USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1029 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 114 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 118 MET CE :methyl 151:sc= -0.572 (180deg=-1.29) USER MOD Set 2.1: A 43 LYS NZ :NH3+ -107:sc= -2.09 (180deg=0) USER MOD Set 2.2: A 46 LYS NZ :NH3+ -102:sc= -3.45 (180deg=-2.79!) USER MOD Set 3.1: A 35 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 38 LYS NZ :NH3+ -135:sc= -0.0331 (180deg=-1.17) USER MOD Single : A 36 SER OG : rot -140:sc= -0.273 USER MOD Single : A 37 SER OG : rot -75:sc= 0.768 USER MOD Single : A 41 LYS NZ :NH3+ -178:sc= -2.35 (180deg=-2.47) USER MOD Single : A 42 ASN : amide:sc= -0.243 X(o=-0.24,f=-0.37) USER MOD Single : A 48 LYS NZ :NH3+ -133:sc= 0 (180deg=-0.278) USER MOD Single : A 49 LYS NZ :NH3+ -160:sc= -0.0526 (180deg=-0.499) USER MOD Single : A 52 THR OG1 : rot 111:sc= 1.19 USER MOD Single : A 54 LYS NZ :NH3+ 158:sc= -0.165 (180deg=-0.86) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 GLN : amide:sc= -0.122 X(o=-0.12,f=-0.16) USER MOD Single : A 88 THR OG1 : rot -30:sc= 0.558 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 LYS NZ :NH3+ 132:sc= -0.0247 (180deg=-0.346) USER MOD Single : A 101 LYS NZ :NH3+ 153:sc= -0.301 (180deg=-1.19) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 107 ASN : amide:sc= -0.115 K(o=-0.12,f=-1.3) USER MOD Single : A 108 SER OG : rot 180:sc= -0.334 USER MOD Single : A 110 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.19) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ 154:sc= 0 (180deg=-0.0104) USER MOD Single : A 141 SER OG : rot -28:sc= 0.643 USER MOD Single : A 142 LYS NZ :NH3+ -156:sc= -0.345 (180deg=-1.24) USER MOD Single : A 143 ASN :FLIP amide:sc= -0.0317 F(o=-1.1,f=-0.032) USER MOD Single : A 144 ASN : amide:sc= 0.742 K(o=0.74,f=-5.5!) USER MOD Single : A 147 ASN : amide:sc= -1.06 K(o=-1.1,f=-2.6!) USER MOD Single : A 148 THR OG1 : rot -62:sc= -2.21 USER MOD Single : A 156 LYS NZ :NH3+ -144:sc= -2.4 (180deg=-7.14!) USER MOD Single : A 158 GLN :FLIP amide:sc= -3.16! C(o=-5.6!,f=-3.2!) USER MOD Single : A 161 ASN : amide:sc= -0.0287 K(o=-0.029,f=-1.7!) USER MOD Single : A 162 GLN :FLIP amide:sc= -0.348 F(o=-1.1,f=-0.35) USER MOD Single : A 164 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 169 LYS NZ :NH3+ 159:sc= -0.0437 (180deg=-0.484) USER MOD Single : A 170 GLN : amide:sc= -2.68! C(o=-2.7!,f=-3.5!) USER MOD ----------------------------------------------------------------- ATOM 163 N ALA A 32 7.715 15.300 -0.957 1.00 0.00 N ATOM 164 CA ALA A 32 7.930 13.910 -1.355 1.00 0.00 C ATOM 165 C ALA A 32 6.954 12.980 -0.634 1.00 0.00 C ATOM 166 O ALA A 32 6.713 11.855 -1.069 1.00 0.00 O ATOM 167 CB ALA A 32 9.359 13.487 -1.014 1.00 0.00 C ATOM 0 HA ALA A 32 7.764 13.837 -2.430 1.00 0.00 H new ATOM 0 HB1 ALA A 32 9.513 12.450 -1.313 1.00 0.00 H new ATOM 0 HB2 ALA A 32 10.064 14.126 -1.545 1.00 0.00 H new ATOM 0 HB3 ALA A 32 9.520 13.583 0.060 1.00 0.00 H new ATOM 173 N LEU A 33 6.391 13.462 0.466 1.00 0.00 N ATOM 174 CA LEU A 33 5.435 12.678 1.240 1.00 0.00 C ATOM 175 C LEU A 33 6.031 11.331 1.612 1.00 0.00 C ATOM 176 O LEU A 33 5.318 10.423 2.031 1.00 0.00 O ATOM 177 CB LEU A 33 4.119 12.484 0.418 1.00 0.00 C ATOM 178 CG LEU A 33 2.990 13.371 0.971 1.00 0.00 C ATOM 179 CD1 LEU A 33 3.288 14.842 0.658 1.00 0.00 C ATOM 180 CD2 LEU A 33 1.670 12.961 0.329 1.00 0.00 C ATOM 0 H LEU A 33 6.579 14.391 0.843 1.00 0.00 H new ATOM 0 HA LEU A 33 5.201 13.214 2.160 1.00 0.00 H new ATOM 0 HB2 LEU A 33 4.300 12.729 -0.629 1.00 0.00 H new ATOM 0 HB3 LEU A 33 3.815 11.438 0.452 1.00 0.00 H new ATOM 0 HG LEU A 33 2.922 13.246 2.052 1.00 0.00 H new ATOM 0 HD11 LEU A 33 2.486 15.467 1.051 1.00 0.00 H new ATOM 0 HD12 LEU A 33 4.232 15.129 1.121 1.00 0.00 H new ATOM 0 HD13 LEU A 33 3.358 14.977 -0.421 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.867 13.587 0.718 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.737 13.086 -0.752 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.461 11.917 0.561 1.00 0.00 H new ATOM 192 N GLU A 34 7.332 11.210 1.453 1.00 0.00 N ATOM 193 CA GLU A 34 7.997 9.963 1.769 1.00 0.00 C ATOM 194 C GLU A 34 7.735 9.567 3.220 1.00 0.00 C ATOM 195 O GLU A 34 7.339 8.440 3.504 1.00 0.00 O ATOM 196 CB GLU A 34 9.502 10.114 1.545 1.00 0.00 C ATOM 197 CG GLU A 34 10.193 8.761 1.733 1.00 0.00 C ATOM 198 CD GLU A 34 11.681 8.880 1.416 1.00 0.00 C ATOM 199 OE1 GLU A 34 12.151 9.997 1.260 1.00 0.00 O ATOM 200 OE2 GLU A 34 12.329 7.853 1.342 1.00 0.00 O ATOM 0 H GLU A 34 7.945 11.950 1.111 1.00 0.00 H new ATOM 0 HA GLU A 34 7.604 9.183 1.117 1.00 0.00 H new ATOM 0 HB2 GLU A 34 9.693 10.494 0.541 1.00 0.00 H new ATOM 0 HB3 GLU A 34 9.912 10.842 2.245 1.00 0.00 H new ATOM 0 HG2 GLU A 34 10.059 8.415 2.758 1.00 0.00 H new ATOM 0 HG3 GLU A 34 9.734 8.016 1.083 1.00 0.00 H new ATOM 207 N SER A 35 7.953 10.499 4.136 1.00 0.00 N ATOM 208 CA SER A 35 7.738 10.234 5.547 1.00 0.00 C ATOM 209 C SER A 35 6.257 10.105 5.845 1.00 0.00 C ATOM 210 O SER A 35 5.865 9.312 6.690 1.00 0.00 O ATOM 211 CB SER A 35 8.335 11.358 6.390 1.00 0.00 C ATOM 212 OG SER A 35 8.215 11.025 7.766 1.00 0.00 O ATOM 0 H SER A 35 8.278 11.443 3.926 1.00 0.00 H new ATOM 0 HA SER A 35 8.231 9.295 5.798 1.00 0.00 H new ATOM 0 HB2 SER A 35 9.383 11.507 6.130 1.00 0.00 H new ATOM 0 HB3 SER A 35 7.819 12.296 6.184 1.00 0.00 H new ATOM 0 HG SER A 35 8.599 11.743 8.311 1.00 0.00 H new ATOM 218 N SER A 36 5.441 10.898 5.152 1.00 0.00 N ATOM 219 CA SER A 36 3.995 10.875 5.365 1.00 0.00 C ATOM 220 C SER A 36 3.453 9.452 5.277 1.00 0.00 C ATOM 221 O SER A 36 2.365 9.156 5.775 1.00 0.00 O ATOM 222 CB SER A 36 3.302 11.756 4.322 1.00 0.00 C ATOM 223 OG SER A 36 3.963 13.012 4.253 1.00 0.00 O ATOM 0 H SER A 36 5.754 11.561 4.442 1.00 0.00 H new ATOM 0 HA SER A 36 3.790 11.261 6.364 1.00 0.00 H new ATOM 0 HB2 SER A 36 3.321 11.268 3.347 1.00 0.00 H new ATOM 0 HB3 SER A 36 2.254 11.898 4.587 1.00 0.00 H new ATOM 0 HG SER A 36 3.299 13.726 4.157 1.00 0.00 H new ATOM 229 N SER A 37 4.216 8.575 4.637 1.00 0.00 N ATOM 230 CA SER A 37 3.802 7.186 4.486 1.00 0.00 C ATOM 231 C SER A 37 3.557 6.546 5.841 1.00 0.00 C ATOM 232 O SER A 37 2.817 5.574 5.945 1.00 0.00 O ATOM 233 CB SER A 37 4.872 6.404 3.731 1.00 0.00 C ATOM 234 OG SER A 37 6.119 6.542 4.407 1.00 0.00 O ATOM 0 H SER A 37 5.118 8.798 4.217 1.00 0.00 H new ATOM 0 HA SER A 37 2.871 7.165 3.920 1.00 0.00 H new ATOM 0 HB2 SER A 37 4.594 5.352 3.668 1.00 0.00 H new ATOM 0 HB3 SER A 37 4.956 6.773 2.709 1.00 0.00 H new ATOM 0 HG SER A 37 6.482 7.438 4.244 1.00 0.00 H new ATOM 240 N LYS A 38 4.164 7.111 6.872 1.00 0.00 N ATOM 241 CA LYS A 38 3.997 6.607 8.228 1.00 0.00 C ATOM 242 C LYS A 38 2.531 6.640 8.641 1.00 0.00 C ATOM 243 O LYS A 38 2.136 5.974 9.597 1.00 0.00 O ATOM 244 CB LYS A 38 4.822 7.439 9.206 1.00 0.00 C ATOM 245 CG LYS A 38 4.279 8.872 9.269 1.00 0.00 C ATOM 246 CD LYS A 38 5.215 9.738 10.100 1.00 0.00 C ATOM 247 CE LYS A 38 4.637 11.147 10.194 1.00 0.00 C ATOM 248 NZ LYS A 38 4.666 11.791 8.850 1.00 0.00 N ATOM 0 H LYS A 38 4.779 7.921 6.797 1.00 0.00 H new ATOM 0 HA LYS A 38 4.344 5.574 8.250 1.00 0.00 H new ATOM 0 HB2 LYS A 38 4.791 6.986 10.197 1.00 0.00 H new ATOM 0 HB3 LYS A 38 5.866 7.451 8.894 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.187 9.281 8.263 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.281 8.874 9.707 1.00 0.00 H new ATOM 0 HD2 LYS A 38 5.335 9.313 11.097 1.00 0.00 H new ATOM 0 HD3 LYS A 38 6.205 9.767 9.644 1.00 0.00 H new ATOM 0 HE2 LYS A 38 3.614 11.107 10.567 1.00 0.00 H new ATOM 0 HE3 LYS A 38 5.212 11.740 10.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 5.022 12.764 8.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 5.292 11.250 8.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 3.705 11.809 8.453 1.00 0.00 H new ATOM 262 N ASP A 39 1.738 7.430 7.924 1.00 0.00 N ATOM 263 CA ASP A 39 0.328 7.557 8.242 1.00 0.00 C ATOM 264 C ASP A 39 -0.391 6.219 8.117 1.00 0.00 C ATOM 265 O ASP A 39 -1.142 5.829 9.006 1.00 0.00 O ATOM 266 CB ASP A 39 -0.319 8.578 7.292 1.00 0.00 C ATOM 267 CG ASP A 39 0.203 9.983 7.589 1.00 0.00 C ATOM 268 OD1 ASP A 39 0.214 10.353 8.748 1.00 0.00 O ATOM 269 OD2 ASP A 39 0.580 10.662 6.648 1.00 0.00 O ATOM 0 H ASP A 39 2.048 7.986 7.127 1.00 0.00 H new ATOM 0 HA ASP A 39 0.239 7.895 9.274 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -0.100 8.312 6.258 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -1.403 8.554 7.405 1.00 0.00 H new ATOM 274 N LEU A 40 -0.177 5.526 7.001 1.00 0.00 N ATOM 275 CA LEU A 40 -0.840 4.260 6.782 1.00 0.00 C ATOM 276 C LEU A 40 -0.482 3.277 7.897 1.00 0.00 C ATOM 277 O LEU A 40 -1.349 2.771 8.603 1.00 0.00 O ATOM 278 CB LEU A 40 -0.410 3.698 5.403 1.00 0.00 C ATOM 279 CG LEU A 40 -1.532 2.829 4.812 1.00 0.00 C ATOM 280 CD1 LEU A 40 -1.074 2.250 3.480 1.00 0.00 C ATOM 281 CD2 LEU A 40 -1.887 1.696 5.792 1.00 0.00 C ATOM 0 H LEU A 40 0.444 5.822 6.248 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.920 4.405 6.792 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -0.179 4.518 4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 40 0.500 3.107 5.510 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.420 3.440 4.650 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.868 1.633 3.059 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -0.841 3.062 2.791 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -0.184 1.640 3.635 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -2.683 1.084 5.368 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.007 1.077 5.967 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.223 2.124 6.736 1.00 0.00 H new ATOM 293 N LYS A 41 0.799 3.009 8.052 1.00 0.00 N ATOM 294 CA LYS A 41 1.252 2.077 9.079 1.00 0.00 C ATOM 295 C LYS A 41 0.783 2.540 10.437 1.00 0.00 C ATOM 296 O LYS A 41 0.466 1.724 11.298 1.00 0.00 O ATOM 297 CB LYS A 41 2.775 1.971 9.065 1.00 0.00 C ATOM 298 CG LYS A 41 3.254 1.437 7.666 1.00 0.00 C ATOM 299 CD LYS A 41 3.740 2.607 6.760 1.00 0.00 C ATOM 300 CE LYS A 41 5.233 2.866 7.017 1.00 0.00 C ATOM 301 NZ LYS A 41 5.515 2.745 8.485 1.00 0.00 N ATOM 0 H LYS A 41 1.544 3.417 7.487 1.00 0.00 H new ATOM 0 HA LYS A 41 0.830 1.094 8.870 1.00 0.00 H new ATOM 0 HB2 LYS A 41 3.219 2.946 9.265 1.00 0.00 H new ATOM 0 HB3 LYS A 41 3.110 1.300 9.856 1.00 0.00 H new ATOM 0 HG2 LYS A 41 4.062 0.719 7.804 1.00 0.00 H new ATOM 0 HG3 LYS A 41 2.437 0.907 7.176 1.00 0.00 H new ATOM 0 HD2 LYS A 41 3.578 2.360 5.711 1.00 0.00 H new ATOM 0 HD3 LYS A 41 3.162 3.507 6.969 1.00 0.00 H new ATOM 0 HE2 LYS A 41 5.838 2.152 6.459 1.00 0.00 H new ATOM 0 HE3 LYS A 41 5.507 3.860 6.664 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 6.518 2.953 8.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 4.922 3.420 9.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 5.301 1.778 8.801 1.00 0.00 H new ATOM 315 N ASN A 42 0.738 3.852 10.624 1.00 0.00 N ATOM 316 CA ASN A 42 0.296 4.432 11.881 1.00 0.00 C ATOM 317 C ASN A 42 -1.217 4.324 11.990 1.00 0.00 C ATOM 318 O ASN A 42 -1.782 4.491 13.067 1.00 0.00 O ATOM 319 CB ASN A 42 0.727 5.895 11.979 1.00 0.00 C ATOM 320 CG ASN A 42 0.181 6.518 13.259 1.00 0.00 C ATOM 321 OD1 ASN A 42 0.334 5.956 14.344 1.00 0.00 O ATOM 322 ND2 ASN A 42 -0.465 7.649 13.190 1.00 0.00 N ATOM 0 H ASN A 42 1.004 4.536 9.916 1.00 0.00 H new ATOM 0 HA ASN A 42 0.756 3.883 12.703 1.00 0.00 H new ATOM 0 HB2 ASN A 42 1.815 5.963 11.968 1.00 0.00 H new ATOM 0 HB3 ASN A 42 0.364 6.448 11.113 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -0.846 8.071 14.037 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -0.589 8.111 12.289 1.00 0.00 H new ATOM 329 N LYS A 43 -1.878 4.085 10.857 1.00 0.00 N ATOM 330 CA LYS A 43 -3.333 3.985 10.840 1.00 0.00 C ATOM 331 C LYS A 43 -3.773 2.604 11.272 1.00 0.00 C ATOM 332 O LYS A 43 -4.441 2.460 12.290 1.00 0.00 O ATOM 333 CB LYS A 43 -3.865 4.267 9.435 1.00 0.00 C ATOM 334 CG LYS A 43 -5.400 4.379 9.472 1.00 0.00 C ATOM 335 CD LYS A 43 -5.843 5.701 10.198 1.00 0.00 C ATOM 336 CE LYS A 43 -6.618 5.365 11.476 1.00 0.00 C ATOM 337 NZ LYS A 43 -6.940 6.622 12.182 1.00 0.00 N ATOM 0 H LYS A 43 -1.432 3.958 9.948 1.00 0.00 H new ATOM 0 HA LYS A 43 -3.734 4.723 11.535 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -3.433 5.191 9.051 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -3.566 3.469 8.756 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -5.795 4.366 8.456 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.820 3.516 9.989 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -4.967 6.302 10.442 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -6.465 6.300 9.533 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -7.532 4.824 11.232 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.024 4.713 12.117 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -6.341 6.709 13.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.766 7.429 11.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.940 6.614 12.466 1.00 0.00 H new ATOM 351 N ILE A 44 -3.423 1.595 10.482 1.00 0.00 N ATOM 352 CA ILE A 44 -3.800 0.210 10.783 1.00 0.00 C ATOM 353 C ILE A 44 -3.647 -0.073 12.263 1.00 0.00 C ATOM 354 O ILE A 44 -4.281 -0.979 12.798 1.00 0.00 O ATOM 355 CB ILE A 44 -2.899 -0.748 9.991 1.00 0.00 C ATOM 356 CG1 ILE A 44 -3.088 -0.499 8.488 1.00 0.00 C ATOM 357 CG2 ILE A 44 -3.269 -2.206 10.312 1.00 0.00 C ATOM 358 CD1 ILE A 44 -1.967 -1.186 7.712 1.00 0.00 C ATOM 0 H ILE A 44 -2.878 1.706 9.627 1.00 0.00 H new ATOM 0 HA ILE A 44 -4.842 0.063 10.501 1.00 0.00 H new ATOM 0 HB ILE A 44 -1.860 -0.571 10.269 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -4.056 -0.882 8.164 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -3.084 0.571 8.283 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -2.624 -2.878 9.745 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -3.136 -2.389 11.378 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.309 -2.386 10.040 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.102 -1.009 6.645 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -1.005 -0.782 8.028 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -1.993 -2.258 7.908 1.00 0.00 H new ATOM 370 N LEU A 45 -2.810 0.710 12.940 1.00 0.00 N ATOM 371 CA LEU A 45 -2.602 0.532 14.357 1.00 0.00 C ATOM 372 C LEU A 45 -3.957 0.380 15.062 1.00 0.00 C ATOM 373 O LEU A 45 -4.085 -0.391 16.010 1.00 0.00 O ATOM 374 CB LEU A 45 -1.795 1.756 14.913 1.00 0.00 C ATOM 375 CG LEU A 45 -2.607 2.553 16.000 1.00 0.00 C ATOM 376 CD1 LEU A 45 -1.686 3.159 17.027 1.00 0.00 C ATOM 377 CD2 LEU A 45 -3.495 3.636 15.335 1.00 0.00 C ATOM 0 H LEU A 45 -2.271 1.469 12.523 1.00 0.00 H new ATOM 0 HA LEU A 45 -2.026 -0.374 14.546 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.858 1.406 15.345 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.537 2.424 14.091 1.00 0.00 H new ATOM 0 HG LEU A 45 -3.262 1.851 16.517 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -2.273 3.704 17.766 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -1.123 2.368 17.523 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.994 3.844 16.536 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.048 4.176 16.104 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -2.866 4.334 14.783 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -4.197 3.161 14.650 1.00 0.00 H new ATOM 389 N LYS A 46 -4.946 1.152 14.610 1.00 0.00 N ATOM 390 CA LYS A 46 -6.255 1.124 15.226 1.00 0.00 C ATOM 391 C LYS A 46 -6.971 -0.139 14.837 1.00 0.00 C ATOM 392 O LYS A 46 -7.473 -0.852 15.697 1.00 0.00 O ATOM 393 CB LYS A 46 -7.069 2.340 14.795 1.00 0.00 C ATOM 394 CG LYS A 46 -8.397 2.369 15.570 1.00 0.00 C ATOM 395 CD LYS A 46 -9.219 3.589 15.136 1.00 0.00 C ATOM 396 CE LYS A 46 -8.527 4.905 15.570 1.00 0.00 C ATOM 397 NZ LYS A 46 -7.626 5.359 14.474 1.00 0.00 N ATOM 0 H LYS A 46 -4.858 1.797 13.825 1.00 0.00 H new ATOM 0 HA LYS A 46 -6.137 1.151 16.309 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -6.505 3.254 14.984 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -7.262 2.300 13.723 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -8.959 1.454 15.383 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -8.203 2.411 16.642 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.346 3.580 14.053 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.215 3.536 15.575 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -9.273 5.670 15.786 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -7.957 4.747 16.