.00 0.00 C ATOM 1824 O TYR A 116 -3.114 14.441 5.827 1.00 0.00 O ATOM 1825 CB TYR A 116 -2.528 17.463 4.824 1.00 0.00 C ATOM 1826 CG TYR A 116 -3.248 18.708 4.361 1.00 0.00 C ATOM 1827 CD1 TYR A 116 -4.553 18.618 3.860 1.00 0.00 C ATOM 1828 CD2 TYR A 116 -2.612 19.953 4.438 1.00 0.00 C ATOM 1829 CE1 TYR A 116 -5.220 19.774 3.437 1.00 0.00 C ATOM 1830 CE2 TYR A 116 -3.279 21.108 4.016 1.00 0.00 C ATOM 1831 CZ TYR A 116 -4.584 21.019 3.514 1.00 0.00 C ATOM 1832 OH TYR A 116 -5.242 22.157 3.096 1.00 0.00 O ATOM 0 H TYR A 116 -2.616 18.511 7.019 1.00 0.00 H new ATOM 0 HA TYR A 116 -4.339 16.681 5.681 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -1.516 17.712 5.143 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -2.438 16.754 4.001 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -5.044 17.658 3.800 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -1.606 20.022 4.824 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -6.226 19.705 3.051 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -2.788 22.068 4.077 1.00 0.00 H new ATOM 0 HH TYR A 116 -4.659 22.935 3.218 1.00 0.00 H new ATOM 1842 N ALA A 117 -1.692 15.521 7.198 1.00 0.00 N ATOM 1843 CA ALA A 117 -0.997 14.315 7.620 1.00 0.00 C ATOM 1844 C ALA A 117 -1.908 13.350 8.358 1.00 0.00 C ATOM 1845 O ALA A 117 -2.099 12.216 7.926 1.00 0.00 O ATOM 1846 CB ALA A 117 0.152 14.711 8.528 1.00 0.00 C ATOM 0 H ALA A 117 -1.339 16.379 7.621 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.637 13.804 6.727 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.684 13.817 8.853 1.00 0.00 H new ATOM 0 HB2 ALA A 117 0.837 15.363 7.985 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -0.238 15.238 9.399 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.472 13.795 9.466 1.00 0.00 N ATOM 1853 CA GLN A 118 -3.353 12.934 10.228 1.00 0.00 C ATOM 1854 C GLN A 118 -4.411 12.378 9.292 1.00 0.00 C ATOM 1855 O GLN A 118 -4.905 11.265 9.469 1.00 0.00 O ATOM 1856 CB GLN A 118 -4.012 13.730 11.352 1.00 0.00 C ATOM 1857 CG GLN A 118 -2.959 14.175 12.369 1.00 0.00 C ATOM 1858 CD GLN A 118 -2.092 12.994 12.792 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -0.936 12.807 12.217 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -2.478 12.221 13.669 1.00 0.00 N flip ATOM 0 H GLN A 118 -2.339 14.730 9.852 1.00 0.00 H new ATOM 0 HA GLN A 118 -2.785 12.116 10.672 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -4.522 14.601 10.941 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -4.769 13.120 11.844 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -2.334 14.956 11.936 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.448 14.606 13.243 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -3.382 12.369 14.117 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -1.894 11.433 13.947 1.00 0.00 H new ATOM 1869 N LYS A 119 -4.731 13.170 8.281 1.00 0.00 N ATOM 1870 CA LYS A 119 -5.711 12.781 7.279 1.00 0.00 C ATOM 1871 C LYS A 119 -5.151 11.709 6.335 1.00 0.00 C ATOM 1872 O LYS A 119 -5.915 10.960 5.725 1.00 0.00 O ATOM 1873 CB LYS A 119 -6.131 14.007 6.464 1.00 0.00 C ATOM 1874 CG LYS A 119 -7.656 14.145 6.480 1.00 0.00 C ATOM 1875 CD LYS A 119 -8.095 14.824 7.779 1.00 0.00 C ATOM 1876 CE LYS A 119 -9.567 15.228 7.674 1.00 0.00 C ATOM 1877 NZ LYS A 119 -9.780 16.522 8.383 1.00 0.00 