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -6.642 5.122 14.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -7.891 4.884 13.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -7.715 6.388 14.355 1.00 0.00 H new ATOM 411 N ILE A 47 -7.003 -0.408 13.535 1.00 0.00 N ATOM 412 CA ILE A 47 -7.673 -1.602 13.026 1.00 0.00 C ATOM 413 C ILE A 47 -7.304 -2.820 13.856 1.00 0.00 C ATOM 414 O ILE A 47 -8.103 -3.745 14.008 1.00 0.00 O ATOM 415 CB ILE A 47 -7.275 -1.849 11.570 1.00 0.00 C ATOM 416 CG1 ILE A 47 -7.613 -0.605 10.726 1.00 0.00 C ATOM 417 CG2 ILE A 47 -8.020 -3.072 11.014 1.00 0.00 C ATOM 418 CD1 ILE A 47 -9.126 -0.307 10.743 1.00 0.00 C ATOM 0 H ILE A 47 -6.577 0.179 12.818 1.00 0.00 H new ATOM 0 HA ILE A 47 -8.749 -1.439 13.090 1.00 0.00 H new ATOM 0 HB ILE A 47 -6.203 -2.041 11.523 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -7.067 0.256 11.110 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -7.283 -0.760 9.699 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -7.727 -3.236 9.977 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -7.768 -3.952 11.606 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -9.095 -2.897 11.064 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -9.330 0.577 10.138 1.00 0.00 H new ATOM 0 HD12 ILE A 47 -9.669 -1.159 10.335 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -9.450 -0.127 11.768 1.00 0.00 H new ATOM 430 N LYS A 48 -6.101 -2.803 14.403 1.00 0.00 N ATOM 431 CA LYS A 48 -5.636 -3.903 15.241 1.00 0.00 C ATOM 432 C LYS A 48 -6.313 -3.874 16.610 1.00 0.00 C ATOM 433 O LYS A 48 -6.597 -4.920 17.197 1.00 0.00 O ATOM 434 CB LYS A 48 -4.131 -3.807 15.418 1.00 0.00 C ATOM 435 CG LYS A 48 -3.451 -3.948 14.056 1.00 0.00 C ATOM 436 CD LYS A 48 -1.944 -3.677 14.195 1.00 0.00 C ATOM 437 CE LYS A 48 -1.281 -4.760 15.065 1.00 0.00 C ATOM 438 NZ LYS A 48 0.184 -4.734 14.852 1.00 0.00 N ATOM 0 H LYS A 48 -5.429 -2.045 14.285 1.00 0.00 H new ATOM 0 HA LYS A 48 -5.893 -4.841 14.749 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -3.867 -2.852 15.872 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.782 -4.588 16.094 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.614 -4.950 13.660 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.891 -3.249 13.345 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.479 -3.659 13.209 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -1.784 -2.695 14.641 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -1.510 -4.587 16.117 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.679 -5.742 14.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 0.530 -5.703 14.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 0.403 -4.154 14.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.649 -4.326 15.688 1.00 0.00 H new ATOM 452 N LYS A 49 -6.535 -2.670 17.130 1.00 0.00 N ATOM 453 CA LYS A 49 -7.150 -2.518 18.445 1.00 0.00 C ATOM 454 C LYS A 49 -8.558 -3.087 18.461 1.00 0.00 C ATOM 455 O LYS A 49 -8.965 -3.728 19.419 1.00 0.00 O ATOM 456 CB LYS A 49 -7.195 -1.037 18.834 1.00 0.00 C ATOM 457 CG LYS A 49 -7.702 -0.896 20.273 1.00 0.00 C ATOM 458 CD LYS A 49 -7.612 0.567 20.705 1.00 0.00 C ATOM 459 CE LYS A 49 -8.084 0.700 22.155 1.00 0.00 C ATOM 460 NZ LYS A 49 -9.520 0.313 22.249 1.00 0.00 N ATOM 0 H LYS A 49 -6.301 -1.793 16.666 1.00 0.00 H new ATOM 0 HA LYS A 49 -6.545 -3.070 19.165 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -6.202 -0.597 18.743 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -7.849 -0.492 18.153 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -8.733 -1.244 20.342 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -7.109 -1.521 20.941 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.586 0.923 20.611 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -8.226 1.188 20.053 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -7.482 0.064 22.804 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -7.950 1.725 22.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -9.931 0.711 23.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -10.034 0.682 21.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -9.599 -0.724 22.272 1.00 0.00 H new ATOM 474 N GLU A 50 -9.302 -2.833 17.399 1.00 0.00 N ATOM 475 CA GLU A 50 -10.683 -3.310 17.301 1.00 0.00 C ATOM 476 C GLU A 50 -10.766 -4.802 17.597 1.00 0.00 C ATOM 477 O GLU A 50 -11.349 -5.219 18.605 1.00 0.00 O ATOM 478 CB GLU A 50 -11.242 -3.030 15.877 1.00 0.00 C ATOM 479 CG GLU A 50 -10.648 -1.742 15.330 1.00 0.00 C ATOM 480 CD GLU A 50 -10.886 -0.589 16.312 1.00 0.00 C ATOM 481 OE1 GLU A 50 -11.914 0.059 16.199 1.00 0.00 O ATOM 482 OE2 GLU A 50 -10.038 -0.372 17.164 1.00 0.00 O ATOM 0 H GLU A 50 -8.980 -2.301 16.591 1.00 0.00 H new ATOM 0 HA GLU A 50 -11.280 -2.775 18.040 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -11.003 -3.861 15.213 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -12.329 -2.953 15.912 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -9.579 -1.870 15.160 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -11.098 -1.506 14.366 1.00 0.00 H new ATOM 489 N ALA A 51 -10.182 -5.604 16.714 1.00 0.00 N ATOM 490 CA ALA A 51 -10.202 -7.048 16.882 1.00 0.00 C ATOM 491 C ALA A 51 -9.693 -7.431 18.267 1.00 0.00 C ATOM 492 O ALA A 51 -10.285 -8.266 18.947 1.00 0.00 O ATOM 493 CB ALA A 51 -9.325 -7.693 15.811 1.00 0.00 C ATOM 0 H ALA A 51 -9.692 -5.279 15.880 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.227 -7.403 16.780 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.338 -8.776 15.934 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.708 -7.435 14.824 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -8.303 -7.329 15.910 1.00 0.00 H new ATOM 499 N THR A 52 -8.590 -6.809 18.678 1.00 0.00 N ATOM 500 CA THR A 52 -8.006 -7.099 19.981 1.00 0.00 C ATOM 501 C THR A 52 -8.993 -6.795 21.103 1.00 0.00 C ATOM 502 O THR A 52 -9.218 -7.623 21.985 1.00 0.00 O ATOM 503 CB THR A 52 -6.736 -6.260 20.178 1.00 0.00 C ATOM 504 OG1 THR A 52 -5.895 -6.406 19.044 1.00 0.00 O ATOM 505 CG2 THR A 52 -5.998 -6.729 21.433 1.00 0.00 C ATOM 0 H THR A 52 -8.088 -6.108 18.132 1.00 0.00 H new ATOM 0 HA THR A 52 -7.758 -8.160 20.015 1.00 0.00 H new ATOM 0 HB THR A 52 -7.008 -5.211 20.295 1.00 0.00 H new ATOM 0 HG1 THR A 52 -5.870 -5.563 18.545 1.00 0.00 H new ATOM 0 HG21 THR A 52 -5.097 -6.131 21.570 1.00 0.00 H new ATOM 0 HG22 THR A 52 -6.646 -6.612 22.301 1.00 0.00 H new ATOM 0 HG23 THR A 52 -5.724 -7.778 21.323 1.00 0.00 H new ATOM 513 N GLY A 53 -9.578 -5.606 21.067 1.00 0.00 N ATOM 514 CA GLY A 53 -10.529 -5.200 22.088 1.00 0.00 C ATOM 515 C GLY A 53 -11.789 -6.039 22.017 1.00 0.00 C ATOM 516 O GLY A 53 -12.702 -5.867 22.823 1.00 0.00 O ATOM 0 H GLY A 53 -9.410 -4.908 20.343 1.00 0.00 H new ATOM 0 HA2 GLY A 53 -10.075 -5.301 23.074 1.00 0.00 H new ATOM 0 HA3 GLY A 53 -10.780 -4.147 21.959 1.00 0.00 H new ATOM 520 N LYS A 54 -11.839 -6.950 21.045 1.00 0.00 N ATOM 521 CA LYS A 54 -13.004 -7.824 20.869 1.00 0.00 C ATOM 522 C LYS A 54 -12.771 -9.169 21.552 1.00 0.00 C ATOM 523 O LYS A 54 -13.521 -10.119 21.340 1.00 0.00 O ATOM 524 CB LYS A 54 -13.289 -8.027 19.369 1.00 0.00 C ATOM 525 CG LYS A 54 -14.777 -8.352 19.162 1.00 0.00 C ATOM 526 CD LYS A 54 -15.070 -8.427 17.684 1.00 0.00 C ATOM 527 CE LYS A 54 -16.548 -8.764 17.479 1.00 0.00 C ATOM 528 NZ LYS A 54 -17.387 -7.721 18.138 1.00 0.00 N ATOM 0 H LYS A 54 -11.091 -7.103 20.369 1.00 0.00 H new ATOM 0 HA LYS A 54 -13.870 -7.350 21.331 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -13.023 -7.128 18.814 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -12.673 -8.837 18.978 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -15.024 -9.299 19.642 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -15.397 -7.586 19.629 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -14.832 -7.477 17.206 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -14.444 -9.186 17.215 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -16.778 -8.813 16.415 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -16.771 -9.745 17.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -18.335 -7.717 17.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -17.466 -7.929 19.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -16.946 -6.788 18.009 1.00 0.00 H new ATOM 542 N GLY A 55 -11.730 -9.241 22.372 1.00 0.00 N ATOM 543 CA GLY A 55 -11.414 -10.481 23.076 1.00 0.00 C ATOM 544 C GLY A 55 -10.675 -11.453 22.176 1.00 0.00 C ATOM 545 O GLY A 55 -10.776 -12.665 22.343 1.00 0.00 O ATOM 0 H GLY A 55 -11.096 -8.466 22.566 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -10.805 -10.259 23.953 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -12.334 -10.942 23.435 1.00 0.00 H new ATOM 549 N VAL A 56 -9.922 -10.921 21.217 1.00 0.00 N ATOM 550 CA VAL A 56 -9.156 -11.759 20.290 1.00 0.00 C ATOM 551 C VAL A 56 -7.744 -11.984 20.827 1.00 0.00 C ATOM 552 O VAL A 56 -7.075 -11.047 21.266 1.00 0.00 O ATOM 553 CB VAL A 56 -9.078 -11.085 18.908 1.00 0.00 C ATOM 554 CG1 VAL A 56 -8.092 -11.847 17.997 1.00 0.00 C ATOM 555 CG2 VAL A 56 -10.477 -11.079 18.265 1.00 0.00 C ATOM 0 H VAL A 56 -9.824 -9.918 21.059 1.00 0.00 H new ATOM 0 HA VAL A 56 -9.661 -12.720 20.194 1.00 0.00 H new ATOM 0 HB VAL A 56 -8.724 -10.061 19.030 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -8.046 -11.360 17.023 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -7.101 -11.844 18.451 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -8.432 -12.875 17.873 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -10.425 -10.602 17.286 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -10.830 -12.104 18.151 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -11.168 -10.526 18.902 1.00 0.00 H new ATOM 565 N LEU A 57 -7.304 -13.232 20.785 1.00 0.00 N ATOM 566 CA LEU A 57 -5.970 -13.584 21.258 1.00 0.00 C ATOM 567 C LEU A 57 -4.912 -13.016 20.321 1.00 0.00 C ATOM 568 O LEU A 57 -5.096 -12.975 19.109 1.00 0.00 O ATOM 569 CB LEU A 57 -5.828 -15.110 21.325 1.00 0.00 C ATOM 570 CG LEU A 57 -7.009 -15.706 22.109 1.00 0.00 C ATOM 571 CD1 LEU A 57 -6.862 -17.230 22.163 1.00 0.00 C ATOM 572 CD2 LEU A 57 -7.052 -15.132 23.541 1.00 0.00 C ATOM 0 H LEU A 57 -7.848 -14.018 20.429 1.00 0.00 H new ATOM 0 HA LEU A 57 -5.828 -13.161 22.253 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.800 -15.527 20.318 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -4.887 -15.377 21.807 1.00 0.00 H new ATOM 0 HG LEU A 57 -7.939 -15.444 21.605 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -7.697 -17.657 22.718 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -6.857 -17.631 21.150 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.927 -17.488 22.660 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.894 -15.565 24.081 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -6.124 -15.376 24.059 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -7.168 -14.049 23.496 1.00 0.00 H new ATOM 813 N GLY A 74 -12.042 -15.439 14.464 1.00 0.00 N ATOM 814 CA GLY A 74 -13.460 -15.365 14.153 1.00 0.00 C ATOM 815 C GLY A 74 -13.692 -14.507 12.916 1.00 0.00 C ATOM 816 O GLY A 74 -12.747 -14.003 12.309 1.00 0.00 O ATOM 0 HA2 GLY A 74 -13.854 -16.367 13.986 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -14.003 -14.946 15.000 1.00 0.00 H new ATOM 820 N LEU A 75 -14.952 -14.352 12.541 1.00 0.00 N ATOM 821 CA LEU A 75 -15.302 -13.556 11.368 1.00 0.00 C ATOM 822 C LEU A 75 -14.983 -12.094 11.598 1.00 0.00 C ATOM 823 O LEU A 75 -14.664 -11.369 10.655 1.00 0.00 O ATOM 824 CB LEU A 75 -16.805 -13.729 11.052 1.00 0.00 C ATOM 825 CG LEU A 75 -17.030 -15.057 10.296 1.00 0.00 C ATOM 826 CD1 LEU A 75 -16.381 -15.005 8.874 1.00 0.00 C ATOM 827 CD2 LEU A 75 -16.433 -16.229 11.121 1.00 0.00 C ATOM 0 H LEU A 75 -15.749 -14.764 13.027 1.00 0.00 H new ATOM 0 HA LEU A 75 -14.712 -13.905 10.520 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -17.383 -13.723 11.976 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -17.158 -12.892 10.449 1.00 0.00 H new ATOM 0 HG LEU A 75 -18.101 -15.214 10.170 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -16.553 -15.951 8.361 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -16.829 -14.194 8.299 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -15.309 -14.833 8.969 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -16.591 -17.167 10.588 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -15.364 -16.068 11.262 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -16.924 -16.277 12.093 1.00 0.00 H new ATOM 839 N ALA A 76 -15.082 -11.663 12.843 1.00 0.00 N ATOM 840 CA ALA A 76 -14.816 -10.276 13.167 1.00 0.00 C ATOM 841 C ALA A 76 -13.424 -9.868 12.705 1.00 0.00 C ATOM 842 O ALA A 76 -13.257 -8.873 12.002 1.00 0.00 O ATOM 843 CB ALA A 76 -14.928 -10.078 14.680 1.00 0.00 C ATOM 0 H ALA A 76 -15.342 -12.247 13.638 1.00 0.00 H new ATOM 0 HA ALA A 76 -15.548 -9.653 12.653 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -14.728 -9.035 14.926 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -15.933 -10.342 15.008 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -14.202 -10.715 15.185 1.00 0.00 H new ATOM 849 N LEU A 77 -12.429 -10.640 13.111 1.00 0.00 N ATOM 850 CA LEU A 77 -11.063 -10.331 12.740 1.00 0.00 C ATOM 851 C LEU A 77 -10.902 -10.365 11.228 1.00 0.00 C ATOM 852 O LEU A 77 -10.389 -9.428 10.626 1.00 0.00 O ATOM 853 CB LEU A 77 -10.119 -11.346 13.369 1.00 0.00 C ATOM 854 CG LEU A 77 -8.635 -11.041 12.954 1.00 0.00 C ATOM 855 CD1 LEU A 77 -7.716 -11.124 14.175 1.00 0.00 C ATOM 856 CD2 LEU A 77 -8.164 -12.060 11.902 1.00 0.00 C ATOM 0 H LEU A 77 -12.541 -11.473 13.689 1.00 0.00 H new ATOM 0 HA LEU A 77 -10.823 -9.331 13.100 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -10.214 -11.317 14.454 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -10.393 -12.352 13.052 1.00 0.00 H new ATOM 0 HG LEU A 77 -8.593 -10.035 12.536 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -6.690 -10.911 13.874 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -8.034 -10.395 14.920 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -7.768 -12.126 14.602 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -7.134 -11.842 11.619 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -8.221 -13.066 12.319 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -8.803 -11.996 11.021 1.00 0.00 H new ATOM 868 N ARG A 78 -11.344 -11.455 10.610 1.00 0.00 N ATOM 869 CA ARG A 78 -11.228 -11.600 9.166 1.00 0.00 C ATOM 870 C ARG A 78 -11.694 -10.330 8.458 1.00 0.00 C ATOM 871 O ARG A 78 -11.069 -9.870 7.503 1.00 0.00 O ATOM 872 CB ARG A 78 -12.092 -12.785 8.697 1.00 0.00 C ATOM 873 CG ARG A 78 -11.729 -13.171 7.231 1.00 0.00 C ATOM 874 CD ARG A 78 -10.624 -14.235 7.239 1.00 0.00 C ATOM 875 NE ARG A 78 -11.139 -15.472 7.820 1.00 0.00 N ATOM 876 CZ ARG A 78 -10.320 -16.460 8.166 1.00 0.00 C ATOM 877 NH1 ARG A 78 -9.033 -16.326 7.999 1.00 0.00 N ATOM 878 NH2 ARG A 78 -10.802 -17.558 8.677 1.00 0.00 N ATOM 0 H ARG A 78 -11.783 -12.245 11.083 1.00 0.00 H new ATOM 0 HA ARG A 78 -10.182 -11.779 8.919 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -11.937 -13.640 9.355 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -13.148 -12.522 8.760 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -12.611 -13.551 6.715 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -11.395 -12.289 6.684 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -10.273 -14.417 6.223 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.768 -13.880 7.813 1.00 0.00 H new ATOM 0 HE ARG A 78 -12.143 -15.579 7.963 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -8.657 -15.464 7.604 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -8.403 -17.083 8.264 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -11.808 -17.659 8.811 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -10.173 -18.316 8.942 1.00 0.00 H new ATOM 892 N GLU A 79 -12.792 -9.767 8.940 1.00 0.00 N ATOM 893 CA GLU A 79 -13.332 -8.551 8.353 1.00 0.00 C ATOM 894 C GLU A 79 -12.306 -7.424 8.442 1.00 0.00 C ATOM 895 O GLU A 79 -12.274 -6.534 7.594 1.00 0.00 O ATOM 896 CB GLU A 79 -14.613 -8.143 9.087 1.00 0.00 C ATOM 897 CG GLU A 79 -15.256 -6.949 8.377 1.00 0.00 C ATOM 898 CD GLU A 79 -16.582 -6.596 9.040 1.00 0.00 C ATOM 899 OE1 GLU A 79 -17.109 -7.432 9.755 1.00 0.00 O ATOM 900 OE2 GLU A 79 -17.045 -5.487 8.829 1.00 0.00 O ATOM 0 H GLU A 79 -13.323 -10.130 9.731 1.00 0.00 H new ATOM 0 HA GLU A 79 -13.563 -8.739 7.304 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -15.310 -8.980 9.115 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -14.385 -7.884 10.121 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -14.584 -6.091 8.411 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -15.418 -7.186 7.325 1.00 0.00 H new ATOM 907 N ALA A 80 -11.477 -7.465 9.479 1.00 0.00 N ATOM 908 CA ALA A 80 -10.461 -6.436 9.673 1.00 0.00 C ATOM 909 C ALA A 80 -9.480 -6.425 8.503 1.00 0.00 C ATOM 910 O ALA A 80 -8.990 -5.371 8.097 1.00 0.00 O ATOM 911 CB ALA A 80 -9.702 -6.686 10.984 1.00 0.00 C ATOM 0 H ALA A 80 -11.487 -8.193 10.193 1.00 0.00 H new ATOM 0 HA ALA A 80 -10.957 -5.467 9.724 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -8.946 -5.913 11.120 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -10.401 -6.661 11.820 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -9.219 -7.662 10.944 1.00 0.00 H new ATOM 917 N LYS A 81 -9.193 -7.608 7.976 1.00 0.00 N ATOM 918 CA LYS A 81 -8.264 -7.731 6.863 1.00 0.00 C ATOM 919 C LYS A 81 -8.770 -6.963 5.649 1.00 0.00 C ATOM 920 O LYS A 81 -7.987 -6.479 4.836 1.00 0.00 O ATOM 921 CB LYS A 81 -8.078 -9.203 6.485 1.00 0.00 C ATOM 922 CG LYS A 81 -7.479 -9.964 7.671 1.00 0.00 C ATOM 923 CD LYS A 81 -7.164 -11.400 7.248 1.00 0.00 C ATOM 924 CE LYS A 81 -6.622 -12.178 8.448 1.00 0.00 C ATOM 925 NZ LYS A 81 -6.248 -13.555 8.021 1.00 0.00 N ATOM 0 H LYS A 81 -9.588 -8.491 8.300 1.00 0.00 H new ATOM 0 HA LYS A 81 -7.308 -7.312 7.177 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.036 -9.641 6.205 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -7.423 -9.287 5.618 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -6.572 -9.467 8.015 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.178 -9.965 8.507 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.063 -11.883 6.864 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.432 -11.400 6.440 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -5.754 -11.667 8.864 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -7.374 -12.222 9.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -5.880 -14.084 8.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -7.086 -14.041 7.644 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.517 -13.503 7.283 1.00 0.00 H new ATOM 939 N VAL A 82 -10.091 -6.849 5.541 1.00 0.00 N ATOM 940 CA VAL A 82 -10.709 -6.126 4.428 1.00 0.00 C ATOM 941 C VAL A 82 -10.776 -4.632 4.711 1.00 0.00 C ATOM 942 O VAL A 82 -10.420 -3.811 3.867 1.00 0.00 O ATOM 943 CB VAL A 82 -12.110 -6.672 4.160 1.00 0.00 C ATOM 944 CG1 VAL A 82 -12.694 -5.995 2.915 1.00 0.00 C ATOM 945 CG2 VAL A 82 -12.021 -8.183 3.936 1.00 0.00 C ATOM 0 H VAL A 82 -10.754 -7.246 6.207 1.00 0.00 H new ATOM 0 HA VAL A 82 -10.090 -6.276 3.543 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.757 -6.467 5.013 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -13.694 -6.385 2.724 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.749 -4.919 3.078 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.055 -6.199 2.056 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -13.017 -8.582 3.744 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -11.377 -8.387 3.080 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.605 -8.659 4.824 1.00 0.00 H new ATOM 955 N GLN A 83 -11.246 -4.279 5.902 1.00 0.00 N ATOM 956 CA GLN A 83 -11.372 -2.873 6.281 1.00 0.00 C ATOM 957 C GLN A 83 -10.045 -2.151 6.089 1.00 0.00 C ATOM 958 O GLN A 83 -10.013 -0.934 5.905 1.00 0.00 O ATOM 959 CB GLN A 83 -11.833 -2.775 7.766 1.00 0.00 C ATOM 960 CG GLN A 83 -13.334 -2.468 7.849 1.00 0.00 C ATOM 961 CD GLN A 83 -13.585 -1.029 7.403 1.00 0.00 C ATOM 962 OE1 GLN A 83 -13.051 -0.092 7.999 1.00 0.00 O ATOM 963 NE2 GLN A 83 -14.348 -0.795 6.373 1.00 0.00 N ATOM 0 H GLN A 83 -11.545 -4.940 6.619 1.00 0.00 H new ATOM 0 HA GLN A 83 -12.116 -2.395 5.643 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -11.619 -3.712 8.281 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -11.268 -1.995 8.276 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -13.893 -3.158 7.217 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -13.689 -2.611 8.869 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -14.790 -1.570 5.879 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -14.503 0.163 6.060 1.00 0.00 H new ATOM 972 N ALA A 84 -8.959 -2.902 6.150 1.00 0.00 N ATOM 973 CA ALA A 84 -7.637 -2.316 5.995 1.00 0.00 C ATOM 974 C ALA A 84 -7.499 -1.675 4.632 1.00 0.00 C ATOM 975 O ALA A 84 -7.285 -0.471 4.529 1.00 0.00 O ATOM 976 CB ALA A 84 -6.573 -3.386 6.173 1.00 0.00 C ATOM 0 H ALA A 84 -8.964 -3.910 6.304 1.00 0.00 H new ATOM 0 HA ALA A 84 -7.505 -1.548 6.757 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -5.585 -2.940 6.056 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -6.658 -3.822 7.168 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -6.711 -4.165 5.423 1.00 0.00 H new ATOM 982 N ILE A 85 -7.611 -2.486 3.585 1.00 0.00 N ATOM 983 CA ILE A 85 -7.470 -1.995 2.216 1.00 0.00 C ATOM 984 C ILE A 85 -8.241 -0.698 2.029 1.00 0.00 C ATOM 985 O ILE A 85 -7.710 0.278 1.501 1.00 0.00 O ATOM 986 CB ILE A 85 -8.009 -3.034 1.221 1.00 0.00 C ATOM 987 CG1 ILE A 85 -7.314 -4.383 1.460 1.00 0.00 C ATOM 988 CG2 ILE A 85 -7.733 -2.560 -0.219 1.00 0.00 C ATOM 989 CD1 ILE A 85 -7.924 -5.446 0.552 1.00 0.00 C ATOM 0 H ILE A 85 -7.799 -3.486 3.657 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.410 -1.818 2.031 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.083 -3.150 1.365 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -6.246 -4.292 1.263 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -7.421 -4.678 2.504 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -8.116 -3.298 -0.924 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -8.229 -1.604 -0.389 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -6.659 -2.442 -0.364 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -7.428 -6.401 0.725 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -8.987 -5.545 0.771 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -7.794 -5.153 -0.490 1.00 0.00 H new ATOM 1001 N VAL A 86 -9.491 -0.682 2.472 1.00 0.00 N ATOM 1002 CA VAL A 86 -10.332 0.506 2.360 1.00 0.00 C ATOM 1003 C VAL A 86 -9.561 1.754 2.778 1.00 0.00 C ATOM 1004 O VAL A 86 -9.780 2.839 2.246 1.00 0.00 O ATOM 1005 CB VAL A 86 -11.575 0.353 3.239 1.00 0.00 C ATOM 1006 CG1 VAL A 86 -12.514 1.542 3.012 1.00 0.00 C ATOM 1007 CG2 VAL A 86 -12.301 -0.946 2.874 1.00 0.00 C ATOM 0 H VAL A 86 -9.948 -1.480 2.914 1.00 0.00 H new ATOM 0 HA VAL A 86 -10.635 0.614 1.319 1.00 0.00 H new ATOM 0 HB VAL A 86 -11.276 0.322 4.287 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -13.399 1.432 3.639 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -11.999 2.467 3.271 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -12.813 1.575 1.964 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -13.187 -1.056 3.500 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -12.599 -0.914 1.826 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -11.635 -1.793 3.036 1.00 0.00 H new ATOM 1017 N GLU A 87 -8.656 1.591 3.744 1.00 0.00 N ATOM 1018 CA GLU A 87 -7.854 2.714 4.233 1.00 0.00 C ATOM 1019 C GLU A 87 -6.632 2.923 3.344 1.00 0.00 C ATOM 1020 O GLU A 87 -6.136 4.040 3.210 1.00 0.00 O ATOM 1021 CB GLU A 87 -7.402 2.439 5.670 1.00 0.00 C ATOM 1022 CG GLU A 87 -8.634 2.263 6.568 1.00 0.00 C ATOM 1023 CD GLU A 87 -9.375 3.588 6.706 1.00 0.00 C ATOM 1024 OE1 GLU A 87 -9.042 4.342 7.605 1.00 0.00 O ATOM 1025 OE2 GLU A 87 -10.266 3.831 5.908 1.00 0.00 O ATOM 0 H GLU A 87 -8.461 0.700 4.200 1.00 0.00 H new ATOM 0 HA GLU A 87 -8.465 3.616 4.209 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -6.783 1.542 5.703 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -6.788 3.263 6.034 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -9.297 1.509 6.145 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -8.329 1.904 7.551 1.00 0.00 H new ATOM 1032 N THR A 88 -6.145 1.840 2.753 1.00 0.00 N ATOM 1033 CA THR A 88 -4.974 1.916 1.891 1.00 0.00 C ATOM 1034 C THR A 88 -5.284 2.698 0.617 1.00 0.00 C ATOM 1035 O THR A 88 -4.412 3.363 0.056 1.00 0.00 O ATOM 1036 CB THR A 88 -4.505 0.511 1.513 1.00 0.00 C ATOM 1037 OG1 THR A 88 -5.468 -0.098 0.663 1.00 0.00 O ATOM 1038 CG2 THR A 88 -4.326 -0.339 2.781 1.00 0.00 C ATOM 0 H THR A 88 -6.540 0.905 2.854 1.00 0.00 H new ATOM 0 HA THR A 88 -4.187 2.432 2.441 1.00 0.00 H new ATOM 0 HB THR A 88 -3.550 0.580 0.991 1.00 0.00 H new ATOM 0 HG1 THR A 88 -6.360 0.243 0.882 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.992 -1.339 2.505 1.00 0.00 H new ATOM 0 HG22 THR A 88 -3.583 0.126 3.429 1.00 0.00 H new ATOM 0 HG23 THR A 88 -5.276 -0.408 3.310 1.00 0.00 H new ATOM 1046 N GLY A 89 -6.529 2.614 0.167 1.00 0.00 N ATOM 1047 CA GLY A 89 -6.947 3.304 -1.039 1.00 0.00 C ATOM 1048 C GLY A 89 -6.928 4.800 -0.823 1.00 0.00 C ATOM 1049 O GLY A 89 -6.825 5.575 -1.767 1.00 0.00 O ATOM 0 H GLY A 89 -7.265 2.074 0.622 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -6.285 3.041 -1.864 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.950 2.983 -1.320 1.00 0.00 H new ATOM 1053 N LYS A 90 -7.058 5.212 0.430 1.00 0.00 N ATOM 1054 CA LYS A 90 -7.073 6.622 0.745 1.00 0.00 C ATOM 1055 C LYS A 90 -5.709 7.243 0.526 1.00 0.00 C ATOM 1056 O LYS A 90 -5.589 8.306 -0.077 1.00 0.00 O ATOM 1057 CB LYS A 90 -7.506 6.819 2.212 1.00 0.00 C ATOM 1058 CG LYS A 90 -8.061 8.271 2.434 1.00 0.00 C ATOM 1059 CD LYS A 90 -9.594 8.246 2.527 1.00 0.00 C ATOM 1060 CE LYS A 90 -10.194 7.851 1.170 1.00 0.00 C ATOM 1061 NZ LYS A 90 -11.668 8.010 1.222 1.00 0.00 N ATOM 0 H LYS A 90 -7.153 4.592 1.234 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.783 7.116 0.082 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.271 6.088 2.472 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -6.658 6.643 2.874 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.641 8.693 3.347 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.750 8.916 1.612 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.909 7.538 3.294 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -9.965 9.226 2.827 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -9.777 8.475 0.379 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.936 6.819 0.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -12.079 7.743 0.304 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -12.057 7.397 1.