N ATOM 0 H LYS A 119 -4.323 14.093 8.132 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.574 12.364 7.797 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.671 14.905 6.878 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.776 13.911 5.438 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.988 14.730 5.622 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -8.121 13.163 6.396 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.952 14.147 8.621 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -7.479 15.703 7.968 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -9.855 15.323 6.627 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -10.199 14.454 8.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -10.781 16.796 8.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -9.521 16.416 9.385 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -9.187 17.258 7.948 1.00 0.00 H new ATOM 1891 N PHE A 120 -3.823 11.663 6.179 1.00 0.00 N ATOM 1892 CA PHE A 120 -3.210 10.705 5.260 1.00 0.00 C ATOM 1893 C PHE A 120 -3.512 9.260 5.634 1.00 0.00 C ATOM 1894 O PHE A 120 -3.818 8.443 4.766 1.00 0.00 O ATOM 1895 CB PHE A 120 -1.699 10.944 5.215 1.00 0.00 C ATOM 1896 CG PHE A 120 -0.929 9.751 5.748 1.00 0.00 C ATOM 1897 CD1 PHE A 120 -0.664 8.650 4.919 1.00 0.00 C ATOM 1898 CD2 PHE A 120 -0.448 9.763 7.063 1.00 0.00 C ATOM 1899 CE1 PHE A 120 0.075 7.572 5.404 1.00 0.00 C ATOM 1900 CE2 PHE A 120 0.287 8.677 7.551 1.00 0.00 C ATOM 1901 CZ PHE A 120 0.550 7.583 6.723 1.00 0.00 C ATOM 0 H PHE A 120 -3.164 12.268 6.669 1.00 0.00 H new ATOM 0 HA PHE A 120 -3.642 10.866 4.272 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -1.393 11.147 4.189 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.452 11.829 5.802 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.033 8.638 3.904 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -0.645 10.612 7.701 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.282 6.728 4.763 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.651 8.685 8.568 1.00 0.00 H new ATOM 0 HZ PHE A 120 1.119 6.746 7.099 1.00 0.00 H new ATOM 1911 N VAL A 121 -3.407 8.938 6.912 1.00 0.00 N ATOM 1912 CA VAL A 121 -3.655 7.573 7.347 1.00 0.00 C ATOM 1913 C VAL A 121 -5.011 7.084 6.847 1.00 0.00 C ATOM 1914 O VAL A 121 -5.163 5.918 6.478 1.00 0.00 O ATOM 1915 CB VAL A 121 -3.611 7.492 8.874 1.00 0.00 C ATOM 1916 CG1 VAL A 121 -2.278 8.048 9.372 1.00 0.00 C ATOM 1917 CG2 VAL A 121 -4.758 8.318 9.460 1.00 0.00 C ATOM 0 H VAL A 121 -3.156 9.590 7.656 1.00 0.00 H new ATOM 0 HA VAL A 121 -2.877 6.935 6.928 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.713 6.453 9.188 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.244 7.992 10.460 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.460 7.462 8.952 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.178 9.087 9.059 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -4.728 8.261 10.548 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -4.655 9.357 9.148 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.709 7.925 9.102 1.00 0.00 H new ATOM 1927 N SER A 122 -5.995 7.978 6.839 1.00 0.00 N ATOM 1928 CA SER A 122 -7.335 7.620 6.387 1.00 0.00 C ATOM 1929 C SER A 122 -7.462 7.765 4.871 1.00 0.00 C ATOM 1930 O SER A 122 -7.992 6.881 4.198 1.00 0.00 O ATOM 1931 