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -11.903 9.001 1.431 1.00 0.00 H new ATOM 1075 N PHE A 91 -4.686 6.578 1.054 1.00 0.00 N ATOM 1076 CA PHE A 91 -3.328 7.081 0.936 1.00 0.00 C ATOM 1077 C PHE A 91 -2.822 6.905 -0.487 1.00 0.00 C ATOM 1078 O PHE A 91 -1.926 7.619 -0.938 1.00 0.00 O ATOM 1079 CB PHE A 91 -2.408 6.337 1.920 1.00 0.00 C ATOM 1080 CG PHE A 91 -1.163 7.166 2.179 1.00 0.00 C ATOM 1081 CD1 PHE A 91 -1.273 8.344 2.927 1.00 0.00 C ATOM 1082 CD2 PHE A 91 0.084 6.772 1.675 1.00 0.00 C ATOM 1083 CE1 PHE A 91 -0.133 9.128 3.175 1.00 0.00 C ATOM 1084 CE2 PHE A 91 1.219 7.553 1.921 1.00 0.00 C ATOM 1085 CZ PHE A 91 1.111 8.729 2.671 1.00 0.00 C ATOM 0 H PHE A 91 -4.773 5.698 1.563 1.00 0.00 H new ATOM 0 HA PHE A 91 -3.323 8.144 1.178 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -2.935 6.151 2.856 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -2.132 5.365 1.511 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -2.234 8.651 3.314 1.00 0.00 H new ATOM 0 HD2 PHE A 91 0.169 5.864 1.096 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.216 10.036 3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 91 2.179 7.248 1.532 1.00 0.00 H new ATOM 0 HZ PHE A 91 1.988 9.330 2.861 1.00 0.00 H new ATOM 1095 N LEU A 92 -3.396 5.941 -1.183 1.00 0.00 N ATOM 1096 CA LEU A 92 -2.998 5.661 -2.549 1.00 0.00 C ATOM 1097 C LEU A 92 -3.362 6.810 -3.482 1.00 0.00 C ATOM 1098 O LEU A 92 -2.623 7.131 -4.408 1.00 0.00 O ATOM 1099 CB LEU A 92 -3.670 4.380 -3.027 1.00 0.00 C ATOM 1100 CG LEU A 92 -3.239 4.065 -4.502 1.00 0.00 C ATOM 1101 CD1 LEU A 92 -2.849 2.592 -4.638 1.00 0.00 C ATOM 1102 CD2 LEU A 92 -4.397 4.374 -5.466 1.00 0.00 C ATOM 0 H LEU A 92 -4.138 5.340 -0.825 1.00 0.00 H new ATOM 0 HA LEU A 92 -1.915 5.541 -2.567 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -3.396 3.551 -2.375 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -4.753 4.485 -2.971 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.380 4.688 -4.752 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.552 2.388 -5.667 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.016 2.373 -3.970 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.700 1.964 -4.375 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -4.089 4.152 -6.488 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -5.260 3.761 -5.206 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -4.664 5.428 -5.388 1.00 0.00 H new ATOM 1114 N LYS A 93 -4.512 7.422 -3.229 1.00 0.00 N ATOM 1115 CA LYS A 93 -4.988 8.532 -4.045 1.00 0.00 C ATOM 1116 C LYS A 93 -4.151 9.771 -3.801 1.00 0.00 C ATOM 1117 O LYS A 93 -4.180 10.709 -4.591 1.00 0.00 O ATOM 1118 CB LYS A 93 -6.463 8.821 -3.732 1.00 0.00 C ATOM 1119 CG LYS A 93 -7.339 7.685 -4.267 1.00 0.00 C ATOM 1120 CD LYS A 93 -8.798 7.951 -3.897 1.00 0.00 C ATOM 1121 CE LYS A 93 -9.686 6.879 -4.528 1.00 0.00 C ATOM 1122 NZ LYS A 93 -9.351 5.547 -3.948 1.00 0.00 N ATOM 0 H LYS A 93 -5.134 7.167 -2.462 1.00 0.00 H new ATOM 0 HA LYS A 93 -4.895 8.254 -5.095 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -6.602 8.924 -2.656 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -6.762 9.767 -4.184 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -7.235 7.610 -5.349 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -7.014 6.732 -3.848 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -8.917 7.945 -2.813 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -9.099 8.939 -4.245 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -10.736 7.111 -4.350 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -9.542 6.863 -5.608 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -10.226 5.060 -3.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -8.849 4.976 -4.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -8.744 5.675 -3.113 1.00 0.00 H new ATOM 1136 N ILE A 94 -3.420 9.783 -2.693 1.00 0.00 N ATOM 1137 CA ILE A 94 -2.584 10.932 -2.352 1.00 0.00 C ATOM 1138 C ILE A 94 -1.256 10.875 -3.108 1.00 0.00 C ATOM 1139 O ILE A 94 -0.813 11.871 -3.677 1.00 0.00 O ATOM 1140 CB ILE A 94 -2.315 10.943 -0.843 1.00 0.00 C ATOM 1141 CG1 ILE A 94 -3.650 11.095 -0.093 1.00 0.00 C ATOM 1142 CG2 ILE A 94 -1.399 12.119 -0.485 1.00 0.00 C ATOM 1143 CD1 ILE A 94 -3.427 11.028 1.433 1.00 0.00 C ATOM 0 H ILE A 94 -3.387 9.018 -2.019 1.00 0.00 H new ATOM 0 HA ILE A 94 -3.110 11.843 -2.638 1.00 0.00 H new ATOM 0 HB ILE A 94 -1.831 10.010 -0.557 1.00 0.00 H new ATOM 0 HG12 ILE A 94 -4.115 12.045 -0.357 1.00 0.00 H new ATOM 0 HG13 ILE A 94 -4.338 10.307 -0.400 1.00 0.00 H new ATOM 0 HG21 ILE A 94 -1.212 12.121 0.589 1.00 0.00 H new ATOM 0 HG22 ILE A 94 -0.453 12.019 -1.018 1.00 0.00 H new ATOM 0 HG23 ILE A 94 -1.879 13.055 -0.771 1.00 0.00 H new ATOM 0 HD11 ILE A 94 -4.383 11.137 1.946 1.00 0.00 H new ATOM 0 HD12 ILE A 94 -2.983 10.067 1.694 1.00 0.00 H new ATOM 0 HD13 ILE A 94 -2.757 11.832 1.738 1.00 0.00 H new ATOM 1155 N ILE A 95 -0.618 9.712 -3.082 1.00 0.00 N ATOM 1156 CA ILE A 95 0.670 9.545 -3.741 1.00 0.00 C ATOM 1157 C ILE A 95 0.527 9.751 -5.238 1.00 0.00 C ATOM 1158 O ILE A 95 1.355 10.407 -5.868 1.00 0.00 O ATOM 1159 CB ILE A 95 1.236 8.149 -3.461 1.00 0.00 C ATOM 1160 CG1 ILE A 95 1.312 7.924 -1.942 1.00 0.00 C ATOM 1161 CG2 ILE A 95 2.641 8.037 -4.068 1.00 0.00 C ATOM 1162 CD1 ILE A 95 1.643 6.458 -1.664 1.00 0.00 C ATOM 0 H ILE A 95 -0.969 8.876 -2.615 1.00 0.00 H new ATOM 0 HA ILE A 95 1.358 10.291 -3.344 1.00 0.00 H new ATOM 0 HB ILE A 95 0.587 7.395 -3.907 1.00 0.00 H new ATOM 0 HG12 ILE A 95 2.074 8.570 -1.505 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.363 8.189 -1.476 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.045 7.044 -3.870 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.586 8.198 -5.145 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.291 8.789 -3.621 1.00 0.00 H new ATOM 0 HD11 ILE A 95 1.698 6.295 -0.588 1.00 0.00 H new ATOM 0 HD12 ILE A 95 0.865 5.823 -2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 95 2.602 6.209 -2.118 1.00 0.00 H new ATOM 1174 N GLU A 96 -0.527 9.182 -5.804 1.00 0.00 N ATOM 1175 CA GLU A 96 -0.760 9.301 -7.233 1.00 0.00 C ATOM 1176 C GLU A 96 -0.692 10.759 -7.675 1.00 0.00 C ATOM 1177 O GLU A 96 -0.076 11.083 -8.688 1.00 0.00 O ATOM 1178 CB GLU A 96 -2.136 8.725 -7.586 1.00 0.00 C ATOM 1179 CG GLU A 96 -2.369 8.774 -9.123 1.00 0.00 C ATOM 1180 CD GLU A 96 -2.966 10.123 -9.532 1.00 0.00 C ATOM 1181 OE1 GLU A 96 -4.179 10.235 -9.509 1.00 0.00 O ATOM 1182 OE2 GLU A 96 -2.206 11.022 -9.856 1.00 0.00 O ATOM 0 H GLU A 96 -1.228 8.638 -5.300 1.00 0.00 H new ATOM 0 HA GLU A 96 0.017 8.742 -7.753 1.00 0.00 H new ATOM 0 HB2 GLU A 96 -2.207 7.696 -7.234 1.00 0.00 H new ATOM 0 HB3 GLU A 96 -2.915 9.291 -7.076 1.00 0.00 H new ATOM 0 HG2 GLU A 96 -1.426 8.614 -9.645 1.00 0.00 H new ATOM 0 HG3 GLU A 96 -3.039 7.968 -9.421 1.00 0.00 H new ATOM 1189 N GLU A 97 -1.326 11.634 -6.904 1.00 0.00 N ATOM 1190 CA GLU A 97 -1.332 13.055 -7.223 1.00 0.00 C ATOM 1191 C GLU A 97 0.071 13.622 -7.116 1.00 0.00 C ATOM 1192 O GLU A 97 0.342 14.721 -7.599 1.00 0.00 O ATOM 1193 CB GLU A 97 -2.261 13.803 -6.265 1.00 0.00 C ATOM 1194 CG GLU A 97 -3.707 13.369 -6.516 1.00 0.00 C ATOM 1195 CD GLU A 97 -4.642 14.043 -5.515 1.00 0.00 C ATOM 1196 OE1 GLU A 97 -4.162 14.832 -4.714 1.00 0.00 O ATOM 1197 OE2 GLU A 97 -5.827 13.762 -5.565 1.00 0.00 O ATOM 0 H GLU A 97 -1.840 11.386 -6.058 1.00 0.00 H new ATOM 0 HA GLU A 97 -1.691 13.181 -8.244 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -1.981 13.594 -5.232 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -2.162 14.879 -6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -4.001 13.630 -7.532 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -3.789 12.286 -6.429 1.00 0.00 H new ATOM 1204 N GLU A 98 0.964 12.877 -6.468 1.00 0.00 N ATOM 1205 CA GLU A 98 2.348 13.330 -6.299 1.00 0.00 C ATOM 1206 C GLU A 98 3.219 12.813 -7.438 1.00 0.00 C ATOM 1207 O GLU A 98 3.968 13.572 -8.053 1.00 0.00 O ATOM 1208 CB GLU A 98 2.899 12.832 -4.948 1.00 0.00 C ATOM 1209 CG GLU A 98 4.157 13.629 -4.558 1.00 0.00 C ATOM 1210 CD GLU A 98 5.301 13.298 -5.514 1.00 0.00 C ATOM 1211 OE1 GLU A 98 5.407 12.146 -5.899 1.00 0.00 O ATOM 1212 OE2 GLU A 98 6.043 14.205 -5.858 1.00 0.00 O ATOM 0 H GLU A 98 0.760 11.967 -6.055 1.00 0.00 H new ATOM 0 HA GLU A 98 2.365 14.420 -6.314 1.00 0.00 H new ATOM 0 HB2 GLU A 98 2.138 12.940 -4.175 1.00 0.00 H new ATOM 0 HB3 GLU A 98 3.138 11.771 -5.014 1.00 0.00 H new ATOM 0 HG2 GLU A 98 3.945 14.698 -4.588 1.00 0.00 H new ATOM 0 HG3 GLU A 98 4.446 13.390 -3.535 1.00 0.00 H new ATOM 1219 N ALA A 99 3.127 11.514 -7.706 1.00 0.00 N ATOM 1220 CA ALA A 99 3.925 10.907 -8.760 1.00 0.00 C ATOM 1221 C ALA A 99 3.720 11.641 -10.076 1.00 0.00 C ATOM 1222 O ALA A 99 4.660 11.852 -10.838 1.00 0.00 O ATOM 1223 CB ALA A 99 3.532 9.438 -8.928 1.00 0.00 C ATOM 0 H ALA A 99 2.512 10.868 -7.211 1.00 0.00 H new ATOM 0 HA ALA A 99 4.976 10.974 -8.480 1.00 0.00 H new ATOM 0 HB1 ALA A 99 4.133 8.989 -9.719 1.00 0.00 H new ATOM 0 HB2 ALA A 99 3.706 8.906 -7.993 1.00 0.00 H new ATOM 0 HB3 ALA A 99 2.477 9.372 -9.192 1.00 0.00 H new ATOM 1229 N LEU A 100 2.484 12.022 -10.344 1.00 0.00 N ATOM 1230 CA LEU A 100 2.171 12.721 -11.576 1.00 0.00 C ATOM 1231 C LEU A 100 2.910 14.059 -11.622 1.00 0.00 C ATOM 1232 O LEU A 100 3.385 14.501 -12.670 1.00 0.00 O ATOM 1233 CB LEU A 100 0.638 12.946 -11.671 1.00 0.00 C ATOM 1234 CG LEU A 100 0.186 12.912 -13.142 1.00 0.00 C ATOM 1235 CD1 LEU A 100 -1.320 13.136 -13.216 1.00 0.00 C ATOM 1236 CD2 LEU A 100 0.928 13.994 -13.955 1.00 0.00 C ATOM 0 H LEU A 100 1.686 11.860 -9.730 1.00 0.00 H new ATOM 0 HA LEU A 100 2.494 12.118 -12.425 1.00 0.00 H new ATOM 0 HB2 LEU A 100 0.114 12.176 -11.104 1.00 0.00 H new ATOM 0 HB3 LEU A 100 0.375 13.905 -11.224 1.00 0.00 H new ATOM 0 HG LEU A 100 0.425 11.938 -13.568 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -1.641 13.112 -14.257 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -1.832 12.351 -12.660 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -1.565 14.106 -12.783 1.00 0.00 H new ATOM 0 HD21 LEU A 100 0.599 13.959 -14.993 1.00 0.00 H new ATOM 0 HD22 LEU A 100 0.708 14.977 -13.538 1.00 0.00 H new ATOM 0 HD23 LEU A 100 2.002 13.812 -13.908 1.00 0.00 H new ATOM 1248 N LYS A 101 2.979 14.721 -10.485 1.00 0.00 N ATOM 1249 CA LYS A 101 3.632 16.011 -10.422 1.00 0.00 C ATOM 1250 C LYS A 101 5.115 15.894 -10.721 1.00 0.00 C ATOM 1251 O LYS A 101 5.804 16.890 -10.912 1.00 0.00 O ATOM 1252 CB LYS A 101 3.418 16.643 -9.028 1.00 0.00 C ATOM 1253 CG LYS A 101 3.667 18.173 -9.081 1.00 0.00 C ATOM 1254 CD LYS A 101 2.414 18.889 -9.605 1.00 0.00 C ATOM 1255 CE LYS A 101 2.705 20.372 -9.764 1.00 0.00 C ATOM 1256 NZ LYS A 101 3.908 20.553 -10.624 1.00 0.00 N ATOM 0 H LYS A 101 2.595 14.390 -9.600 1.00 0.00 H new ATOM 0 HA LYS A 101 3.187 16.654 -11.182 1.00 0.00 H new ATOM 0 HB2 LYS A 101 2.402 16.446 -8.685 1.00 0.00 H new ATOM 0 HB3 LYS A 101 4.093 16.183 -8.306 1.00 0.00 H new ATOM 0 HG2 LYS A 101 3.919 18.544 -8.088 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.517 18.390 -9.728 1.00 0.00 H new ATOM 0 HD2 LYS A 101 2.112 18.462 -10.562 1.00 0.00 H new ATOM 0 HD3 LYS A 101 1.583 18.743 -8.914 1.00 0.00 H new ATOM 0 HE2 LYS A 101 1.847 20.876 -10.209 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.871 20.828 -8.788 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.856 21.474 -11.104 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.764 20.517 -10.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 3.944 19.794 -11.334 1.00 0.00 H new ATOM 1270 N LEU A 102 5.609 14.670 -10.774 1.00 0.00 N ATOM 1271 CA LEU A 102 7.025 14.424 -11.054 1.00 0.00 C ATOM 1272 C LEU A 102 7.231 14.089 -12.513 1.00 0.00 C ATOM 1273 O LEU A 102 8.349 13.819 -12.936 1.00 0.00 O ATOM 1274 CB LEU A 102 7.519 13.276 -10.173 1.00 0.00 C ATOM 1275 CG LEU A 102 7.395 13.660 -8.686 1.00 0.00 C ATOM 1276 CD1 LEU A 102 7.847 12.471 -7.829 1.00 0.00 C ATOM 1277 CD2 LEU A 102 8.266 14.899 -8.366 1.00 0.00 C ATOM 0 H LEU A 102 5.056 13.826 -10.628 1.00 0.00 H new ATOM 0 HA LEU A 102 7.594 15.326 -10.832 1.00 0.00 H new ATOM 0 HB2 LEU A 102 6.937 12.376 -10.374 1.00 0.00 H new ATOM 0 HB3 LEU A 102 8.557 13.045 -10.412 1.00 0.00 H new ATOM 0 HG LEU A 102 6.357 13.908 -8.465 1.00 0.00 H new ATOM 0 HD11 LEU A 102 7.764 12.731 -6.774 1.00 0.00 H new ATOM 0 HD12 LEU A 102 7.215 11.608 -8.041 1.00 0.00 H new ATOM 0 HD13 LEU A 102 8.884 12.228 -8.062 1.00 0.00 H new ATOM 0 HD21 LEU A 102 8.164 15.153 -7.311 1.00 0.00 H new ATOM 0 HD22 LEU A 102 9.310 14.676 -8.586 1.00 0.00 H new ATOM 0 HD23 LEU A 102 7.938 15.741 -8.975 1.00 0.00 H new ATOM 1289 N LYS A 103 6.156 14.126 -13.280 1.00 0.00 N ATOM 1290 CA LYS A 103 6.244 13.841 -14.701 1.00 0.00 C ATOM 1291 C LYS A 103 6.990 14.953 -15.427 1.00 0.00 C ATOM 1292 O LYS A 103 7.623 14.715 -16.456 1.00 0.00 O ATOM 1293 CB LYS A 103 4.849 13.699 -15.285 1.00 0.00 C ATOM 1294 CG LYS A 103 4.940 13.192 -16.736 1.00 0.00 C ATOM 1295 CD LYS A 103 3.525 13.029 -17.334 1.00 0.00 C ATOM 1296 CE LYS A 103 2.842 11.771 -16.774 1.00 0.00 C ATOM 1297 NZ LYS A 103 1.585 11.525 -17.514 1.00 0.00 N ATOM 0 H LYS A 103 5.218 14.349 -12.946 1.00 0.00 H new ATOM 0 HA LYS A 103 6.792 12.908 -14.833 1.00 0.00 H new ATOM 0 HB2 LYS A 103 4.262 13.005 -14.684 1.00 0.00 H new ATOM 0 HB3 LYS A 103 4.334 14.659 -15.257 1.00 0.00 H new ATOM 0 HG2 LYS A 103 5.519 13.893 -17.338 1.00 0.00 H new ATOM 0 HG3 LYS A 103 5.466 12.238 -16.763 1.00 0.00 H new ATOM 0 HD2 LYS A 103 2.924 13.909 -17.104 1.00 0.00 H new ATOM 0 HD3 LYS A 103 3.589 12.962 -18.420 1.00 0.00 H new ATOM 0 HE2 LYS A 103 3.506 10.911 -16.867 1.00 0.00 H new ATOM 0 HE3 LYS A 103 2.633 11.899 -15.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 1.121 10.674 -17.137 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 0.952 12.342 -17.