CB SER A 122 -8.370 8.510 7.074 1.00 0.00 C ATOM 1932 OG SER A 122 -8.350 9.800 6.476 1.00 0.00 O ATOM 0 H SER A 122 -5.891 8.948 7.138 1.00 0.00 H new ATOM 0 HA SER A 122 -7.514 6.577 6.650 1.00 0.00 H new ATOM 0 HB2 SER A 122 -9.363 8.070 6.983 1.00 0.00 H new ATOM 0 HB3 SER A 122 -8.151 8.587 8.139 1.00 0.00 H new ATOM 0 HG SER A 122 -7.425 10.115 6.410 1.00 0.00 H new ATOM 1938 N GLU A 123 -6.981 8.886 4.342 1.00 0.00 N ATOM 1939 CA GLU A 123 -7.056 9.136 2.904 1.00 0.00 C ATOM 1940 C GLU A 123 -6.435 7.986 2.118 1.00 0.00 C ATOM 1941 O GLU A 123 -6.870 7.675 1.009 1.00 0.00 O ATOM 1942 CB GLU A 123 -6.332 10.438 2.562 1.00 0.00 C ATOM 1943 CG GLU A 123 -7.342 11.587 2.523 1.00 0.00 C ATOM 1944 CD GLU A 123 -8.292 11.483 3.712 1.00 0.00 C ATOM 1945 OE1 GLU A 123 -7.831 11.649 4.830 1.00 0.00 O ATOM 1946 OE2 GLU A 123 -9.466 11.241 3.486 1.00 0.00 O ATOM 0 H GLU A 123 -6.539 9.631 4.881 1.00 0.00 H new ATOM 0 HA GLU A 123 -8.107 9.219 2.628 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.560 10.643 3.304 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -5.832 10.346 1.598 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -6.819 12.543 2.546 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -7.907 11.555 1.591 1.00 0.00 H new ATOM 1953 N ILE A 124 -5.416 7.360 2.694 1.00 0.00 N ATOM 1954 CA ILE A 124 -4.742 6.251 2.037 1.00 0.00 C ATOM 1955 C ILE A 124 -5.735 5.142 1.679 1.00 0.00 C ATOM 1956 O ILE A 124 -5.595 4.473 0.656 1.00 0.00 O ATOM 1957 CB ILE A 124 -3.676 5.685 2.975 1.00 0.00 C ATOM 1958 CG1 ILE A 124 -2.472 5.237 2.148 1.00 0.00 C ATOM 1959 CG2 ILE A 124 -4.248 4.495 3.757 1.00 0.00 C ATOM 1960 CD1 ILE A 124 -1.775 4.065 2.840 1.00 0.00 C ATOM 0 H ILE A 124 -5.041 7.601 3.611 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.284 6.618 1.118 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.366 6.453 3.684 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -2.795 4.942 1.150 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -1.775 6.066 2.026 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.483 4.096 4.424 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.106 4.824 4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -4.562 3.718 3.060 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -0.917 3.750 2.246 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -1.437 4.375 3.829 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -2.473 3.234 2.939 1.00 0.00 H new ATOM 1972 N GLN A 125 -6.720 4.942 2.551 1.00 0.00 N ATOM 1973 CA GLN A 125 -7.721 3.898 2.349 1.00 0.00 C ATOM 1974 C GLN A 125 -8.290 3.935 0.935 1.00 0.00 C ATOM 1975 O GLN A 125 -8.684 2.906 0.388 1.00 0.00 O ATOM 1976 CB GLN A 125 -8.848 4.053 3.370 1.00 0.00 C ATOM 1977 CG GLN A 125 -9.917 4.940 2.783 1.00 0.00 C ATOM 1978 CD GLN A 125 -10.820 4.139 1.851 1.00 0.00 C ATOM 1979 OE1 GLN A 125 -10.765 2.909 1.838 1.00 0.00 O ATOM 1980 NE2 GLN A 125 -11.651 4.765 1.064 1.00 0.00 N ATOM 0 H GLN A 125 -6.846 5.488 3.403 1.00 0.00 H new ATOM 0 HA GLN A 125 -7.233 2.933 2.488 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.264 3.078 3.624 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -8.464 4.486 4.294 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -10.511 5.383 3.583 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -9.456 5.762 2.235 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -11.695 5.784 1.076 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -12.256 4.235 0.437 1.00 0.00 H new ATOM 1989 N HIS A 126 -8.339 5.124 0.351 1.00 0.00 N ATOM 1990 CA HIS A 126 -8.873 5.274 -0.996 1.00 0.00 C ATOM 1991 C HIS A 126 -8.104 4.410 -1.994 1.00 0.00 C ATOM 1992 O HIS A 126 -8.536 4.236 -3.133 1.00 0.00 O ATOM 1993 CB HIS A 126 -8.804 6.736 -1.420 1.00 0.00 C ATOM 1994 CG HIS A 126 -8.977 6.836 -2.911 1.00 0.00 C ATOM 1995 ND1 HIS A 126 -9.857 6.022 -3.606 1.00 0.00 N ATOM 1996 CD2 HIS A 126 -8.393 7.648 -3.851 1.00 0.00 C ATOM 1997 CE1 HIS A 126 -9.779 6.359 -4.907 1.00 0.00 C ATOM 1998 NE2 HIS A 126 -8.901 7.344 -5.111 1.00 0.00 N ATOM 0 H HIS A 126 -8.019 5.991 0.783 1.00 0.00 H new ATOM 0 HA HIS A 126 -9.912 4.944 -0.988 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -9.581 7.309 -0.914 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -7.847 7.166 -1.125 1.00 0.00 H new ATOM 0 HD1 HIS A 126 -10.455 5.299 -3.205 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -7.653 8.407 -3.645 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -10.356 5.890 -5.690 1.00 0.00 H new ATOM 2007 N ASP A 127 -6.962 3.877 -1.567 1.00 0.00 N ATOM 2008 CA ASP A 127 -6.150 3.042 -2.450 1.00 0.00 C ATOM 2009 C ASP A 127 -5.966 1.638 -1.876 1.00 0.00 C ATOM 2010 O ASP A 127 -5.897 0.657 -2.616 1.00 0.00 O ATOM 2011 CB ASP A 127 -4.782 3.691 -2.654 1.00 0.00 C ATOM 2012 CG ASP A 127 -4.897 4.846 -3.644 1.00 0.00 C ATOM 2013 OD1 ASP A 127 -5.971 5.021 -4.197 1.00 0.00 O ATOM 2014 OD2 ASP A 127 -3.912 5.539 -3.833 1.00 0.00 O ATOM 0 H ASP A 127 -6.581 4.005 -0.629 1.00 0.00 H new ATOM 0 HA ASP A 127 -6.669 2.955 -3.404 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -4.397 4.054 -1.701 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.071 2.952 -3.025 1.00 0.00 H new ATOM 2019 N LEU A 128 -5.880 1.553 -0.554 1.00 0.00 N ATOM 2020 CA LEU A 128 -5.693 0.271 0.120 1.00 0.00 C ATOM 2021 C LEU A 128 -6.480 -0.841 -0.570 1.00 0.00 C ATOM 2022 O LEU A 128 -7.701 -0.917 -0.446 1.00 0.00 O ATOM 2023 CB LEU A 128 -6.158 0.392 1.574 1.00 0.00 C ATOM 2024 CG LEU A 128 -5.507 -0.696 2.434 1.00 0.00 C ATOM 2025 CD1 LEU A 128 -5.668 -2.060 1.761 1.00 0.00 C ATOM 2026 CD2 LEU A 128 -4.021 -0.386 2.607 1.00 0.00 C ATOM 0 H LEU A 128 -5.937 2.355 0.074 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.634 0.015 0.080 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.900 1.376 1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -7.243 0.304 1.624 1.00 0.00 H new ATOM 0 HG LEU A 128 -5.993 -0.719 3.409 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -5.202 -2.828 2.379 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -6.728 -2.284 1.641 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.188 -2.042 0.782 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -3.557 -1.160 3.219 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -3.539 -0.358 1.630 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -3.906 0.581 3.096 1.00 0.00 H new ATOM 2038 N THR A 129 -5.770 -1.718 -1.284 1.00 0.00 N ATOM 2039 CA THR A 129 -6.421 -2.835 -1.963 1.00 0.00 C ATOM 2040 C THR A 129 -6.369 -4.074 -1.082 1.00 0.00 C ATOM 2041 O THR A 129 -7.367 -4.773 -0.913 1.00 0.00 O ATOM 2042 