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 1.797 11.385 -18.522 1.00 0.00 H new ATOM 1311 N GLU A 104 6.891 16.170 -14.904 1.00 0.00 N ATOM 1312 CA GLU A 104 7.544 17.314 -15.526 1.00 0.00 C ATOM 1313 C GLU A 104 9.058 17.181 -15.431 1.00 0.00 C ATOM 1314 O GLU A 104 9.769 17.435 -16.402 1.00 0.00 O ATOM 1315 CB GLU A 104 7.107 18.604 -14.823 1.00 0.00 C ATOM 1316 CG GLU A 104 5.578 18.718 -14.853 1.00 0.00 C ATOM 1317 CD GLU A 104 5.094 18.885 -16.290 1.00 0.00 C ATOM 1318 OE1 GLU A 104 5.563 19.800 -16.949 1.00 0.00 O ATOM 1319 OE2 GLU A 104 4.269 18.093 -16.713 1.00 0.00 O ATOM 0 H GLU A 104 6.368 16.388 -14.056 1.00 0.00 H new ATOM 0 HA GLU A 104 7.255 17.348 -16.576 1.00 0.00 H new ATOM 0 HB2 GLU A 104 7.461 18.605 -13.792 1.00 0.00 H new ATOM 0 HB3 GLU A 104 7.555 19.467 -15.315 1.00 0.00 H new ATOM 0 HG2 GLU A 104 5.130 17.828 -14.411 1.00 0.00 H new ATOM 0 HG3 GLU A 104 5.257 19.568 -14.252 1.00 0.00 H new ATOM 1326 N THR A 105 9.549 16.784 -14.255 1.00 0.00 N ATOM 1327 CA THR A 105 10.991 16.627 -14.052 1.00 0.00 C ATOM 1328 C THR A 105 11.445 15.245 -14.503 1.00 0.00 C ATOM 1329 O THR A 105 12.438 15.115 -15.221 1.00 0.00 O ATOM 1330 CB THR A 105 11.318 16.813 -12.567 1.00 0.00 C ATOM 1331 OG1 THR A 105 10.620 15.837 -11.805 1.00 0.00 O ATOM 1332 CG2 THR A 105 10.895 18.213 -12.117 1.00 0.00 C ATOM 0 H THR A 105 8.978 16.568 -13.438 1.00 0.00 H new ATOM 0 HA THR A 105 11.514 17.378 -14.644 1.00 0.00 H new ATOM 0 HB THR A 105 12.391 16.696 -12.415 1.00 0.00 H new ATOM 0 HG1 THR A 105 10.829 15.953 -10.855 1.00 0.00 H new ATOM 0 HG21 THR A 105 11.129 18.342 -11.060 1.00 0.00 H new ATOM 0 HG22 THR A 105 11.432 18.961 -12.701 1.00 0.00 H new ATOM 0 HG23 THR A 105 9.823 18.335 -12.269 1.00 0.00 H new ATOM 1340 N GLY A 106 10.713 14.214 -14.087 1.00 0.00 N ATOM 1341 CA GLY A 106 11.061 12.850 -14.472 1.00 0.00 C ATOM 1342 C GLY A 106 12.373 12.419 -13.828 1.00 0.00 C ATOM 1343 O GLY A 106 13.119 11.617 -14.394 1.00 0.00 O ATOM 0 H GLY A 106 9.888 14.295 -13.493 1.00 0.00 H new ATOM 0 HA2 GLY A 106 10.264 12.169 -14.173 1.00 0.00 H new ATOM 0 HA3 GLY A 106 11.145 12.785 -15.557 1.00 0.00 H new ATOM 1347 N ASN A 107 12.654 12.955 -12.644 1.00 0.00 N ATOM 1348 CA ASN A 107 13.884 12.615 -11.939 1.00 0.00 C ATOM 1349 C ASN A 107 13.832 11.173 -11.454 1.00 0.00 C ATOM 1350 O ASN A 107 13.154 10.862 -10.474 1.00 0.00 O ATOM 1351 CB ASN A 107 14.071 13.551 -10.743 1.00 0.00 C ATOM 1352 CG ASN A 107 15.400 13.260 -10.055 1.00 0.00 C ATOM 1353 OD1 ASN A 107 16.344 12.797 -10.695 1.00 0.00 O ATOM 1354 ND2 ASN A 107 15.533 13.505 -8.779 1.00 0.00 N ATOM 0 H ASN A 107 12.053 13.620 -12.157 1.00 0.00 H new ATOM 0 HA ASN A 107 14.724 12.729 -12.624 1.00 0.00 H new ATOM 0 HB2 ASN A 107 14.044 14.589 -11.075 1.00 0.00 H new ATOM 0 HB3 ASN A 107 13.251 13.421 -10.037 1.00 0.00 H new ATOM 0 HD21 ASN A 107 16.419 13.313 -8.312 1.00 0.00 H new ATOM 0 HD22 ASN A 107 14.750 13.889 -8.249 1.00 0.00 H new ATOM 1361 N SER A 108 14.548 10.294 -12.151 1.00 0.00 N ATOM 1362 CA SER A 108 14.566 8.879 -11.789 1.00 0.00 C ATOM 1363 C SER A 108 14.828 8.700 -10.302 1.00 0.00 C ATOM 1364 O SER A 108 14.152 7.912 -9.641 1.00 0.00 O ATOM 1365 CB SER A 108 15.661 8.157 -12.575 1.00 0.00 C ATOM 1366 OG SER A 108 16.928 8.506 -12.031 1.00 0.00 O ATOM 0 H SER A 108 15.118 10.533 -12.962 1.00 0.00 H new ATOM 0 HA SER A 108 13.590 8.457 -12.030 1.00 0.00 H new ATOM 0 HB2 SER A 108 15.513 7.078 -12.523 1.00 0.00 H new ATOM 0 HB3 SER A 108 15.614 8.435 -13.628 1.00 0.00 H new ATOM 0 HG SER A 108 17.636 8.046 -12.529 1.00 0.00 H new ATOM 1372 N GLY A 109 15.802 9.433 -9.773 1.00 0.00 N ATOM 1373 CA GLY A 109 16.134 9.345 -8.360 1.00 0.00 C ATOM 1374 C GLY A 109 14.907 9.569 -7.496 1.00 0.00 C ATOM 1375 O GLY A 109 14.704 8.882 -6.495 1.00 0.00 O ATOM 0 H GLY A 109 16.373 10.092 -10.302 1.00 0.00 H new ATOM 0 HA2 GLY A 109 16.561 8.366 -8.144 1.00 0.00 H new ATOM 0 HA3 GLY A 109 16.895 10.086 -8.115 1.00 0.00 H new ATOM 1379 N GLN A 110 14.088 10.543 -7.878 1.00 0.00 N ATOM 1380 CA GLN A 110 12.883 10.846 -7.119 1.00 0.00 C ATOM 1381 C GLN A 110 11.880 9.703 -7.223 1.00 0.00 C ATOM 1382 O GLN A 110 11.227 9.349 -6.243 1.00 0.00 O ATOM 1383 CB GLN A 110 12.247 12.145 -7.637 1.00 0.00 C ATOM 1384 CG GLN A 110 11.164 12.634 -6.661 1.00 0.00 C ATOM 1385 CD GLN A 110 11.815 13.129 -5.373 1.00 0.00 C ATOM 1386 OE1 GLN A 110 11.495 12.646 -4.287 1.00 0.00 O ATOM 1387 NE2 GLN A 110 12.727 14.062 -5.433 1.00 0.00 N ATOM 0 H GLN A 110 14.235 11.130 -8.699 1.00 0.00 H new ATOM 0 HA GLN A 110 13.159 10.973 -6.072 1.00 0.00 H new ATOM 0 HB2 GLN A 110 13.013 12.911 -7.755 1.00 0.00 H new ATOM 0 HB3 GLN A 110 11.810 11.977 -8.621 1.00 0.00 H new ATOM 0 HG2 GLN A 110 10.585 13.436 -7.118 1.00 0.00 H new ATOM 0 HG3 GLN A 110 10.468 11.825 -6.440 1.00 0.00 H new ATOM 0 HE21 GLN A 110 12.990 14.461 -6.334 1.00 0.00 H new ATOM 0 HE22 GLN A 110 13.176 14.392 -4.579 1.00 0.00 H new ATOM 1396 N PHE A 111 11.753 9.134 -8.422 1.00 0.00 N ATOM 1397 CA PHE A 111 10.818 8.033 -8.638 1.00 0.00 C ATOM 1398 C PHE A 111 11.306 6.775 -7.938 1.00 0.00 C ATOM 1399 O PHE A 111 10.514 5.987 -7.429 1.00 0.00 O ATOM 1400 CB PHE A 111 10.654 7.784 -10.154 1.00 0.00 C ATOM 1401 CG PHE A 111 9.520 8.630 -10.692 1.00 0.00 C ATOM 1402 CD1 PHE A 111 8.202 8.188 -10.534 1.00 0.00 C ATOM 1403 CD2 PHE A 111 9.776 9.843 -11.336 1.00 0.00 C ATOM 1404 CE1 PHE A 111 7.143 8.951 -11.027 1.00 0.00 C ATOM 1405 CE2 PHE A 111 8.715 10.607 -11.825 1.00 0.00 C ATOM 1406 CZ PHE A 111 7.399 10.158 -11.676 1.00 0.00 C ATOM 0 H PHE A 111 12.280 9.414 -9.249 1.00 0.00 H new ATOM 0 HA PHE A 111 9.849 8.299 -8.216 1.00 0.00 H new ATOM 0 HB2 PHE A 111 11.580 8.028 -10.674 1.00 0.00 H new ATOM 0 HB3 PHE A 111 10.452 6.729 -10.339 1.00 0.00 H new ATOM 0 HD1 PHE A 111 8.004 7.254 -10.029 1.00 0.00 H new ATOM 0 HD2 PHE A 111 10.792 10.189 -11.455 1.00 0.00 H new ATOM 0 HE1 PHE A 111 6.126 8.607 -10.906 1.00 0.00 H new ATOM 0 HE2 PHE A 111 8.911 11.547 -12.320 1.00 0.00 H new ATOM 0 HZ PHE A 111 6.581 10.747 -12.064 1.00 0.00 H new ATOM 1416 N LEU A 112 12.614 6.578 -7.932 1.00 0.00 N ATOM 1417 CA LEU A 112 13.175 5.390 -7.310 1.00 0.00 C ATOM 1418 C LEU A 112 12.795 5.337 -5.843 1.00 0.00 C ATOM 1419 O LEU A 112 12.437 4.280 -5.327 1.00 0.00 O ATOM 1420 CB LEU A 112 14.713 5.420 -7.465 1.00 0.00 C ATOM 1421 CG LEU A 112 15.134 4.865 -8.858 1.00 0.00 C ATOM 1422 CD1 LEU A 112 16.484 5.464 -9.284 1.00 0.00 C ATOM 1423 CD2 LEU A 112 15.263 3.329 -8.779 1.00 0.00 C ATOM 0 H LEU A 112 13.298 7.213 -8.343 1.00 0.00 H new ATOM 0 HA LEU A 112 12.777 4.500 -7.798 1.00 0.00 H new ATOM 0 HB2 LEU A 112 15.076 6.441 -7.350 1.00 0.00 H new ATOM 0 HB3 LEU A 112 15.175 4.827 -6.676 1.00 0.00 H new ATOM 0 HG LEU A 112 14.375 5.138 -9.591 1.00 0.00 H new ATOM 0 HD11 LEU A 112 16.766 5.068 -10.259 1.00 0.00 H new ATOM 0 HD12 LEU A 112 16.398 6.549 -9.344 1.00 0.00 H new ATOM 0 HD13 LEU A 112 17.246 5.201 -8.551 1.00 0.00 H new ATOM 0 HD21 LEU A 112 15.558 2.938 -9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 112 16.018 3.065 -8.038 1.00 0.00 H new ATOM 0 HD23 LEU A 112 14.305 2.898 -8.490 1.00 0.00 H new ATOM 1435 N ALA A 113 12.877 6.470 -5.179 1.00 0.00 N ATOM 1436 CA ALA A 113 12.537 6.527 -3.768 1.00 0.00 C ATOM 1437 C ALA A 113 11.070 6.157 -3.581 1.00 0.00 C ATOM 1438 O ALA A 113 10.711 5.460 -2.633 1.00 0.00 O ATOM 1439 CB ALA A 113 12.786 7.930 -3.230 1.00 0.00 C ATOM 0 H ALA A 113 13.173 7.357 -5.586 1.00 0.00 H new ATOM 0 HA ALA A 113 13.161 5.821 -3.220 1.00 0.00 H new ATOM 0 HB1 ALA A 113 12.529 7.965 -2.171 1.00 0.00 H new ATOM 0 HB2 ALA A 113 13.838 8.187 -3.356 1.00 0.00 H new ATOM 0 HB3 ALA A 113 12.170 8.644 -3.777 1.00 0.00 H new ATOM 1445 N MET A 114 10.234 6.615 -4.501 1.00 0.00 N ATOM 1446 CA MET A 114 8.811 6.319 -4.435 1.00 0.00 C ATOM 1447 C MET A 114 8.582 4.819 -4.616 1.00 0.00 C ATOM 1448 O MET A 114 7.681 4.243 -4.011 1.00 0.00 O ATOM 1449 CB MET A 114 8.052 7.087 -5.527 1.00 0.00 C ATOM 1450 CG MET A 114 6.525 6.984 -5.290 1.00 0.00 C ATOM 1451 SD MET A 114 5.646 7.334 -6.834 1.00 0.00 S ATOM 1452 CE MET A 114 5.574 5.625 -7.441 1.00 0.00 C ATOM 0 H MET A 114 10.514 7.189 -5.296 1.00 0.00 H new ATOM 0 HA MET A 114 8.438 6.629 -3.459 1.00 0.00 H new ATOM 0 HB2 MET A 114 8.358 8.133 -5.525 1.00 0.00 H new ATOM 0 HB3 MET A 114 8.303 6.683 -6.508 1.00 0.00 H new ATOM 0 HG2 MET A 114 6.269 5.987 -4.932 1.00 0.00 H new ATOM 0 HG3 MET A 114 6.218 7.689 -4.517 1.00 0.00 H new ATOM 0 HE1 MET A 114 5.062 5.602 -8.403 1.00 0.00 H new ATOM 0 HE2 MET A 114 6.586 5.238 -7.559 1.00 0.00 H new ATOM 0 HE3 MET A 114 5.031 5.007 -6.726 1.00 0.00 H new ATOM 1462 N PHE A 115 9.386 4.198 -5.474 1.00 0.00 N ATOM 1463 CA PHE A 115 9.237 2.778 -5.740 1.00 0.00 C ATOM 1464 C PHE A 115 9.303 1.991 -4.434 1.00 0.00 C ATOM 1465 O PHE A 115 8.497 1.101 -4.200 1.00 0.00 O ATOM 1466 CB PHE A 115 10.361 2.310 -6.672 1.00 0.00 C ATOM 1467 CG PHE A 115 10.086 0.894 -7.137 1.00 0.00 C ATOM 1468 CD1 PHE A 115 9.015 0.652 -8.010 1.00 0.00 C ATOM 1469 CD2 PHE A 115 10.887 -0.176 -6.705 1.00 0.00 C ATOM 1470 CE1 PHE A 115 8.747 -0.649 -8.450 1.00 0.00 C ATOM 1471 CE2 PHE A 115 10.618 -1.474 -7.147 1.00 0.00 C ATOM 1472 CZ PHE A 115 9.548 -1.712 -8.019 1.00 0.00 C ATOM 0 H PHE A 115 10.139 4.653 -5.990 1.00 0.00 H new ATOM 0 HA PHE A 115 8.271 2.606 -6.214 1.00 0.00 H new ATOM 0 HB2 PHE A 115 10.435 2.977 -7.531 1.00 0.00 H new ATOM 0 HB3 PHE A 115 11.318 2.352 -6.152 1.00 0.00 H new ATOM 0 HD1 PHE A 115 8.396 1.472 -8.343 1.00 0.00 H new ATOM 0 HD2 PHE A 115 11.711 0.005 -6.031 1.00 0.00 H new ATOM 0 HE1 PHE A 115 7.922 -0.833 -9.122 1.00 0.00 H new ATOM 0 HE2 PHE A 115 11.236 -2.295 -6.816 1.00 0.00 H new ATOM 0 HZ PHE A 115 9.341 -2.716 -8.359 1.00 0.00 H new ATOM 1482 N ASP A 116 10.263 2.334 -3.593 1.00 0.00 N ATOM 1483 CA ASP A 116 10.413 1.649 -2.307 1.00 0.00 C ATOM 1484 C ASP A 116 9.295 2.043 -1.351 1.00 0.00 C ATOM 1485 O ASP A 116 9.025 1.349 -0.373 1.00 0.00 O ATOM 1486 CB ASP A 116 11.762 2.001 -1.681 1.00 0.00 C ATOM 1487 CG ASP A 116 11.991 1.161 -0.428 1.00 0.00 C ATOM 1488 OD1 ASP A 116 11.378 0.113 -0.319 1.00 0.00 O ATOM 1489 OD2 ASP A 116 12.776 1.583 0.406 1.00 0.00 O ATOM 0 H ASP A 116 10.945 3.072 -3.767 1.00 0.00 H new ATOM 0 HA ASP A 116 10.361 0.575 -2.486 1.00 0.00 H new ATOM 0 HB2 ASP A 116 12.563 1.824 -2.399 1.00 0.00 H new ATOM 0 HB3 ASP A 116 11.789 3.061 -1.428 1.00 0.00 H new ATOM 1494 N LEU A 117 8.656 3.174 -1.635 1.00 0.00 N ATOM 1495 CA LEU A 117 7.578 3.663 -0.783 1.00 0.00 C ATOM 1496 C LEU A 117 6.276 2.931 -1.074 1.00 0.00 C ATOM 1497 O LEU A 117 5.701 2.285 -0.198 1.00 0.00 O ATOM 1498 CB LEU A 117 7.376 5.166 -1.025 1.00 0.00 C ATOM 1499 CG LEU A 117 6.424 5.746 0.056 1.00 0.00 C ATOM 1500 CD1 LEU A 117 7.142 5.860 1.435 1.00 0.00 C ATOM 1501 CD2 LEU A 117 5.902 7.118 -0.408 1.00 0.00 C ATOM 0 H LEU A 117 8.863 3.764 -2.441 1.00 0.00 H new ATOM 0 HA LEU A 117 7.854 3.482 0.256 1.00 0.00 H new ATOM 0 HB2 LEU A 117 8.336 5.682 -0.993 1.00 0.00 H new ATOM 0 HB3 LEU A 117 6.958 5.332 -2.018 1.00 0.00 H new ATOM 0 HG LEU A 117 5.581 5.068 0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 117 6.451 6.269 2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 117 7.472 4.872 1.756 1.00 0.00 H new ATOM 0 HD13 LEU A 117 8.005 6.519 1.342 1.00 0.00 H new ATOM 0 HD21 LEU A 117 5.233 7.528 0.349 1.00 0.00 H new ATOM 0 HD22 LEU A 117 6.742 7.796 -0.555 1.00 0.00 H new ATOM 0 HD23 LEU A 117 5.360 7.003 -1.347 1.00 0.00 H new ATOM 1513 N MET A 118 5.794 3.070 -2.304 1.00 0.00 N ATOM 1514 CA MET A 118 4.540 2.447 -2.687 1.00 0.00 C ATOM 1515 C MET A 118 4.520 0.977 -2.315 1.00 0.00 C ATOM 1516 O MET A 118 3.465 0.389 -2.126 1.00 0.00 O ATOM 1517 CB MET A 118 4.300 2.616 -4.196 1.00 0.00 C ATOM 1518 CG MET A 118 2.821 2.335 -4.544 1.00 0.00 C ATOM 1519 SD MET A 118 2.472 3.004 -6.184 1.00 0.00 S ATOM 1520 CE MET A 118 2.056 4.694 -5.660 1.00 0.00 C ATOM 0 H MET A 118 6.250 3.604 -3.044 1.00 0.00 H new ATOM 0 HA MET A 118 3.738 2.944 -2.141 1.00 0.00 H new ATOM 0 HB2 MET A 118 4.565 3.628 -4.501 1.00 0.00 H new ATOM 0 HB3 MET A 118 4.946 1.936 -4.751 1.00 0.00 H new ATOM 0 HG2 MET A 118 2.626 1.263 -4.524 1.00 0.00 H new ATOM 0 HG3 MET A 118 2.165 2.792 -3.803 1.00 0.00 H new ATOM 0 HE1 MET A 118 2.302 5.394 -6.459 1.00 0.00 H new ATOM 0 HE2 MET A 118 0.990 4.755 -5.440 1.00 0.00 H new ATOM 0 HE3 MET A 118 2.626 4.949 -4.767 1.00 0.00 H new ATOM 1530 N LEU A 119 5.699 0.392 -2.230 1.00 0.00 N ATOM 1531 CA LEU A 119 5.832 -1.015 -1.869 1.00 0.00 C ATOM 1532 C LEU A 119 5.824 -1.189 -0.361 1.00 0.00 C ATOM 1533 O LEU A 119 5.443 -2.237 0.134 1.00 0.00 O ATOM 1534 CB LEU A 119 7.125 -1.565 -2.437 1.00 0.00 C ATOM 1535 CG LEU A 119 7.088 -1.500 -3.975 1.00 0.00 C ATOM 1536 CD1 LEU A 119 8.469 -1.873 -4.533 1.00 0.00 C ATOM 1537 CD2 LEU A 119 6.022 -2.455 -4.551 1.00 0.00 C ATOM 0 H LEU A 119 6.584 0.867 -2.406 1.00 0.00 H new ATOM 0 HA LEU A 119 4.985 -1.560 -2.285 1.00 0.00 H new ATOM 0 HB2 LEU A 119 7.972 -0.991 -2.060 1.00 0.00 H new ATOM 0 HB3 LEU A 119 7.267 -2.595 -2.111 1.00 0.00 H new ATOM 0 HG LEU A 119 6.827 -0.484 -4.270 1.00 0.00 H new ATOM 0 HD11 LEU A 119 8.446 -1.828 -5.622 1.00 0.00 H new ATOM 0 HD12 LEU A 119 9.215 -1.173 -4.157 1.00 0.00 H new ATOM 0 HD13 LEU A 119 8.728 -2.884 -4.217 1.00 0.00 H new ATOM 0 HD21 LEU A 119 6.021 -2.386 -5.639 1.00 0.00 H new ATOM 0 HD22 LEU A 119 6.251 -3.478 -4.253 1.00 0.00 H new ATOM 0 HD23 LEU A 119 5.040 -2.177 -4.169 1.00 0.00 H new ATOM 1549 N GLU A 120 6.260 -0.164 0.365 1.00 0.00 N ATOM 1550 CA GLU A 120 6.313 -0.246 1.816 1.00 0.00 C ATOM 1551 C GLU A 120 4.906 -0.277 2.422 1.00 0.00 C ATOM 1552 O GLU A 120 4.621 -1.014 3.355 1.00 0.00 O ATOM 1553 CB GLU A 120 7.068 0.959 2.367 1.00 0.00 C ATOM 1554 CG GLU A 120 7.313 0.770 3.864 1.00 0.00 C ATOM 1555 CD GLU A 120 8.124 1.937 4.414 1.00 0.00 C ATOM 1556 OE1 GLU A 120 8.198 2.954 3.744 1.00 0.00 O ATOM 1557 OE2 GLU A 120 8.664 1.795 5.499 1.00 0.00 O ATOM 0 H GLU A 120 6.578 0.723 -0.025 1.00 0.00 H new ATOM 0 HA GLU A 120 6.826 -1.169 2.085 1.00 0.00 H new ATOM 0 HB2 GLU A 120 8.018 1.076 1.845 1.00 0.00 H new ATOM 0 HB3 GLU A 120 6.495 1.870 2.194 1.00 0.00 H new ATOM 0 HG2 GLU A 120 6.361 0.699 4.390 1.00 0.00 H new ATOM 0 HG3 GLU A 120 7.844 -0.166 4.038 1.00 0.00 H new ATOM 1564 N VAL A 121 4.027 0.546 1.895 1.00 0.00 N ATOM 1565 CA VAL A 121 2.666 0.612 2.420 1.00 0.00 C ATOM 1566 C VAL A 121 2.017 -0.774 2.463 1.00 0.00 C ATOM 1567 O VAL A 121 1.339 -1.125 3.428 1.00 0.00 O ATOM 1568 CB VAL A 121 1.816 1.547 1.516 1.00 0.00 C ATOM 1569 CG1 VAL A 121 2.031 3.006 1.914 1.00 0.00 C ATOM 1570 CG2 VAL A 121 2.230 1.360 0.044 1.00 0.00 C ATOM 0 H VAL A 121 4.218 1.174 1.114 1.00 0.00 H new ATOM 0 HA VAL A 121 2.709 1.000 3.438 1.00 0.00 H new ATOM 0 HB VAL A 121 0.764 1.292 1.640 1.00 0.00 H new ATOM 0 HG11 VAL A 121 1.430 3.650 1.273 1.00 0.00 H new ATOM 0 HG12 VAL A 121 1.733 3.148 2.953 1.00 0.00 H new ATOM 0 HG13 VAL A 121 3.084 3.263 1.801 1.00 0.00 H new ATOM 0 HG21 VAL A 121 1.632 2.017 -0.588 1.00 0.00 H new ATOM 0 HG22 VAL A 121 3.285 1.607 -0.071 1.00 0.00 H new ATOM 0 HG23 VAL A 121 2.065 0.324 -0.251 1.00 0.00 H new ATOM 1580 N VAL A 122 2.201 -1.538 1.403 1.00 0.00 N ATOM 1581 CA VAL A 122 1.623 -2.874 1.283 1.00 0.00 C ATOM 1582 C VAL A 122 2.417 -3.889 2.088 1.00 0.00 C ATOM 1583 O VAL A 122 1.992 -5.027 2.268 1.00 0.00 O ATOM 1584 CB VAL A 122 1.552 -3.303 -0.186 1.00 0.00 C ATOM 1585 CG1 VAL A 122 0.551 -2.422 -0.938 1.00 0.00 C ATOM 1586 CG2 VAL A 122 2.937 -3.161 -0.825 1.00 0.00 C ATOM 0 H VAL A 122 2.756 -1.254 0.596 1.00 0.00 H new ATOM 0 HA VAL A 122 0.611 -2.835 1.686 1.00 0.00 H new ATOM 0 HB VAL A 122 1.227 -4.342 -0.241 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.506 -2.732 -1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -0.435 -2.524 -0.486 1.00 0.00 H new ATOM 0 HG13 VAL A 122 0.869 -1.381 -0.883 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.888 -3.466 -1.870 1.00 0.00 H new ATOM 0 HG22 VAL A 122 3.261 -2.122 -0.765 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.649 -3.794 -0.295 1.00 0.00 H new ATOM 1596 N GLU A 123 3.582 -3.477 2.573 1.00 0.00 N ATOM 1597 CA GLU A 123 4.435 -4.375 3.372 1.00 0.00 C ATOM 1598 C GLU A 123 3.953 -4.453 4.811 1.00 0.00 C ATOM 1599 O GLU A 123 4.187 -5.448 5.490 1.00 0.00 O ATOM 1600 CB GLU A 123 5.899 -3.882 3.314 1.00 0.00 C ATOM 1601 CG GLU A 123 6.581 -4.384 2.028 1.00 0.00 C ATOM 1602 CD GLU A 123 6.910 -5.860 2.181 1.00 0.00 C ATOM 1603 OE1 GLU A 123 7.662 -6.180 3.086 1.00 0.00 O ATOM 1604 OE2 GLU A 123 6.390 -6.646 1.413 1.00 0.00 O ATOM 0 H GLU A 123 3.962 -2.541 2.435 1.00 0.00 H new ATOM 0 HA GLU A 123 4.376 -5.379 2.951 1.00 0.00 H new ATOM 0 HB2 GLU A 123 5.925 -2.793 3.346 1.00 0.00 H new ATOM 0 HB3 GLU A 123 6.445 -4.240 4.187 1.00 0.00 H new ATOM 0 HG2 GLU A 123 5.925 -4.232 1.171 1.00 0.00 H new ATOM 0 HG3 GLU A 123 7.490 -3.814 1.838 1.00 0.00 H new ATOM 1611 N SER A 124 3.294 -3.398 5.279 1.00 0.00 N ATOM 1612 CA SER A 124 2.797 -3.372 6.651 1.00 0.00 C ATOM 1613 C SER A 124 1.591 -4.287 6.795 1.00 0.00 C ATOM 1614 O SER A 124 1.288 -4.760 7.887 1.00 0.00 O ATOM 1615 CB SER A 124 2.418 -1.949 7.038 1.00 0.00 C ATOM 1616 OG SER A 124 2.142 -1.902 8.430 1.00 0.00 O ATOM 0 H SER A 124 3.093 -2.558 4.736 1.00 0.00 H new ATOM 0 HA SER A 124 3.585 -3.726 7.315 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.230 -1.264 6.793 1.00 0.00 H new ATOM 0 HB3 SER A 124 1.545 -1.625 6.471 1.00 0.00 H new ATOM 0 HG SER A 124 1.899 -0.987 8.685 1.00 0.00 H new ATOM 1622 N LEU A 125 0.909 -4.534 5.683 1.00 0.00 N ATOM 1623 CA LEU A 125 -0.268 -5.394 5.696 1.00 0.00 C ATOM 1624 C LEU A 125 0.077 -6.750 6.287 1.00 0.00 C ATOM 1625 O LEU A 125 -0.793 -7.558 6.557 1.00 0.00 O ATOM 1626 CB LEU A 125 -0.802 -5.569 4.269 1.00 0.00 C ATOM 1627 CG LEU A 125 -1.219 -4.197 3.696 1.00 0.00 C ATOM 1628 CD1 LEU A 125 -1.608 -4.363 2.222 1.00 0.00 C ATOM 1629 CD2 LEU A 125 -2.413 -3.602 4.494 1.00 0.00 C ATOM 0 H LEU A 125 1.148 -4.154 4.767 1.00 0.00 H new ATOM 0 HA LEU A 125 -1.036 -4.927 6.312 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -0.037 -6.020 3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -1.655 -6.248 4.271 1.00 0.00 H new ATOM 0 HG LEU A 125 -0.377 -3.510 3.782 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -1.903 -3.397 1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -0.756 -4.749 1.662 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -2.441 -5.061 2.142 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -2.688 -2.636 4.071 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -3.265 -4.280 4.434 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -2.125 -3.473 5.537 1.00 0.00 H new ATOM 1641 N GLU A 126 1.347 -6.995 6.499 1.00 0.00 N ATOM 1642 CA GLU A 126 1.768 -8.267 7.073 1.00 0.00 C ATOM 1643 C GLU A 126 1.314 -8.372 8.530 1.00 0.00 C ATOM 1644 O GLU A 126 1.262 -9.461 9.099 1.00 0.00 O ATOM 1645 CB GLU A 126 3.292 -8.379 7.001 1.00 0.00 C ATOM 1646 CG GLU A 126 3.736 -9.769 7.463 1.00 0.00 C ATOM 1647 CD GLU A 126 5.232 -9.948 7.238 1.00 0.00 C ATOM 1648 OE1 GLU A 126 5.908 -8.951 7.045 1.00 0.00 O ATOM 1649 OE2 GLU A 126 5.678 -11.082 7.260 1.00 0.00 O ATOM 0 H GLU A 126 2.105 -6.345 6.289 1.00 0.00 H new ATOM 0 HA GLU A 126 1.312 -9.078 6.505 1.00 0.00 H new ATOM 0 HB2 GLU A 126 3.630 -8.200 5.980 1.00 0.00 H new ATOM 0 HB3 GLU A 126 3.751 -7.614 7.627 1.00 0.00 H new ATOM 0 HG2 GLU A 126 3.502 -9.901 8.519 1.00 0.00 H new ATOM 0 HG3 GLU A 126 3.185 -10.535 6.917 1.00 0.00 H new ATOM 1656 N ASP A 127 1.002 -7.230 9.133 1.00 0.00 N ATOM 1657 CA ASP A 127 0.570 -7.206 10.527 1.00 0.00 C ATOM 1658 C ASP A 127 -0.805 -7.831 10.686 1.00 0.00 C ATOM 1659 O ASP A 127 -1.178 -8.244 11.780 1.00 0.00 O ATOM 1660 CB ASP A 127 0.535 -5.765 11.039 1.00 0.00 C ATOM 1661 CG ASP A 127 -0.358 -4.909 10.146 1.00 0.00 C ATOM 1662 OD1 ASP A 127 -0.722 -5.374 9.082 1.00 0.00 O ATOM 1663 OD2 ASP A 127 -0.666 -3.798 10.543 1.00 0.00 O ATOM 0 H ASP A 127 1.039 -6.315 8.683 1.00 0.00 H new ATOM 0 HA ASP A 127 1.285 -7.787 11.110 1.00 0.00 H new ATOM 0 HB2 ASP A 127 0.163 -5.745 12.064 1.00 0.00 H new ATOM 0 HB3 ASP A 127 1.544 -5.354 11.058 1.00 0.00 H new ATOM 1668 N VAL A 128 -1.559 -7.898 9.587 1.00 0.00 N ATOM 1669 CA VAL A 128 -2.911 -8.477 9.598 1.00 0.00 C ATOM 1670 C VAL A 128 -2.916 -9.828 8.896 1.00 0.00 C ATOM 1671 O VAL A 128 -3.941 -10.254 8.388 1.00 0.00 O ATOM 1672 CB VAL A 128 -3.899 -7.509 8.927 1.00 0.00 C ATOM 1673 CG1 VAL A 128 -4.168 -6.320 9.852 1.00 0.00 C ATOM 1674 CG2 VAL A 128 -3.307 -6.995 7.620 1.00 0.00 C ATOM 0 H VAL A 128 -1.258 -7.558 8.674 1.00 0.00 H new ATOM 0 HA VAL A 128 -3.223 -8.632 10.631 1.00 0.00 H new ATOM 0 HB VAL A 128 -4.831 -8.037 8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 128 -4.869 -5.637 9.372 1.00 0.00 H new ATOM 0 HG12 VAL A 128 -4.594 -6.677 10.789 1.00 0.00 H new ATOM 0 HG13 VAL A 128 -3.233 -5.798 10.054 1.00 0.00 H new ATOM 0 HG21 VAL A 128 -4.010 -6.309 7.147 1.00 0.00 H new ATOM 0 HG22 VAL A 128 -2.372 -6.473 7.824 1.00 0.00 H new ATOM 0 HG23 VAL A 128 -3.115 -7.835 6.952 1.00 0.00 H new ATOM 1684 N GLY A 129 -1.773 -10.515 8.897 1.00 0.00 N ATOM 1685 CA GLY A 129 -1.708 -11.833 8.287 1.00 0.00 C ATOM 1686 C GLY A 129 -2.135 -11.808 6.840 1.00 0.00 C ATOM 1687 O GLY A 129 -2.824 -12.716 6.379 1.00 0.00 O ATOM 0 H GLY A 129 -0.899 -10.185 9.306 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -0.690 -12.215 8.358 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -2.346 -12.521 8.841 1.00 0.00 H new ATOM 1691 N ILE A 130 -1.712 -10.781 6.118 1.00 0.00 N ATOM 1692 CA ILE A 130 -2.019 -10.646 4.681 1.00 0.00 C ATOM 1693 C ILE A 130 -0.761 -10.777 3.841 1.00 0.00 C ATOM 1694 O ILE A 130 0.305 -10.304 4.237 1.00 0.00 O ATOM 1695 CB ILE A 130 -2.706 -9.313 4.410 1.00 0.00 C ATOM 1696 CG1 ILE A 130 -4.131 -9.337 5.013 1.00 0.00 C ATOM 1697 CG2 ILE A 130 -2.799 -9.046 2.892 1.00 0.00 C ATOM 1698 CD1 ILE A 130 -4.787 -7.944 4.918 1.00 0.00 C ATOM 0 H ILE A 130 -1.151 -10.018 6.497 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.697 -11.452 4.400 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.119 -8.518 4.870 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.742 -10.069 4.485 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.085 -9.652 6.055 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.293 -8.089 2.720 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.796 -9.019 2.465 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.374 -9.841 2.417 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -5.788 -7.983 5.347 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -4.185 -7.220 5.467 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -4.852 -7.643 3.872 1.00 0.00 H new ATOM 1710 N ILE A 131 -0.898 -11.396 2.679 1.00 0.00 N ATOM 1711 CA ILE A 131 0.226 -11.562 1.767 1.00 0.00 C ATOM 1712 C ILE A 131 -0.265 -11.632 0.323 1.00 0.00 C ATOM 1713 O ILE A 131 -0.884 -12.592 -0.108 1.00 0.00 O ATOM 1714 CB ILE A 131 0.996 -12.841 2.136 1.00 0.00 C ATOM 1715 CG1 ILE A 131 -0.005 -13.997 2.381 1.00 0.00 C ATOM 1716 CG2 ILE A 131 1.831 -12.614 3.421 1.00 0.00 C ATOM 1717 CD1 ILE A 131 0.741 -15.258 2.787 1.00 0.00 C ATOM 0 H ILE A 131 -1.776 -11.792 2.344 1.00 0.00 H new ATOM 0 HA ILE A 131 0.892 -10.704 1.857 1.00 0.00 H new ATOM 0 HB ILE A 131 1.665 -13.096 1.314 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -0.712 -13.717 3.162 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -0.585 -14.184 1.477 1.00 0.00 H new ATOM 0 HG21 ILE A 131 2.371 -13.528 3.670 1.00 0.00 H new ATOM 0 HG22 ILE A 131 2.543 -11.806 3.254 1.00 0.00 H new ATOM 0 HG23 ILE A 131 1.167 -12.349 4.244 1.00 0.00 H new ATOM 0 HD11 ILE A 131 0.027 -16.064 2.957 1.00 0.00 H new ATOM 0 HD12 ILE A 131 1.430 -15.545 1.993 1.00 0.00 H new ATOM 0 HD13 ILE A 131 1.301 -15.070 3.703 1.00 0.00 H new ATOM 1729 N GLY A 132 0.031 -10.594 -0.427 1.00 0.00 N ATOM 1730 CA GLY A 132 -0.373 -10.533 -1.819 1.00 0.00 C ATOM 1731 C GLY A 132 0.689 -11.128 -2.728 1.00 0.00 C ATOM 1732 O GLY A 132 1.178 -12.226 -2.490 1.00 0.00 O ATOM 0 H GLY A 132 0.550 -9.779 -0.099 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -1.311 -11.071 -1.952 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -0.557 -9.497 -2.101 1.00 0.00 H new ATOM 1736 N LEU A 133 1.017 -10.399 -3.797 1.00 0.00 N ATOM 1737 CA LEU A 133 2.023 -10.858 -4.773 1.00 0.00 C ATOM 1738 C LEU A 133 3.016 -9.743 -5.076 1.00 0.00 C ATOM 1739 O LEU A 133 3.260 -9.401 -6.225 1.00 0.00 O ATOM 1740 CB LEU A 133 1.312 -11.298 -6.067 1.00 0.00 C ATOM 1741 CG LEU A 133 0.158 -10.295 -6.400 1.00 0.00 C ATOM 1742 CD1 LEU A 133 0.044 -10.111 -7.916 1.00 0.00 C ATOM 1743 CD2 LEU A 133 -1.180 -10.827 -5.847 1.00 0.00 C ATOM 0 H LEU A 133 0.606 -9.491 -4.013 1.00 0.00 H new ATOM 0 HA LEU A 133 2.571 -11.702 -4.353 1.00 0.00 H new ATOM 0 HB2 LEU A 133 2.025 -11.334 -6.891 1.00 0.00 H new ATOM 0 HB3 LEU A 133 0.910 -12.304 -5.949 1.00 0.00 H new ATOM 0 HG LEU A 133 0.385 -9.335 -5.936 1.00 0.00 H new ATOM 0 HD11 LEU A 133 -0.762 -9.411 -8.138 1.00 0.00 H new ATOM 0 HD12 LEU A 133 0.983 -9.719 -8.307 1.00 0.00 H new ATOM 0 HD13 LEU A 133 -0.171 -11.072 -8.384 1.00 0.00 H new ATOM 0 HD21 LEU A 133 -1.977 -10.122 -6.083 1.00 0.00 H new ATOM 0 HD22 LEU A 133 -1.403 -11.793 -6.301 1.00 0.00 H new ATOM 0 HD23 LEU A 133 -1.107 -10.942 -4.766 1.00 0.00 H new ATOM 1755 N LYS A 134 3.602 -9.186 -4.029 1.00 0.00 N ATOM 1756 CA LYS A 134 4.579 -8.129 -4.215 1.00 0.00 C ATOM 1757 C LYS A 134 5.791 -8.651 -4.978 1.00 0.00 C ATOM 1758 O LYS A 134 6.188 -8.077 -5.973 1.00 0.00 O ATOM 1759 CB LYS A 134 5.035 -7.605 -2.853 1.00 0.00 C ATOM 1760 CG LYS A 134 6.111 -6.522 -3.035 1.00 0.00 C ATOM 1761 CD LYS A 134 6.532 -5.967 -1.669 1.00 0.00 C ATOM 1762 CE LYS A 134 7.882 -5.236 -1.799 1.00 0.00 C ATOM 1763 NZ LYS A 134 8.980 -6.246 -1.762 1.00 0.00 N ATOM 0 H LYS A 134 3.422 -9.443 -3.058 1.00 0.00 H new ATOM 0 HA LYS A 134 4.115 -7.325 -4.787 1.00 0.00 H new ATOM 0 HB2 LYS A 134 4.184 -7.195 -2.309 1.00 0.00 H new ATOM 0 HB3 LYS A 134 5.431 -8.425 -2.254 1.00 0.00 H new ATOM 0 HG2 LYS A 134 6.976 -6.940 -3.549 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.726 -5.717 -3.661 1.00 0.00 H new ATOM 0 HD2 LYS A 134 5.771 -5.282 -1.294 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.615 -6.778 -0.946 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.918 -4.673 -2.732 1.00 0.00 H new ATOM 0 HE3 LYS A 134 8.002 -4.518 -0.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 9.810 -5.875 -2.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 9.236 -6.444 -0.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.660 -7.123 -2.220 1.00 0.00 H new ATOM 1777 N ALA A 135 6.369 -9.746 -4.508 1.00 0.00 N ATOM 1778 CA ALA A 135 7.552 -10.311 -5.162 1.00 0.00 C ATOM 1779 C ALA A 135 7.398 -10.334 -6.679 1.00 0.00 C ATOM 1780 O ALA A 135 8.383 -10.410 -7.419 1.00 0.00 O ATOM 1781 CB ALA A 135 7.792 -11.731 -4.661 1.00 0.00 C ATOM 0 H ALA A 135 6.048 -10.260 -3.687 1.00 0.00 H new ATOM 0 HA ALA A 135 8.402 -9.676 -4.913 1.00 0.00 H new ATOM 0 HB1 ALA A 135 8.673 -12.146 -5.151 1.00 0.00 H new ATOM 0 HB2 ALA A 135 7.951 -11.714 -3.583 1.00 0.00 H new ATOM 0 HB3 ALA A 135 6.924 -12.349 -4.891 1.00 0.00 H new ATOM 1787 N ARG A 136 6.149 -10.261 -7.137 1.00 0.00 N ATOM 1788 CA ARG A 136 5.869 -10.269 -8.566 1.00 0.00 C ATOM 1789 C ARG A 136 6.204 -8.927 -9.214 1.00 0.00 C ATOM 1790 O ARG A 136 6.844 -8.878 -10.265 1.00 0.00 O ATOM 1791 CB ARG A 136 4.387 -10.588 -8.797 1.00 0.00 C ATOM 1792 CG ARG A 136 4.157 -10.932 -10.270 1.00 0.00 C ATOM 1793 CD ARG A 136 2.706 -11.348 -10.476 1.00 0.00 C ATOM 1794 NE ARG A 136 2.448 -12.619 -9.809 1.00 0.00 N ATOM 1795 CZ ARG A 136 1.241 -13.177 -9.832 1.00 0.00 C ATOM 1796 NH1 ARG A 136 0.260 -12.584 -10.457 1.00 0.00 N ATOM 1797 NH2 ARG A 136 1.037 -14.317 -9.232 1.00 0.00 N ATOM 0 H ARG A 136 5.323 -10.196 -6.542 1.00 0.00 H new ATOM 0 HA ARG A 136 6.496 -11.033 -9.025 1.00 0.00 H new ATOM 0 HB2 ARG A 136 4.082 -11.423 -8.167 1.00 0.00 H new ATOM 0 HB3 ARG A 136 3.773 -9.734 -8.513 1.00 0.00 H new ATOM 0 HG2 ARG A 136 4.392 -10.071 -10.896 1.00 0.00 H new ATOM 0 HG3 ARG A 136 4.824 -11.739 -10.574 1.00 0.00 H new ATOM 0 HD2 ARG A 136 2.040 -10.580 -10.082 1.00 0.00 H new ATOM 0 HD3 ARG A 136 2.493 -11.438 -11.541 1.00 0.00 H new ATOM 0 HE ARG A 136 3.207 -13.089 -9.316 1.00 0.00 H new ATOM 0 HH11 ARG A 136 0.419 -11.693 -10.927 1.00 0.00 H new ATOM 0 HH12 ARG A 136 -0.666 -13.012 -10.475 1.00 0.00 H new ATOM 0 HH21 ARG A 136 1.803 -14.781 -8.745 1.00 0.00 H new ATOM 0 HH22 ARG A 136 0.111 -14.744 -9.250 1.00 0.00 H new ATOM 1811 N VAL A 137 5.759 -7.833 -8.589 1.00 0.00 N ATOM 1812 CA VAL A 137 6.008 -6.509 -9.132 1.00 0.00 C ATOM 1813 C VAL A 137 7.501 -6.216 -9.174 1.00 0.00 C ATOM 1814 O VAL A 137 7.959 -5.367 -9.925 1.00 0.00 O ATOM 1815 CB VAL A 137 5.271 -5.456 -8.284 1.00 0.00 C ATOM 1816 CG1 VAL A 137 6.077 -5.125 -7.003 1.00 0.00 C ATOM 1817 CG2 VAL A 137 5.075 -4.172 -9.103 1.00 0.00 C ATOM 0 H VAL A 137 5.231 -7.844 -7.716 1.00 0.00 H new ATOM 0 HA VAL A 137 5.631 -6.469 -10.154 1.00 0.00 H new ATOM 0 HB VAL A 137 4.301 -5.863 -7.998 1.00 0.00 H new ATOM 0 HG11 VAL A 137 5.539 -4.379 -6.417 1.00 0.00 H new ATOM 0 HG12 VAL A 137 6.204 -6.030 -6.409 1.00 0.00 H new ATOM 0 HG13 VAL A 137 7.055 -4.733 -7.280 1.00 0.00 H new ATOM 0 HG21 VAL A 137 4.553 -3.431 -8.498 1.00 0.00 H new ATOM 0 HG22 VAL A 137 6.047 -3.778 -9.401 1.00 0.00 H new ATOM 0 HG23 VAL A 137 4.486 -4.394 -9.993 1.00 0.00 H new ATOM 1827 N LEU A 138 8.258 -6.915 -8.350 1.00 0.00 N ATOM 1828 CA LEU A 138 9.705 -6.712 -8.307 1.00 0.00 C ATOM 1829 C LEU A 138 10.334 -7.098 -9.636 1.00 0.00 C ATOM 1830 O LEU A 138 11.309 -6.486 -10.062 1.00 0.00 O ATOM 1831 CB LEU A 138 10.328 -7.548 -7.155 1.00 0.00 C ATOM 1832 CG LEU A 138 10.413 -6.719 -5.866 1.00 0.00 C ATOM 1833 CD1 LEU A 138 9.023 -6.250 -5.441 1.00 0.00 C ATOM 1834 CD2 LEU A 138 11.042 -7.567 -4.762 1.00 0.00 C ATOM 0 H LEU A 138 7.906 -7.623 -7.705 1.00 0.00 H new ATOM 0 HA LEU A 138 9.904 -5.656 -8.123 1.00 0.00 H new ATOM 0 HB2 LEU A 138 9.727 -8.440 -6.980 1.00 0.00 H new ATOM 0 HB3 LEU A 138 11.324 -7.886 -7.442 1.00 0.00 H new ATOM 0 HG LEU A 138 11.031 -5.839 -6.046 1.00 0.00 H new ATOM 0 HD11 LEU A 138 9.101 -5.664 -4.525 1.00 0.00 H new ATOM 0 HD12 LEU A 138 8.589 -5.635 -6.230 1.00 0.00 H new ATOM 0 HD13 LEU A 138 8.385 -7.116 -5.264 1.00 0.00 H new ATOM 0 HD21 LEU A 138 11.104 -6.982 -3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 138 10.428 -8.451 -4.588 1.00 0.00 H new ATOM 0 HD23 LEU A 138 12.043 -7.874 -5.065 1.00 0.00 H new ATOM 1846 N GLU A 139 9.788 -8.125 -10.260 1.00 0.00 N ATOM 1847 CA GLU A 139 10.325 -8.597 -11.522 1.00 0.00 C ATOM 1848 C GLU A 139 10.258 -7.499 -12.576 1.00 0.00 C ATOM 1849 O GLU A 139 11.044 -7.482 -13.521 1.00 0.00 O ATOM 1850 CB GLU A 139 9.539 -9.812 -12.000 1.00 0.00 C ATOM 1851 CG GLU A 139 9.597 -10.908 -10.935 1.00 0.00 C ATOM 1852 CD GLU A 139 8.791 -12.128 -11.384 1.00 0.00 C ATOM 1853 OE1 GLU A 139 8.272 -12.103 -12.490 1.00 0.00 O ATOM 1854 OE2 GLU A 139 8.704 -13.072 -10.616 1.00 0.00 O ATOM 0 H GLU A 139 8.980 -8.644 -9.917 1.00 0.00 H new ATOM 0 HA GLU A 139 11.368 -8.876 -11.370 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.503 -9.534 -12.195 1.00 0.00 H new ATOM 0 HB3 GLU A 139 9.953 -10.180 -12.939 1.00 0.00 H new ATOM 0 HG2 GLU A 139 10.633 -11.195 -10.754 1.00 0.00 H new ATOM 0 HG3 GLU A 139 9.202 -10.530 -9.992 