CB THR A 129 -5.727 -3.134 -3.290 1.00 0.00 C ATOM 2043 OG1 THR A 129 -6.176 -2.216 -4.275 1.00 0.00 O ATOM 2044 CG2 THR A 129 -6.056 -4.564 -3.724 1.00 0.00 C ATOM 0 H THR A 129 -4.758 -1.676 -1.405 1.00 0.00 H new ATOM 0 HA THR A 129 -7.458 -2.563 -2.157 1.00 0.00 H new ATOM 0 HB THR A 129 -4.648 -3.033 -3.171 1.00 0.00 H new ATOM 0 HG1 THR A 129 -6.132 -1.305 -3.917 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.562 -4.780 -4.671 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.707 -5.264 -2.965 1.00 0.00 H new ATOM 0 HG23 THR A 129 -7.134 -4.668 -3.846 1.00 0.00 H new ATOM 2052 N TYR A 130 -5.195 -4.333 -0.516 1.00 0.00 N ATOM 2053 CA TYR A 130 -5.019 -5.485 0.354 1.00 0.00 C ATOM 2054 C TYR A 130 -4.289 -5.062 1.621 1.00 0.00 C ATOM 2055 O TYR A 130 -3.214 -4.465 1.564 1.00 0.00 O ATOM 2056 CB TYR A 130 -4.230 -6.576 -0.370 1.00 0.00 C ATOM 2057 CG TYR A 130 -4.576 -7.918 0.225 1.00 0.00 C ATOM 2058 CD1 TYR A 130 -3.837 -8.419 1.302 1.00 0.00 C ATOM 2059 CD2 TYR A 130 -5.642 -8.661 -0.298 1.00 0.00 C ATOM 2060 CE1 TYR A 130 -4.159 -9.663 1.855 1.00 0.00 C ATOM 2061 CE2 TYR A 130 -5.966 -9.905 0.256 1.00 0.00 C ATOM 2062 CZ TYR A 130 -5.225 -10.406 1.332 1.00 0.00 C ATOM 2063 OH TYR A 130 -5.544 -11.633 1.878 1.00 0.00 O ATOM 0 H TYR A 130 -4.358 -3.764 -0.644 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.997 -5.884 0.622 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -4.465 -6.566 -1.434 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -3.160 -6.389 -0.278 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -3.017 -7.845 1.707 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -6.214 -8.274 -1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -3.586 -10.050 2.685 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -6.788 -10.478 -0.147 1.00 0.00 H new ATOM 0 HH TYR A 130 -5.494 -12.323 1.184 1.00 0.00 H new ATOM 2073 N ASN A 131 -4.894 -5.356 2.765 1.00 0.00 N ATOM 2074 CA ASN A 131 -4.313 -4.984 4.047 1.00 0.00 C ATOM 2075 C ASN A 131 -3.372 -6.066 4.564 1.00 0.00 C ATOM 2076 O ASN A 131 -3.815 -7.136 4.985 1.00 0.00 O ATOM 2077 CB ASN A 131 -5.432 -4.756 5.067 1.00 0.00 C ATOM 2078 CG ASN A 131 -5.439 -3.304 5.527 1.00 0.00 C ATOM 2079 OD1 ASN A 131 -5.221 -2.395 4.726 1.00 0.00 O ATOM 2080 ND2 ASN A 131 -5.677 -3.029 6.781 1.00 0.00 N ATOM 0 H ASN A 131 -5.784 -5.850 2.831 1.00 0.00 H new ATOM 0 HA ASN A 131 -3.738 -4.068 3.907 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -6.395 -5.009 4.623 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -5.293 -5.415 5.924 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -5.683 -2.060 7.098 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -5.857 -3.784 7.443 1.00 0.00 H new ATOM 2087 N LEU A 132 -2.073 -5.777 4.551 1.00 0.00 N ATOM 2088 CA LEU A 132 -1.094 -6.735 5.048 1.00 0.00 C ATOM 2089 C LEU A 132 -1.132 -6.729 6.570 1.00 0.00 C ATOM 2090 O LEU A 132 -0.816 -5.722 7.200 1.00 0.00 O ATOM 2091 CB LEU A 132 0.307 -6.345 4.563 1.00 0.00 C ATOM 2092 CG LEU A 132 0.681 -7.138 3.304 1.00 0.00 C ATOM 2093 CD1 LEU A 132 1.205 -8.521 3.698 1.00 0.00 C ATOM 2094 CD2 LEU A 132 -0.548 -7.294 2.403 1.00 0.00 C ATOM 0 H LEU A 132 -1.680 -4.901 4.207 1.00 0.00 H new ATOM 0 HA LEU A 132 -1.330 -7.732 4.676 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.340 -5.277 4.350 1.00 0.00 H new ATOM 0 HB3 LEU A 132 1.037 -6.536 5.350 1.00 0.00 H new ATOM 0 HG LEU A 132 1.458 -6.598 2.763 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.469 -9.079 2.800 1.00 0.00 H new ATOM 0 HD12 LEU A 132 2.087 -8.410 4.329 1.00 0.00 H new ATOM 0 HD13 LEU A 132 0.433 -9.060 4.247 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -0.276 -7.858 1.511 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -1.331 -7.826 2.944 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -0.913 -6.309 2.112 1.00 0.00 H new ATOM 2106 N ARG A 133 -1.534 -7.847 7.159 1.00 0.00 N ATOM 2107 CA ARG A 133 -1.627 -7.934 8.611 1.00 0.00 C ATOM 2108 C ARG A 133 -0.458 -8.712 9.204 1.00 0.00 C ATOM 2109 O ARG A 133 0.131 -9.572 8.549 1.00 0.00 O ATOM 2110 CB ARG A 133 -2.941 -8.606 9.009 1.00 0.00 C ATOM 2111 CG ARG A 133 -4.105 -7.657 8.718 1.00 0.00 C ATOM 2112 CD ARG A 133 -5.312 -8.052 9.568 1.00 0.00 C ATOM 2113 NE ARG A 133 -4.911 -8.247 10.957 1.00 0.00 N ATOM 2114 CZ ARG A 133 -4.889 -7.232 11.815 1.00 0.00 C ATOM 2115 NH1 ARG A 133 -5.231 -6.036 11.420 1.00 0.00 N ATOM 2116 NH2 ARG A 133 -4.527 -7.432 13.054 1.00 0.00 N ATOM 0 H ARG A 133 -1.798 -8.697 6.661 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.594 -6.919 9.006 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -3.069 -9.536 8.456 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -2.924 -8.865 10.068 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.814 -6.630 8.937 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -4.364 -7.696 7.660 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -6.076 -7.277 9.508 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -5.756 -8.968 9.178 1.00 0.00 H new ATOM 0 HE ARG A 133 -4.643 -9.178 11.275 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -5.515 -5.880 10.453 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -5.214 -5.257 12.078 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -4.261 -8.367 13.363 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -4.510 -6.653 13.712 1.00 0.00 H new ATOM 2130 N GLU A 134 -0.137 -8.400 10.455 1.00 0.00 N ATOM 2131 CA GLU A 134 0.955 -9.071 11.148 1.00 0.00 C ATOM 2132 C GLU A 134 0.439 -10.297 11.895 1.00 0.00 C ATOM 2133 O GLU A 134 -0.701 -10.319 12.359 1.00 0.00 O ATOM 2134 CB GLU A 134 1.608 -8.106 12.138 1.00 0.00 C ATOM 2135 CG GLU A 134 0.541 -7.179 12.722 1.00 0.00 C ATOM 2136 CD GLU A 134 -0.609 -8.001 13.291 1.00 0.00 C ATOM 2137 OE1 GLU A 134 -0.488 -8.454 14.417 1.00 0.00 O ATOM 2138 OE2 GLU A 134 -1.595 -8.167 12.592 1.00 0.00 O ATOM 0 H GLU A 134 -0.616 -7.689 11.008 1.00 0.00 H new ATOM 0 HA GLU A 134 1.691 -9.392 10.411 1.00 0.00 H new ATOM 0 HB2 GLU A 134 2.098 -8.663 12.936 1.00 0.00 H new ATOM 0 HB3 GLU A 134 2.380 -7.521 11.638 1.00 0.00 H new ATOM 0 HG2 GLU A 134 0.976 -6.557 13.504 1.00 0.00 H new ATOM 0 HG3 GLU A 134 0.170 -6.506 11.949 1.00 0.00 H new ATOM 2145 N GLY A 135 1.285 -11.316 12.005 1.00 0.00 N ATOM 2146 CA GLY A 135 0.902 -12.541 12.698 1.00 0.00 C ATOM 2147 C GLY A 135 -0.212 -13.264 11.949 1.00 0.00 C ATOM 2148 O GLY A 135 -0.679 -14.319 12.376 1.00 0.00 O ATOM 0 H GLY A 135 2.232 -11.319 11.627 1.00 0.00 H new ATOM 0 HA2 GLY A 135 1.768 -13.197 12.792 1.00 0.00 H new ATOM 0 HA3 GLY A 135 0.571 -12.303 13.709 1.00 0.00 H new