1.00 0.00 H new ATOM 1861 N GLU A 140 9.308 -6.584 -12.409 1.00 0.00 N ATOM 1862 CA GLU A 140 9.143 -5.492 -13.362 1.00 0.00 C ATOM 1863 C GLU A 140 10.438 -4.693 -13.480 1.00 0.00 C ATOM 1864 O GLU A 140 10.934 -4.462 -14.582 1.00 0.00 O ATOM 1865 CB GLU A 140 8.020 -4.564 -12.900 1.00 0.00 C ATOM 1866 CG GLU A 140 6.692 -5.323 -12.905 1.00 0.00 C ATOM 1867 CD GLU A 140 5.564 -4.423 -12.407 1.00 0.00 C ATOM 1868 OE1 GLU A 140 5.836 -3.278 -12.078 1.00 0.00 O ATOM 1869 OE2 GLU A 140 4.442 -4.896 -12.361 1.00 0.00 O ATOM 0 H GLU A 140 8.648 -6.576 -11.632 1.00 0.00 H new ATOM 0 HA GLU A 140 8.892 -5.915 -14.335 1.00 0.00 H new ATOM 0 HB2 GLU A 140 8.233 -4.190 -11.899 1.00 0.00 H new ATOM 0 HB3 GLU A 140 7.957 -3.697 -13.558 1.00 0.00 H new ATOM 0 HG2 GLU A 140 6.469 -5.672 -13.913 1.00 0.00 H new ATOM 0 HG3 GLU A 140 6.768 -6.206 -12.271 1.00 0.00 H new ATOM 1876 N SER A 141 10.984 -4.280 -12.338 1.00 0.00 N ATOM 1877 CA SER A 141 12.225 -3.513 -12.331 1.00 0.00 C ATOM 1878 C SER A 141 13.391 -4.387 -12.769 1.00 0.00 C ATOM 1879 O SER A 141 14.305 -3.924 -13.451 1.00 0.00 O ATOM 1880 CB SER A 141 12.492 -2.963 -10.932 1.00 0.00 C ATOM 1881 OG SER A 141 12.579 -4.040 -10.010 1.00 0.00 O ATOM 0 H SER A 141 10.590 -4.462 -11.415 1.00 0.00 H new ATOM 0 HA SER A 141 12.123 -2.683 -13.030 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.418 -2.389 -10.926 1.00 0.00 H new ATOM 0 HB3 SER A 141 11.693 -2.282 -10.638 1.00 0.00 H new ATOM 0 HG SER A 141 12.040 -4.792 -10.333 1.00 0.00 H new ATOM 1887 N LYS A 142 13.367 -5.652 -12.369 1.00 0.00 N ATOM 1888 CA LYS A 142 14.434 -6.578 -12.717 1.00 0.00 C ATOM 1889 C LYS A 142 14.634 -6.611 -14.227 1.00 0.00 C ATOM 1890 O LYS A 142 15.751 -6.793 -14.709 1.00 0.00 O ATOM 1891 CB LYS A 142 14.076 -7.977 -12.225 1.00 0.00 C ATOM 1892 CG LYS A 142 15.273 -8.923 -12.417 1.00 0.00 C ATOM 1893 CD LYS A 142 14.885 -10.357 -12.021 1.00 0.00 C ATOM 1894 CE LYS A 142 14.684 -10.466 -10.503 1.00 0.00 C ATOM 1895 NZ LYS A 142 15.817 -9.797 -9.803 1.00 0.00 N ATOM 0 H LYS A 142 12.621 -6.059 -11.804 1.00 0.00 H new ATOM 0 HA LYS A 142 15.357 -6.244 -12.243 1.00 0.00 H new ATOM 0 HB2 LYS A 142 13.795 -7.941 -11.172 1.00 0.00 H new ATOM 0 HB3 LYS A 142 13.212 -8.354 -12.772 1.00 0.00 H new ATOM 0 HG2 LYS A 142 15.600 -8.901 -13.456 1.00 0.00 H new ATOM 0 HG3 LYS A 142 16.114 -8.585 -11.811 1.00 0.00 H new ATOM 0 HD2 LYS A 142 13.969 -10.646 -12.536 1.00 0.00 H new ATOM 0 HD3 LYS A 142 15.663 -11.051 -12.340 1.00 0.00 H new ATOM 0 HE2 LYS A 142 13.740 -10.002 -10.216 1.00 0.00 H new ATOM 0 HE3 LYS A 142 14.627 -11.514 -10.207 1.00 0.00 H new ATOM 0 HZ1 LYS A 142 15.918 -10.195 -8.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 142 16.696 -9.953 -10.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 142 15.629 -8.776 -9.735 1.00 0.00 H new ATOM 1909 N ASN A 143 13.546 -6.438 -14.965 1.00 0.00 N ATOM 1910 CA ASN A 143 13.619 -6.452 -16.422 1.00 0.00 C ATOM 1911 C ASN A 143 14.323 -5.214 -16.932 1.00 0.00 C ATOM 1912 O ASN A 143 15.255 -5.315 -17.733 1.00 0.00 O ATOM 1913 CB ASN A 143 12.211 -6.503 -17.014 1.00 0.00 C ATOM 1914 CG ASN A 143 11.545 -7.823 -16.648 1.00 0.00 C ATOM 1915 OD1 ASN A 143 12.271 -8.903 -16.542 1.00 0.00 O flip ATOM 1916 ND2 ASN A 143 10.331 -7.871 -16.455 1.00 0.00 N flip ATOM 0 H ASN A 143 12.611 -6.288 -14.585 1.00 0.00 H new ATOM 0 HA ASN A 143 14.181 -7.335 -16.727 1.00 0.00 H new ATOM 0 HB2 ASN A 143 11.618 -5.669 -16.638 1.00 0.00 H new ATOM 0 HB3 ASN A 143 12.258 -6.397 -18.098 1.00 0.00 H new ATOM 0 HD21 ASN A 143 9.767 -7.025 -16.539 1.00 0.00 H new ATOM 0 HD22 ASN A 143 9.888 -8.757 -16.211 1.00 0.00 H new ATOM 1923 N ASN A 144 13.881 -4.047 -16.459 1.00 0.00 N ATOM 1924 CA ASN A 144 14.486 -2.783 -16.876 1.00 0.00 C ATOM 1925 C ASN A 144 14.671 -1.846 -15.673 1.00 0.00 C ATOM 1926 O ASN A 144 13.738 -1.646 -14.892 1.00 0.00 O ATOM 1927 CB ASN A 144 13.634 -2.096 -17.932 1.00 0.00 C ATOM 1928 CG ASN A 144 14.339 -0.827 -18.419 1.00 0.00 C ATOM 1929 OD1 ASN A 144 14.127 0.254 -17.869 1.00 0.00 O ATOM 1930 ND2 ASN A 144 15.170 -0.893 -19.428 1.00 0.00 N ATOM 0 H ASN A 144 13.114 -3.952 -15.794 1.00 0.00 H new ATOM 0 HA ASN A 144 15.463 -3.009 -17.304 1.00 0.00 H new ATOM 0 HB2 ASN A 144 13.461 -2.772 -18.770 1.00 0.00 H new ATOM 0 HB3 ASN A 144 12.657 -1.845 -17.518 1.00 0.00 H new ATOM 0 HD21 ASN A 144 15.640 -0.050 -19.757 1.00 0.00 H new ATOM 0 HD22 ASN A 144 15.347 -1.787 -19.885 1.00 0.00 H new ATOM 1937 N PRO A 145 15.837 -1.261 -15.506 1.00 0.00 N ATOM 1938 CA PRO A 145 16.110 -0.323 -14.378 1.00 0.00 C ATOM 1939 C PRO A 145 15.009 0.713 -14.213 1.00 0.00 C ATOM 1940 O PRO A 145 14.799 1.228 -13.116 1.00 0.00 O ATOM 1941 CB PRO A 145 17.433 0.367 -14.788 1.00 0.00 C ATOM 1942 CG PRO A 145 18.127 -0.624 -15.669 1.00 0.00 C ATOM 1943 CD PRO A 145 17.036 -1.428 -16.356 1.00 0.00 C ATOM 0 HA PRO A 145 16.164 -0.845 -13.423 1.00 0.00 H new ATOM 0 HB2 PRO A 145 17.244 1.301 -15.317 1.00 0.00 H new ATOM 0 HB3 PRO A 145 18.038 0.611 -13.915 1.00 0.00 H new ATOM 0 HG2 PRO A 145 18.756 -0.118 -16.402 1.00 0.00 H new ATOM 0 HG3 PRO A 145 18.778 -1.274 -15.084 1.00 0.00 H new ATOM 0 HD2 PRO A 145 16.856 -1.063 -17.367 1.00 0.00 H new ATOM 0 HD3 PRO A 145 17.315 -2.478 -16.441 1.00 0.00 H new ATOM 1951 N ILE A 146 14.319 1.022 -15.308 1.00 0.00 N ATOM 1952 CA ILE A 146 13.252 2.006 -15.275 1.00 0.00 C ATOM 1953 C ILE A 146 13.804 3.376 -14.896 1.00 0.00 C ATOM 1954 O ILE A 146 14.660 3.490 -14.026 1.00 0.00 O ATOM 1955 CB ILE A 146 12.145 1.558 -14.258 1.00 0.00 C ATOM 1956 CG1 ILE A 146 10.767 1.483 -14.944 1.00 0.00 C ATOM 1957 CG2 ILE A 146 12.028 2.529 -13.043 1.00 0.00 C ATOM 1958 CD1 ILE A 146 9.728 0.834 -14.024 1.00 0.00 C ATOM 0 H ILE A 146 14.482 0.604 -16.224 1.00 0.00 H new ATOM 0 HA ILE A 146 12.808 2.080 -16.268 1.00 0.00 H new ATOM 0 HB ILE A 146 12.446 0.574 -13.898 1.00 0.00 H new ATOM 0 HG12 ILE A 146 10.439 2.486 -15.218 1.00 0.00 H new ATOM 0 HG13 ILE A 146 10.848 0.910 -15.868 1.00 0.00 H new ATOM 0 HG21 ILE A 146 11.248 2.175 -12.368 1.00 0.00 H new ATOM 0 HG22 ILE A 146 12.979 2.564 -12.512 1.00 0.00 H new ATOM 0 HG23 ILE A 146 11.774 3.528 -13.398 1.00 0.00 H new ATOM 0 HD11 ILE A 146 8.765 0.794 -14.534 1.00 0.00 H new ATOM 0 HD12 ILE A 146 10.047 -0.177 -13.771 1.00 0.00 H new ATOM 0 HD13 ILE A 146 9.632 1.423 -13.112 1.00 0.00 H new ATOM 1970 N ASN A 147 13.276 4.408 -15.531 1.00 0.00 N ATOM 1971 CA ASN A 147 13.689 5.766 -15.219 1.00 0.00 C ATOM 1972 C ASN A 147 12.875 6.771 -16.022 1.00 0.00 C ATOM 1973 O ASN A 147 13.412 7.757 -16.510 1.00 0.00 O ATOM 1974 CB ASN A 147 15.172 5.929 -15.534 1.00 0.00 C ATOM 1975 CG ASN A 147 15.441 5.451 -16.954 1.00 0.00 C ATOM 1976 OD1 ASN A 147 14.853 5.967 -17.906 1.00 0.00 O ATOM 1977 ND2 ASN A 147 16.295 4.485 -17.156 1.00 0.00 N ATOM 0 H ASN A 147 12.566 4.334 -16.260 1.00 0.00 H new ATOM 0 HA ASN A 147 13.517 5.953 -14.159 1.00 0.00 H new ATOM 0 HB2 ASN A 147 15.465 6.973 -15.428 1.00 0.00 H new ATOM 0 HB3 ASN A 147 15.771 5.356 -14.826 1.00 0.00 H new ATOM 0 HD21 ASN A 147 16.477 4.155 -18.104 1.00 0.00 H new ATOM 0 HD22 ASN A 147 16.780 4.060 -16.366 1.00 0.00 H new ATOM 1984 N THR A 148 11.575 6.517 -16.157 1.00 0.00 N ATOM 1985 CA THR A 148 10.697 7.419 -16.914 1.00 0.00 C ATOM 1986 C THR A 148 9.313 7.467 -16.291 1.00 0.00 C ATOM 1987 O THR A 148 8.631 6.460 -16.217 1.00 0.00 O ATOM 1988 CB THR A 148 10.587 6.934 -18.359 1.00 0.00 C ATOM 1989 OG1 THR A 148 10.011 5.644 -18.373 1.00 0.00 O ATOM 1990 CG2 THR A 148 11.975 6.867 -18.987 1.00 0.00 C ATOM 0 H THR A 148 11.106 5.704 -15.758 1.00 0.00 H new ATOM 0 HA THR A 148 11.126 8.421 -16.892 1.00 0.00 H new ATOM 0 HB THR A 148 9.965 7.627 -18.926 1.00 0.00 H new ATOM 0 HG1 THR A 148 10.593 5.021 -17.890 1.00 0.00 H new ATOM 0 HG21 THR A 148 11.892 6.521 -20.017 1.00 0.00 H new ATOM 0 HG22 THR A 148 12.429 7.858 -18.973 1.00 0.00 H new ATOM 0 HG23 THR A 148 12.598 6.174 -18.421 1.00 0.00 H new ATOM 1998 N ALA A 149 8.915 8.650 -15.847 1.00 0.00 N ATOM 1999 CA ALA A 149 7.607 8.840 -15.218 1.00 0.00 C ATOM 2000 C ALA A 149 6.500 8.263 -16.072 1.00 0.00 C ATOM 2001 O ALA A 149 5.855 7.309 -15.665 1.00 0.00 O ATOM 2002 CB ALA A 149 7.338 10.316 -14.976 1.00 0.00 C ATOM 0 H ALA A 149 9.478 9.498 -15.909 1.00 0.00 H new ATOM 0 HA ALA A 149 7.625 8.314 -14.263 1.00 0.00 H new ATOM 0 HB1 ALA A 149 6.361 10.436 -14.508 1.00 0.00 H new ATOM 0 HB2 ALA A 149 8.107 10.723 -14.320 1.00 0.00 H new ATOM 0 HB3 ALA A 149 7.353 10.849 -15.927 1.00 0.00 H new ATOM 2008 N GLU A 150 6.278 8.858 -17.251 1.00 0.00 N ATOM 2009 CA GLU A 150 5.226 8.404 -18.167 1.00 0.00 C ATOM 2010 C GLU A 150 5.049 6.893 -18.113 1.00 0.00 C ATOM 2011 O GLU A 150 3.930 6.379 -18.109 1.00 0.00 O ATOM 2012 CB GLU A 150 5.593 8.807 -19.601 1.00 0.00 C ATOM 2013 CG GLU A 150 6.937 8.160 -20.002 1.00 0.00 C ATOM 2014 CD GLU A 150 7.465 8.785 -21.283 1.00 0.00 C ATOM 2015 OE1 GLU A 150 7.331 9.987 -21.430 1.00 0.00 O ATOM 2016 OE2 GLU A 150 7.999 8.051 -22.099 1.00 0.00 O ATOM 0 H GLU A 150 6.814 9.656 -17.592 1.00 0.00 H new ATOM 0 HA GLU A 150 4.290 8.872 -17.861 1.00 0.00 H new ATOM 0 HB2 GLU A 150 4.808 8.492 -20.289 1.00 0.00 H new ATOM 0 HB3 GLU A 150 5.665 9.892 -19.676 1.00 0.00 H new ATOM 0 HG2 GLU A 150 7.664 8.290 -19.200 1.00 0.00 H new ATOM 0 HG3 GLU A 150 6.804 7.087 -20.141 1.00 0.00 H new ATOM 2023 N ARG A 151 6.165 6.176 -18.059 1.00 0.00 N ATOM 2024 CA ARG A 151 6.120 4.718 -17.993 1.00 0.00 C ATOM 2025 C ARG A 151 5.988 4.282 -16.538 1.00 0.00 C ATOM 2026 O ARG A 151 5.398 3.249 -16.233 1.00 0.00 O ATOM 2027 CB ARG A 151 7.403 4.118 -18.655 1.00 0.00 C ATOM 2028 CG ARG A 151 8.348 3.465 -17.612 1.00 0.00 C ATOM 2029 CD ARG A 151 9.482 2.746 -18.296 1.00 0.00 C ATOM 2030 NE ARG A 151 8.967 1.557 -18.951 1.00 0.00 N ATOM 2031 CZ ARG A 151 9.766 0.787 -19.668 1.00 0.00 C ATOM 2032 NH1 ARG A 151 11.027 1.098 -19.784 1.00 0.00 N ATOM 2033 NH2 ARG A 151 9.297 -0.277 -20.255 1.00 0.00 N ATOM 0 H ARG A 151 7.104 6.574 -18.059 1.00 0.00 H new ATOM 0 HA ARG A 151 5.255 4.346 -18.542 1.00 0.00 H new ATOM 0 HB2 ARG A 151 7.113 3.374 -19.397 1.00 0.00 H new ATOM 0 HB3 ARG A 151 7.938 4.905 -19.186 1.00 0.00 H new ATOM 0 HG2 ARG A 151 8.746 4.230 -16.945 1.00 0.00 H new ATOM 0 HG3 ARG A 151 7.787 2.764 -16.994 1.00 0.00 H new ATOM 0 HD2 ARG A 151 9.956 3.402 -19.026 1.00 0.00 H new ATOM 0 HD3 ARG A 151 10.247 2.473 -17.569 1.00 0.00 H new ATOM 0 HE ARG A 151 7.981 1.314 -18.857 1.00 0.00 H new ATOM 0 HH11 ARG A 151 11.391 1.932 -19.323 1.00 0.00 H new ATOM 0 HH12 ARG A 151 11.649 0.508 -20.336 1.00 0.00 H new ATOM 0 HH21 ARG A 151 8.310 -0.518 -20.162 1.00 0.00 H new ATOM 0 HH22 ARG A 151 9.917 -0.869 -20.808 1.00 0.00 H new ATOM 2047 N LEU A 152 6.609 5.028 -15.639 1.00 0.00 N ATOM 2048 CA LEU A 152 6.601 4.641 -14.246 1.00 0.00 C ATOM 2049 C LEU A 152 5.168 4.609 -13.737 1.00 0.00 C ATOM 2050 O LEU A 152 4.761 3.691 -13.037 1.00 0.00 O ATOM 2051 CB LEU A 152 7.442 5.648 -13.411 1.00 0.00 C ATOM 2052 CG LEU A 152 8.052 4.952 -12.186 1.00 0.00 C ATOM 2053 CD1 LEU A 152 6.939 4.304 -11.333 1.00 0.00 C ATOM 2054 CD2 LEU A 152 9.092 3.883 -12.633 1.00 0.00 C ATOM 0 H LEU A 152 7.115 5.889 -15.847 1.00 0.00 H new ATOM 0 HA LEU A 152 7.040 3.649 -14.144 1.00 0.00 H new ATOM 0 HB2 LEU A 152 8.234 6.070 -14.029 1.00 0.00 H new ATOM 0 HB3 LEU A 152 6.813 6.478 -13.089 1.00 0.00 H new ATOM 0 HG LEU A 152 8.565 5.697 -11.578 1.00 0.00 H new ATOM 0 HD11 LEU A 152 7.383 3.813 -10.467 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.244 5.073 -10.997 1.00 0.00 H new ATOM 0 HD13 LEU A 152 6.404 3.568 -11.932 1.00 0.00 H new ATOM 0 HD21 LEU A 152 9.516 3.398 -11.754 1.00 0.00 H new ATOM 0 HD22 LEU A 152 8.601 3.137 -13.258 1.00 0.00 H new ATOM 0 HD23 LEU A 152 9.888 4.365 -13.201 1.00 0.00 H new ATOM 2066 N LEU A 153 4.423 5.622 -14.097 1.00 0.00 N ATOM 2067 CA LEU A 153 3.054 5.711 -13.669 1.00 0.00 C ATOM 2068 C LEU A 153 2.315 4.401 -13.930 1.00 0.00 C ATOM 2069 O LEU A 153 1.409 4.028 -13.184 1.00 0.00 O ATOM 2070 CB LEU A 153 2.351 6.856 -14.415 1.00 0.00 C ATOM 2071 CG LEU A 153 1.073 7.290 -13.646 1.00 0.00 C ATOM 2072 CD1 LEU A 153 1.421 8.370 -12.607 1.00 0.00 C ATOM 2073 CD2 LEU A 153 0.035 7.848 -14.627 1.00 0.00 C ATOM 0 H LEU A 153 4.741 6.394 -14.683 1.00 0.00 H new ATOM 0 HA LEU A 153 3.042 5.908 -12.597 1.00 0.00 H new ATOM 0 HB2 LEU A 153 3.029 7.704 -14.517 1.00 0.00 H new ATOM 0 HB3 LEU A 153 2.087 6.536 -15.423 1.00 0.00 H new ATOM 0 HG LEU A 153 0.661 6.419 -13.137 1.00 0.00 H new ATOM 0 HD11 LEU A 153 0.518 8.667 -12.074 1.00 0.00 H new ATOM 0 HD12 LEU A 153 2.147 7.972 -11.898 1.00 0.00 H new ATOM 0 HD13 LEU A 153 1.846 9.238 -13.112 1.00 0.00 H new ATOM 0 HD21 LEU A 153 -0.858 8.150 -14.079 1.00 0.00 H new ATOM 0 HD22 LEU A 153 0.452 8.711 -15.146 1.00 0.00 H new ATOM 0 HD23 LEU A 153 -0.228 7.080 -15.354 1.00 0.00 H new ATOM 2085 N ALA A 154 2.711 3.722 -14.996 1.00 0.00 N ATOM 2086 CA ALA A 154 2.087 2.461 -15.355 1.00 0.00 C ATOM 2087 C ALA A 154 2.290 1.429 -14.249 1.00 0.00 C ATOM 2088 O ALA A 154 1.491 0.508 -14.095 1.00 0.00 O ATOM 2089 CB ALA A 154 2.684 1.937 -16.665 1.00 0.00 C ATOM 0 H ALA A 154 3.457 4.022 -15.623 1.00 0.00 H new ATOM 0 HA ALA A 154 1.018 2.629 -15.486 1.00 0.00 H new ATOM 0 HB1 ALA A 154 2.211 0.991 -16.928 1.00 0.00 H new ATOM 0 HB2 ALA A 154 2.510 2.662 -17.460 1.00 0.00 H new ATOM 0 HB3 ALA A 154 3.756 1.784 -16.541 1.00 0.00 H new ATOM 2095 N ALA A 155 3.367 1.591 -13.483 1.00 0.00 N ATOM 2096 CA ALA A 155 3.665 0.665 -12.398 1.00 0.00 C ATOM 2097 C ALA A 155 2.575 0.716 -11.342 1.00 0.00 C ATOM 2098 O ALA A 155 1.874 -0.263 -11.111 1.00 0.00 O ATOM 2099 CB ALA A 155 5.011 1.023 -11.761 1.00 0.00 C ATOM 0 H ALA A 155 4.041 2.348 -13.594 1.00 0.00 H new ATOM 0 HA ALA A 155 3.714 -0.344 -12.808 1.00 0.00 H new ATOM 0 HB1 ALA A 155 5.227 0.326 -10.951 1.00 0.00 H new ATOM 0 HB2 ALA A 155 5.798 0.960 -12.513 1.00 0.00 H new ATOM 0 HB3 ALA A 155 4.968 2.038 -11.365 1.00 0.00 H new ATOM 2105 N LYS A 156 2.429 1.870 -10.711 1.00 0.00 N ATOM 2106 CA LYS A 156 1.422 2.031 -9.676 1.00 0.00 C ATOM 2107 C LYS A 156 0.051 1.551 -10.169 1.00 0.00 C ATOM 2108 O LYS A 156 -0.671 0.838 -9.467 1.00 0.00 O ATOM 2109 CB LYS A 156 1.346 3.509 -9.271 1.00 0.00 C ATOM 2110 CG LYS A 156 0.152 3.723 -8.296 1.00 0.00 C ATOM 2111 CD LYS A 156 -1.198 3.952 -9.079 1.00 0.00 C ATOM 2112 CE LYS A 156 -1.828 5.263 -8.641 1.00 0.00 C ATOM 2113 NZ LYS A 156 -1.988 5.248 -7.162 1.00 0.00 N ATOM 0 H LYS A 156 2.990 2.702 -10.895 1.00 0.00 H new ATOM 0 HA LYS A 156 1.702 1.426 -8.813 1.00 0.00 H new ATOM 0 HB2 LYS A 156 2.277 3.814 -8.794 1.00 0.00 H new ATOM 0 HB3 LYS A 156 1.222 4.133 -10.156 1.00 0.00 H new ATOM 0 HG2 LYS A 156 0.053 2.855 -7.644 1.00 0.00 H new ATOM 0 HG3 LYS A 156 0.353 4.582 -7.656 1.00 0.00 H new ATOM 0 HD2 LYS A 156 -1.009 3.969 -10.152 1.00 0.00 H new ATOM 0 HD3 LYS A 156 -1.884 3.126 -8.889 1.00 0.00 H new ATOM 0 HE2 LYS A 156 -1.202 6.102 -8.944 1.00 0.00 H new ATOM 0 HE3 LYS A 156 -2.796 5.396 -9.124 1.00 0.00 H new ATOM 0 HZ1 LYS A 156 -2.868 5.738 -6.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 156 -2.028 4.264 -6.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 156 -1.180 5.731 -6.720 1.00 0.00 H new ATOM 2127 N ALA A 157 -0.295 1.945 -11.387 1.00 0.00 N ATOM 2128 CA ALA A 157 -1.574 1.552 -11.966 1.00 0.00 C ATOM 2129 C ALA A 157 -1.707 0.039 -12.002 1.00 0.00 C ATOM 2130 O ALA A 157 -2.807 -0.503 -11.904 1.00 0.00 O ATOM 2131 CB ALA A 157 -1.702 2.102 -13.382 1.00 0.00 C ATOM 0 H ALA A 157 0.285 2.530 -11.989 1.00 0.00 H new ATOM 0 HA ALA A 157 -2.367 1.963 -11.342 1.00 0.00 H new ATOM 0 HB1 ALA A 157 -2.661 1.802 -13.804 1.00 0.00 H new ATOM 0 HB2 ALA A 157 -1.641 3.190 -13.357 1.00 0.00 H new ATOM 0 HB3 ALA A 157 -0.895 1.708 -14.000 1.00 0.00 H new ATOM 2137 N GLN A 158 -0.583 -0.650 -12.145 1.00 0.00 N ATOM 2138 CA GLN A 158 -0.593 -2.102 -12.184 1.00 0.00 C ATOM 2139 C GLN A 158 -0.853 -2.664 -10.777 1.00 0.00 C ATOM 2140 O GLN A 158 -1.521 -3.693 -10.608 1.00 0.00 O ATOM 2141 CB GLN A 158 0.775 -2.604 -12.772 1.00 0.00 C ATOM 2142 CG GLN A 158 1.682 -3.260 -11.700 1.00 0.00 C ATOM 2143 CD GLN A 158 1.101 -4.624 -11.291 1.00 0.00 C ATOM 2144 OE1 GLN A 158 0.111 -5.143 -11.985 1.00 0.00 O flip ATOM 2145 NE2 GLN A 158 1.526 -5.215 -10.290 1.00 0.00 N flip ATOM 0 H GLN A 158 0.341 -0.228 -12.235 1.00 0.00 H new ATOM 0 HA GLN A 158 -1.397 -2.459 -12.828 1.00 0.00 H new ATOM 0 HB2 GLN A 158 0.582 -3.323 -13.568 1.00 0.00 H new ATOM 0 HB3 GLN A 158 1.302 -1.763 -13.223 1.00 0.00 H new ATOM 0 HG2 GLN A 158 2.691 -3.387 -12.092 1.00 0.00 H new ATOM 0 HG3 GLN A 158 1.758 -2.611 -10.828 1.00 0.00 H new ATOM 0 HE21 GLN A 158 2.293 -4.816 -9.749 1.00 0.00 H new ATOM 0 HE22 GLN A 158 1.109 -6.101 -10.006 1.00 0.00 H new ATOM 2154 N ILE A 159 -0.261 -2.013 -9.778 1.00 0.00 N ATOM 2155 CA ILE A 159 -0.370 -2.471 -8.407 1.00 0.00 C ATOM 2156 C ILE A 159 -1.775 -2.221 -7.908 1.00 0.00 C ATOM 2157 O ILE A 159 -2.325 -3.027 -7.168 1.00 0.00 O ATOM 2158 CB ILE A 159 0.657 -1.766 -7.503 1.00 0.00 C ATOM 2159 CG1 ILE A 159 2.079 -1.907 -8.115 1.00 0.00 C ATOM 2160 CG2 ILE A 159 0.638 -2.403 -6.092 1.00 0.00 C ATOM 2161 CD1 ILE A 159 3.154 -1.458 -7.112 1.00 0.00 C ATOM 0 H ILE A 159 0.297 -1.168 -9.899 1.00 0.00 H new ATOM 0 HA ILE A 159 -0.157 -3.540 -8.375 1.00 0.00 H new ATOM 0 HB ILE A 159 0.398 -0.710 -7.426 1.00 0.00 H new ATOM 0 HG12 ILE A 159 2.254 -2.944 -8.403 1.00 0.00 H new ATOM 0 HG13 ILE A 159 2.150 -1.308 -9.023 1.00 0.00 H new ATOM 0 HG21 ILE A 159 1.367 -1.900 -5.456 1.00 0.00 H new ATOM 0 HG22 ILE A 159 -0.356 -2.297 -5.658 1.00 0.00 H new ATOM 0 HG23 ILE A 159 0.890 -3.461 -6.167 1.00 0.00 H new ATOM 0 HD11 ILE A 159 4.140 -1.566 -7.563 1.00 0.00 H new ATOM 0 HD12 ILE A 159 2.989 -0.414 -6.845 1.00 0.00 H new ATOM 0 HD13 ILE A 159 3.096 -2.075 -6.215 1.00 0.00 H new ATOM 2173 N GLU A 160 -2.339 -1.090 -8.314 1.00 0.00 N ATOM 2174 CA GLU A 160 -3.669 -0.736 -7.889 1.00 0.00 C ATOM 2175 C GLU A 160 -4.648 -1.860 -8.225 1.00 0.00 C ATOM 2176 O GLU A 160 -5.594 -2.115 -7.480 1.00 0.00 O ATOM 2177 CB GLU A 160 -4.103 0.569 -8.590 1.00 0.00 C ATOM 2178 CG GLU A 160 -5.153 1.301 -7.756 1.00 0.00 C ATOM 2179 CD GLU A 160 -6.414 0.445 -7.650 1.00 0.00 C ATOM 2180 OE1 GLU A 160 -6.822 -0.103 -8.662 1.00 0.00 O ATOM 2181 OE2 GLU A 160 -6.950 0.343 -6.558 1.00 0.00 O ATOM 0 H GLU A 160 -1.892 -0.413 -8.932 1.00 0.00 H new ATOM 0 HA GLU A 160 -3.671 -0.585 -6.810 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -3.237 1.213 -8.741 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -4.507 0.342 -9.576 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -4.760 1.511 -6.761 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -5.391 2.261 -8.214 1.00 0.00 H new ATOM 2188 N ASN A 161 -4.404 -2.518 -9.345 1.00 0.00 N ATOM 2189 CA ASN A 161 -5.267 -3.610 -9.770 1.00 0.00 C ATOM 2190 C ASN A 161 -5.177 -4.754 -8.775 1.00 0.00 C ATOM 2191 O ASN A 161 -6.080 -5.576 -8.689 1.00 0.00 O ATOM 2192 CB ASN A 161 -4.848 -4.100 -11.163 1.00 0.00 C ATOM 2193 CG ASN A 161 -5.178 -3.041 -12.211 1.00 0.00 C ATOM 2194 OD1 ASN A 161 -6.044 -2.197 -11.989 1.00 0.00 O ATOM 2195 ND2 ASN A 161 -4.533 -3.035 -13.344 1.00 0.00 N ATOM 0 H ASN A 161 -3.624 -2.319 -9.972 1.00 0.00 H new ATOM 0 HA ASN A 161 -6.296 -3.252 -9.814 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -3.779 -4.315 -11.176 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -5.363 -5.031 -11.400 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -4.746 -2.329 -14.049 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -3.815 -3.736 -13.526 1.00 0.00 H new ATOM 2202 N GLN A 162 -4.085 -4.806 -8.024 1.00 0.00 N ATOM 2203 CA GLN A 162 -3.899 -5.867 -7.042 1.00 0.00 C ATOM 2204 C GLN A 162 -4.906 -5.727 -5.897 1.00 0.00 C ATOM 2205 O GLN A 162 -5.501 -6.704 -5.441 1.00 0.00 O ATOM 2206 CB GLN A 162 -2.465 -5.806 -6.481 1.00 0.00 C ATOM 2207 CG GLN A 162 -2.049 -7.191 -5.961 1.00 0.00 C ATOM 2208 CD GLN A 162 -0.797 -7.084 -5.112 1.00 0.00 C ATOM 2209 OE1 GLN A 162 -0.777 -7.665 -3.948 1.00 0.00 O flip ATOM 2210 NE2 GLN A 162 0.184 -6.464 -5.516 1.00 0.00 N flip ATOM 0 H GLN A 162 -3.320 -4.133 -8.074 1.00 0.00 H new ATOM 0 HA GLN A 162 -4.061 -6.827 -7.532 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -1.775 -5.477 -7.258 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -2.411 -5.074 -5.675 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -2.859 -7.624 -5.373 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -1.870 -7.863 -6.801 1.00 0.00 H new ATOM 0 HE21 GLN A 162 0.160 -6.011 -6.430 1.00 0.00 H new ATOM 0 HE22 GLN A 162 1.022 -6.402 -4.938 1.00 0.00 H new ATOM 2219 N LEU A 163 -5.073 -4.500 -5.427 1.00 0.00 N ATOM 2220 CA LEU A 163 -5.984 -4.232 -4.319 1.00 0.00 C ATOM 2221 C LEU A 163 -7.385 -4.711 -4.661 1.00 0.00 C ATOM 2222 O LEU A 163 -8.097 -5.245 -3.810 1.00 0.00 O ATOM 2223 CB LEU A 163 -6.020 -2.732 -4.016 1.00 0.00 C ATOM 2224 CG LEU A 163 -4.585 -2.198 -3.852 1.00 0.00 C ATOM 2225 CD1 LEU A 163 -4.636 -0.697 -3.559 1.00 0.00 C ATOM 2226 CD2 LEU A 163 -3.866 -2.932 -2.702 1.00 0.00 C ATOM 0 H LEU A 163 -4.594 -3.677 -5.792 1.00 0.00 H new ATOM 0 HA LEU A 163 -5.625 -4.769 -3.441 1.00 0.00 H new ATOM 0 HB2 LEU A 163 -6.525 -2.201 -4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 163 -6.592 -2.549 -3.106 1.00 0.00 H new ATOM 0 HG LEU A 163 -4.031 -2.374 -4.774 1.00 0.00 H new ATOM 0 HD11 LEU A 163 -3.622 -0.314 -3.442 1.00 0.00 H new ATOM 0 HD12 LEU A 163 -5.125 -0.181 -4.385 1.00 0.00 H new ATOM 0 HD13 LEU A 163 -5.197 -0.524 -2.641 1.00 0.00 H new ATOM 0 HD21 LEU A 163 -2.853 -2.543 -2.599 1.00 0.00 H new ATOM 0 HD22 LEU A 163 -4.412 -2.774 -1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 163 -3.824 -3.999 -2.921 1.00 0.00 H new ATOM 2238 N LYS A 164 -7.770 -4.524 -5.912 1.00 0.00 N ATOM 2239 CA LYS A 164 -9.085 -4.944 -6.373 1.00 0.00 C ATOM 2240 C LYS A 164 -9.155 -6.450 -6.546 1.00 0.00 C ATOM 2241 O LYS A 164 -10.233 -7.025 -6.614 1.00 0.00 O ATOM 2242 CB LYS A 164 -9.411 -4.271 -7.702 1.00 0.00 C ATOM 2243 CG LYS A 164 -10.922 -4.362 -7.973 1.00 0.00 C ATOM 2244 CD LYS A 164 -11.256 -3.677 -9.301 1.00 0.00 C ATOM 2245 CE LYS A 164 -11.082 -2.148 -9.193 1.00 0.00 C ATOM 2246 NZ LYS A 164 -11.805 -1.493 -10.304 1.00 0.00 N ATOM 0 H LYS A 164 -7.192 -4.084 -6.628 1.00 0.00 H new ATOM 0 HA LYS A 164 -9.812 -4.647 -5.617 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -9.098 -3.227 -7.678 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -8.858 -4.751 -8.509 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -11.232 -5.406 -8.005 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -11.475 -3.890 -7.161 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -10.609 -4.066 -10.088 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -12.281 -3.911 -9.587 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -11.465 -1.794 -8.236 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -10.024 -1.888 -9.229 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -11.689 -0.462 -10.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -11.419 -1.823 -11.212 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -12.816 -1.732 -10.249 1.00 0.00 H new ATOM 2260 N VAL A 165 -7.997 -7.086 -6.620 1.00 0.00 N ATOM 2261 CA VAL A 165 -7.933 -8.543 -6.787 1.00 0.00 C ATOM 2262 C VAL A 165 -7.982 -9.250 -5.436 1.00 0.00 C ATOM 2263 O VAL A 165 -8.677 -10.247 -5.270 1.00 0.00 O ATOM 2264 CB VAL A 165 -6.639 -8.924 -7.544 1.00 0.00 C ATOM 2265 CG1 VAL A 165 -6.350 -10.439 -7.398 1.00 0.00 C ATOM 2266 CG2 VAL A 165 -6.789 -8.563 -9.039 1.00 0.00 C ATOM 0 H VAL A 165 -7.088 -6.626 -6.568 1.00 0.00 H new ATOM 0 HA VAL A 165 -8.798 -8.865 -7.367 1.00 0.00 H new ATOM 0 HB VAL A 165 -5.805 -8.368 -7.116 1.00 0.00 H new ATOM 0 HG11 VAL A 165 -5.436 -10.689 -7.937 1.00 0.00 H new ATOM 0 HG12 VAL A 165 -6.228 -10.686 -6.343 1.00 0.00 H new ATOM 0 HG13 VAL A 165 -7.182 -11.010 -7.811 1.00 0.00 H new ATOM 0 HG21 VAL A 165 -5.877 -8.832 -9.572 1.00 0.00 H new ATOM 0 HG22 VAL A 165 -7.631 -9.110 -9.463 1.00 0.00 H new ATOM 0 HG23 VAL A 165 -6.965 -7.492 -9.139 1.00 0.00 H new ATOM 2276 N VAL A 166 -7.196 -8.762 -4.487 1.00 0.00 N ATOM 2277 CA VAL A 166 -7.135 -9.387 -3.170 1.00 0.00 C ATOM 2278 C VAL A 166 -8.411 -9.115 -2.376 1.00 0.00 C ATOM 2279 O VAL A 166 -8.874 -9.962 -1.615 1.00 0.00 O ATOM 2280 CB VAL A 166 -5.928 -8.849 -2.398 1.00 0.00 C ATOM 2281 CG1 VAL A 166 -4.651 -9.090 -3.211 1.00 0.00 C ATOM 2282 CG2 VAL A 166 -6.107 -7.344 -2.152 1.00 0.00 C ATOM 0 H VAL A 166 -6.597 -7.944 -4.600 1.00 0.00 H new ATOM 0 HA VAL A 166 -7.035 -10.464 -3.307 1.00 0.00 H new ATOM 0 HB VAL A 166 -5.849 -9.365 -1.441 1.00 0.00 H new ATOM 0 HG11 VAL A 166 -3.792 -8.707 -2.661 1.00 0.00 H new ATOM 0 HG12 VAL A 166 -4.525 -10.159 -3.382 1.00 0.00 H new ATOM 0 HG13 VAL A 166 -4.727 -8.576 -4.169 1.00 0.00 H new ATOM 0 HG21 VAL A 166 -5.248 -6.960 -1.602 1.00 0.00 H new ATOM 0 HG22 VAL A 166 -6.187 -6.826 -3.108 1.00 0.00 H new ATOM 0 HG23 VAL A 166 -7.014 -7.176 -1.571 1.00 0.00 H new ATOM 2292 N LYS A 167 -8.964 -7.919 -2.565 1.00 0.00 N ATOM 2293 CA LYS A 167 -10.173 -7.538 -1.847 1.00 0.00 C ATOM 2294 C LYS A 167 -11.328 -8.469 -2.188 1.00 0.00 C ATOM 2295 O LYS A 167 -12.019 -8.966 -1.301 1.00 0.00 O ATOM 2296 CB LYS A 167 -10.558 -6.095 -2.204 1.00 0.00 C ATOM 2297 CG LYS A 167 -11.740 -5.646 -1.342 1.00 0.00 C ATOM 2298 CD LYS A 167 -12.058 -4.180 -1.631 1.00 0.00 C ATOM 2299 CE LYS A 167 -13.252 -3.742 -0.781 1.00 0.00 C ATOM 2300 NZ LYS A 167 -13.546 -2.306 -1.044 1.00 0.00 N ATOM 0 H LYS A 167 -8.600 -7.208 -3.199 1.00 0.00 H new ATOM 0 HA LYS A 167 -9.971 -7.613 -0.779 1.00 0.00 H new ATOM 0 HB2 LYS A 167 -9.708 -5.432 -2.045 1.00 0.00 H new ATOM 0 HB3 LYS A 167 -10.820 -6.029 -3.260 1.00 0.00 H new ATOM 0 HG2 LYS A 167 -12.612 -6.266 -1.551 1.00 0.00 H new ATOM 0 HG3 LYS A 167 -11.503 -5.776 -0.286 1.00 0.00 H new ATOM 0 HD2 LYS A 167 -11.191 -3.558 -1.408 1.00 0.00 H new ATOM 0 HD3 LYS A 167 -12.283 -4.047 -2.689 1.00 0.00 H new ATOM 0 HE2 LYS A 167 -14.124 -4.352 -1.017 1.00 0.00 H new ATOM 0 HE3 LYS A 167 -13.034 -3.892 0.276 1.00 0.00 H new ATOM 0 HZ1 LYS A 167 -14.358 -2.006 -0.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 167 -12.715 -1.731 -0.798 1.00 0.00 H new ATOM 0 HZ3 LYS A 167 -13.771 -2.176 -2.051 1.00 0.00 H new ATOM 2314 N GLU A 168 -11.536 -8.696 -3.479 1.00 0.00 N ATOM 2315 CA GLU A 168 -12.619 -9.567 -3.927 1.00 0.00 C ATOM 2316 C GLU A 168 -12.382 -10.994 -3.471 1.00 0.00 C ATOM 2317 O GLU A 168 -13.304 -11.805 -3.421 1.00 0.00 O ATOM 2318 CB GLU A 168 -12.738 -9.521 -5.452 1.00 0.00 C ATOM 2319 CG GLU A 168 -11.385 -9.851 -6.080 1.00 0.00 C ATOM 2320 CD GLU A 168 -11.476 -9.772 -7.597 1.00 0.00 C ATOM 2321 OE1 GLU A 168 -11.584 -8.668 -8.108 1.00 0.00 O ATOM 2322 OE2 GLU A 168 -11.431 -10.815 -8.229 1.00 0.00 O ATOM 0 H GLU A 168 -10.975 -8.294 -4.230 1.00 0.00 H new ATOM 0 HA GLU A 168 -13.550 -9.210 -3.486 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -13.491 -10.233 -5.790 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -13.068 -8.533 -5.772 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -10.628 -9.155 -5.717 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -11.070 -10.850 -5.779 1.00 0.00 H new ATOM 2329 N LYS A 169 -11.133 -11.312 -3.154 1.00 0.00 N ATOM 2330 CA LYS A 169 -10.779 -12.665 -2.715 1.00 0.00 C ATOM 2331 C LYS A 169 -11.173 -12.883 -1.270 1.00 0.00 C ATOM 2332 O LYS A 169 -11.087 -13.998 -0.764 1.00 0.00 O ATOM 2333 CB LYS A 169 -9.247 -12.901 -2.905 1.00 0.00 C ATOM 2334 CG LYS A 169 -8.979 -13.993 -3.956 1.00 0.00 C ATOM 2335 CD LYS A 169 -9.293 -13.447 -5.354 1.00 0.00 C ATOM 2336 CE LYS A 169 -9.047 -14.536 -6.385 1.00 0.00 C ATOM 2337 NZ LYS A 169 -10.048 -15.623 -6.197 1.00 0.00 N ATOM 0 H LYS A 169 -10.350 -10.660 -3.191 1.00 0.00 H new ATOM 0 HA LYS A 169 -11.327 -13.383 -3.325 1.00 0.00 H new ATOM 0 HB2 LYS A 169 -8.768 -11.971 -3.212 1.00 0.00 H new ATOM 0 HB3 LYS A 169 -8.800 -13.190 -1.954 1.00 0.00 H new ATOM 0 HG2 LYS A 169 -7.939 -14.314 -3.905 1.00 0.00 H new ATOM 0 HG3 LYS A 169 -9.594 -14.869 -3.750 1.00 0.00 H new ATOM 0 HD2 LYS A 169 -10.329 -13.112 -5.402 1.00 0.00 H new ATOM 0 HD3 LYS A 169 -8.668 -12.580 -5.567 1.00 0.00 H new ATOM 0 HE2 LYS A 169 -9.124 -14.125 -7.391 1.00 0.00 H new ATOM 0 HE3 LYS A 169 -8.037 -14.933 -6.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 169 -10.128 -16.176 -7.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 169 -9.743 -16.245 -5.421 1.00 0.00 H new ATOM 0 HZ3 LYS A 169 -10.972 -15.207 -5.964 1.00 0.00 H new ATOM 2351 N GLN A 170 -11.601 -11.825 -0.612 1.00 0.00 N ATOM 2352 CA GLN A 170 -12.004 -11.924 0.781 1.00 0.00 C ATOM 2353 C GLN A 170 -13.069 -13.011 0.949 1.00 0.00 C ATOM 2354 O GLN A 170 -13.431 -13.370 2.069 1.00 0.00 O ATOM 2355 CB GLN A 170 -12.562 -10.576 1.246 1.00 0.00 C ATOM 2356 CG GLN A 170 -13.827 -10.209 0.420 1.00 0.00 C ATOM 2357 CD GLN A 170 -15.058 -10.889 1.017 1.00 0.00 C ATOM 2358 OE1 GLN A 170 -15.547 -11.884 0.479 1.00 0.00 O ATOM 2359 NE2 GLN A 170 -15.577 -10.415 2.113 1.00 0.00 N ATOM 0 H GLN A 170 -11.680 -10.891 -1.014 1.00 0.00 H new ATOM 0 HA GLN A 170 -11.136 -12.188 1.385 1.00 0.00 H new ATOM 0 HB2 GLN A 170 -12.811 -10.623 2.306 1.00 0.00 H new ATOM 0 HB3 GLN A 170 -11.805 -9.801 1.130 1.00 0.00 H new ATOM 0 HG2 GLN A 170 -13.966 -9.128 0.414 1.00 0.00 H new ATOM 0 HG3 GLN A 170 -13.697 -10.520 -0.617 1.00 0.00 H new ATOM 0 HE21 GLN A 170 -15.170 -9.591 2.556 1.00 0.00 H new ATOM 0 HE22 GLN A 170 -16.391 -10.867 2.529 1.00 0.00 H new