USER MOD reduce.3.24.130724 H: found=0, std=0, add=827, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 827 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 128 MET CE :methyl -105:sc= -5.28! (180deg=-8.06!) USER MOD Set 1.2: A 149 LYS NZ :NH3+ -96:sc= 1.28 (180deg=-0.394) USER MOD Set 2.1: A 21 LYS NZ :NH3+ 177:sc= 0.453 (180deg=-0.0427) USER MOD Set 2.2: A 95 GLN : amide:sc= -2.16! C(o=-1.7!,f=-9.2!) USER MOD Set 3.1: A 16 HIS : no HD1:sc= -8.77! C(o=-20!,f=-20!) USER MOD Set 3.2: A 19 HIS : no HD1:sc= -7.63! C(o=-20!,f=-34!) USER MOD Set 3.3: A 93 MET CE :methyl -118:sc= -0.0312 (180deg=-0.363) USER MOD Set 3.4: A 96 THR OG1 : rot -165:sc= -3.16! USER MOD Single : A 12 THR OG1 : rot 23:sc= 0.137 USER MOD Single : A 14 MET CE :methyl -135:sc= 0 (180deg=-1.97!) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.562 USER MOD Single : A 23 THR OG1 : rot 180:sc= -1.68! USER MOD Single : A 101 ASN : amide:sc= -2.91! C(o=-2.9!,f=-3!) USER MOD Single : A 102 HIS : no HD1:sc= -0.334 X(o=-0.33,f=0) USER MOD Single : A 104 LYS NZ :NH3+ 143:sc= 0.742 (180deg=-0.891) USER MOD Single : A 107 ASN : amide:sc= -0.0499 X(o=-0.05,f=0) USER MOD Single : A 115 ASN : amide:sc= -3.31! C(o=-3.3!,f=-12!) USER MOD Single : A 116 LYS NZ :NH3+ 152:sc= 1.79 (180deg=0.749) USER MOD Single : A 117 MET CE :methyl -124:sc= -6.41! (180deg=-14.5!) USER MOD Single : A 119 LYS NZ :NH3+ -164:sc= 1.21 (180deg=0.855) USER MOD Single : A 123 ASN : amide:sc= -1.2 K(o=-1.2,f=-4.4!) USER MOD Single : A 129 GLN :FLIP amide:sc= -0.0226 F(o=-1.3!,f=-0.023) USER MOD Single : A 132 MET CE :methyl 146:sc= -0.501 (180deg=-2.49!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 135 ASN : amide:sc= -0.242 K(o=-0.24,f=-1) USER MOD Single : A 145 THR OG1 : rot -11:sc= 0.146 USER MOD Single : A 148 CYS SG : rot -130:sc= -0.698 USER MOD Single : A 151 SER OG : rot -118:sc= 0.139 USER MOD Single : A 153 LYS NZ :NH3+ -135:sc= 1.08 (180deg=0.146) USER MOD Single : A 154 THR OG1 : rot 166:sc= -1.4! USER MOD Single : A 155 LYS NZ :NH3+ 154:sc= -0.174 (180deg=-0.948) USER MOD Single : A 160 HIS : no HE2:sc= 1.07 K(o=1.1,f=-5!) USER MOD Single : A 164 MET CE :methyl 135:sc= -1.9! (180deg=-4.82!) USER MOD ----------------------------------------------------------------- ATOM 171 N THR A 12 -11.694 -3.953 -0.907 1.00 0.44 N ATOM 172 CA THR A 12 -11.340 -4.681 0.299 1.00 0.45 C ATOM 173 C THR A 12 -10.336 -3.884 1.127 1.00 0.41 C ATOM 174 O THR A 12 -9.307 -3.462 0.616 1.00 0.50 O ATOM 175 CB THR A 12 -10.749 -6.061 -0.041 1.00 0.54 C ATOM 176 OG1 THR A 12 -11.651 -6.778 -0.892 1.00 0.61 O ATOM 177 CG2 THR A 12 -10.491 -6.872 1.218 1.00 0.64 C ATOM 0 HA THR A 12 -12.251 -4.826 0.880 1.00 0.45 H new ATOM 0 HB THR A 12 -9.799 -5.906 -0.553 1.00 0.54 H new ATOM 0 HG1 THR A 12 -12.232 -6.144 -1.362 1.00 0.61 H new ATOM 0 HG21 THR A 12 -10.074 -7.842 0.947 1.00 0.64 H new ATOM 0 HG22 THR A 12 -9.786 -6.339 1.856 1.00 0.64 H new ATOM 0 HG23 THR A 12 -11.428 -7.018 1.755 1.00 0.64 H new ATOM 185 N ILE A 13 -10.654 -3.659 2.394 1.00 0.40 N ATOM 186 CA ILE A 13 -9.746 -2.962 3.292 1.00 0.40 C ATOM 187 C ILE A 13 -8.994 -3.966 4.154 1.00 0.37 C ATOM 188 O ILE A 13 -9.600 -4.840 4.774 1.00 0.52 O ATOM 189 CB ILE A 13 -10.487 -1.954 4.204 1.00 0.52 C ATOM 190 CG1 ILE A 13 -11.169 -0.868 3.360 1.00 1.15 C ATOM 191 CG2 ILE A 13 -9.525 -1.322 5.203 1.00 1.26 C ATOM 192 CD1 ILE A 13 -11.914 0.164 4.181 1.00 1.30 C ATOM 0 H ILE A 13 -11.533 -3.949 2.822 1.00 0.40 H new ATOM 0 HA ILE A 13 -9.046 -2.401 2.673 1.00 0.40 H new ATOM 0 HB ILE A 13 -11.252 -2.496 4.760 1.00 0.52 H new ATOM 0 HG12 ILE A 13 -10.415 -0.363 2.756 1.00 1.15 H new ATOM 0 HG13 ILE A 13 -11.866 -1.342 2.669 1.00 1.15 H new ATOM 0 HG21 ILE A 13 -10.067 -0.617 5.834 1.00 1.26 H new ATOM 0 HG22 ILE A 13 -9.083 -2.100 5.825 1.00 1.26 H new ATOM 0 HG23 ILE A 13 -8.736 -0.796 4.666 1.00 1.26 H new ATOM 0 HD11 ILE A 13 -12.369 0.898 3.516 1.00 1.30 H new ATOM 0 HD12 ILE A 13 -12.692 -0.328 4.765 1.00 1.30 H new ATOM 0 HD13 ILE A 13 -11.218 0.666 4.853 1.00 1.30 H new ATOM 204 N MET A 14 -7.680 -3.852 4.163 1.00 0.26 N ATOM 205 CA MET A 14 -6.826 -4.728 4.927 1.00 0.28 C ATOM 206 C MET A 14 -5.778 -3.901 5.662 1.00 0.24 C ATOM 207 O MET A 14 -5.588 -2.727 5.352 1.00 0.29 O ATOM 208 CB MET A 14 -6.142 -5.711 3.986 1.00 0.36 C ATOM 209 CG MET A 14 -7.074 -6.768 3.411 1.00 0.49 C ATOM 210 SD MET A 14 -6.240 -7.872 2.256 1.00 0.79 S ATOM 211 CE MET A 14 -7.561 -9.006 1.850 1.00 0.69 C ATOM 0 H MET A 14 -7.175 -3.141 3.634 1.00 0.26 H new ATOM 0 HA MET A 14 -7.422 -5.280 5.654 1.00 0.28 H new ATOM 0 HB2 MET A 14 -5.688 -5.156 3.165 1.00 0.36 H new ATOM 0 HB3 MET A 14 -5.333 -6.207 4.521 1.00 0.36 H new ATOM 0 HG2 MET A 14 -7.499 -7.354 4.226 1.00 0.49 H new ATOM 0 HG3 MET A 14 -7.905 -6.278 2.904 1.00 0.49 H new ATOM 0 HE1 MET A 14 -7.184 -10.028 1.878 1.00 0.69 H new ATOM 0 HE2 MET A 14 -8.369 -8.897 2.573 1.00 0.69 H new ATOM 0 HE3 MET A 14 -7.936 -8.785 0.851 1.00 0.69 H new ATOM 221 N GLY A 15 -5.111 -4.503 6.631 1.00 0.27 N ATOM 222 CA GLY A 15 -4.074 -3.808 7.347 1.00 0.27 C ATOM 223 C GLY A 15 -3.799 -4.440 8.685 1.00 0.24 C ATOM 224 O GLY A 15 -4.366 -5.483 9.008 1.00 0.31 O ATOM 0 H GLY A 15 -5.272 -5.464 6.933 1.00 0.27 H new ATOM 0 HA2 GLY A 15 -3.161 -3.805 6.752 1.00 0.27 H new ATOM 0 HA3 GLY A 15 -4.365 -2.767 7.489 1.00 0.27 H new ATOM 228 N HIS A 16 -2.928 -3.817 9.460 1.00 0.20 N ATOM 229 CA HIS A 16 -2.580 -4.348 10.771 1.00 0.17 C ATOM 230 C HIS A 16 -3.527 -3.843 11.851 1.00 0.19 C ATOM 231 O HIS A 16 -4.205 -2.826 11.698 1.00 0.22 O ATOM 232 CB HIS A 16 -1.140 -3.977 11.145 1.00 0.17 C ATOM 233 CG HIS A 16 -0.621 -4.676 12.372 1.00 0.16 C ATOM 234 ND1 HIS A 16 -0.725 -6.038 12.527 1.00 0.16 N ATOM 235 CD2 HIS A 16 -0.020 -4.154 13.466 1.00 0.19 C ATOM 236 CE1 HIS A 16 -0.191 -6.307 13.707 1.00 0.19 C ATOM 237 NE2 HIS A 16 0.249 -5.199 14.309 1.00 0.22 N ATOM 0 H HIS A 16 -2.451 -2.951 9.209 1.00 0.20 H new ATOM 0 HA HIS A 16 -2.670 -5.432 10.709 1.00 0.17 H new ATOM 0 HB2 HIS A 16 -0.487 -4.210 10.304 1.00 0.17 H new ATOM 0 HB3 HIS A 16 -1.084 -2.900 11.303 1.00 0.17 H new ATOM 0 HD2 HIS A 16 0.205 -3.112 13.641 1.00 0.19 H new ATOM 0 HE1 HIS A 16 -0.120 -7.298 14.130 1.00 0.19 H new ATOM 0 HE2 HIS A 16 0.699 -5.142 15.222 1.00 0.22 H new ATOM 245 N VAL A 17 -3.568 -4.594 12.935 1.00 0.20 N ATOM 246 CA VAL A 17 -4.270 -4.208 14.139 1.00 0.25 C ATOM 247 C VAL A 17 -3.537 -3.048 14.801 1.00 0.26 C ATOM 248 O VAL A 17 -2.341 -2.881 14.588 1.00 0.25 O ATOM 249 CB VAL A 17 -4.348 -5.416 15.090 1.00 0.29 C ATOM 250 CG1 VAL A 17 -2.957 -5.932 15.417 1.00 0.30 C ATOM 251 CG2 VAL A 17 -5.084 -5.099 16.362 1.00 0.36 C ATOM 0 H VAL A 17 -3.107 -5.502 13.003 1.00 0.20 H new ATOM 0 HA VAL A 17 -5.283 -3.887 13.896 1.00 0.25 H new ATOM 0 HB VAL A 17 -4.910 -6.190 14.567 1.00 0.29 H new ATOM 0 HG11 VAL A 17 -3.035 -6.786 16.090 1.00 0.30 H new ATOM 0 HG12 VAL A 17 -2.457 -6.239 14.498 1.00 0.30 H new ATOM 0 HG13 VAL A 17 -2.380 -5.142 15.898 1.00 0.30 H new ATOM 0 HG21 VAL A 17 -5.111 -5.984 16.997 1.00 0.36 H new ATOM 0 HG22 VAL A 17 -4.573 -4.291 16.886 1.00 0.36 H new ATOM 0 HG23 VAL A 17 -6.103 -4.791 16.126 1.00 0.36 H new ATOM 261 N ASP A 18 -4.266 -2.232 15.555 1.00 0.31 N ATOM 262 CA ASP A 18 -3.711 -1.029 16.181 1.00 0.36 C ATOM 263 C ASP A 18 -3.485 0.068 15.139 1.00 0.34 C ATOM 264 O ASP A 18 -3.436 1.255 15.462 1.00 0.41 O ATOM 265 CB ASP A 18 -2.418 -1.361 16.933 1.00 0.42 C ATOM 266 CG ASP A 18 -1.697 -0.129 17.439 1.00 0.55 C ATOM 267 OD1 ASP A 18 -2.110 0.418 18.483 1.00 0.69 O ATOM 268 OD2 ASP A 18 -0.722 0.303 16.790 1.00 0.59 O ATOM 0 H ASP A 18 -5.256 -2.382 15.751 1.00 0.31 H new ATOM 0 HA ASP A 18 -4.431 -0.652 16.907 1.00 0.36 H new ATOM 0 HB2 ASP A 18 -2.651 -2.011 17.776 1.00 0.42 H new ATOM 0 HB3 ASP A 18 -1.753 -1.919 16.274 1.00 0.42 H new ATOM 273 N HIS A 19 -3.371 -0.335 13.879 1.00 0.29 N ATOM 274 CA HIS A 19 -3.342 0.611 12.777 1.00 0.32 C ATOM 275 C HIS A 19 -4.778 0.937 12.395 1.00 0.43 C ATOM 276 O HIS A 19 -5.045 1.649 11.432 1.00 0.63 O ATOM 277 CB HIS A 19 -2.589 0.051 11.563 1.00 0.29 C ATOM 278 CG HIS A 19 -1.210 -0.445 11.861 1.00 0.22 C ATOM 279 ND1 HIS A 19 -0.360 -0.828 10.856 1.00 0.27 N ATOM 280 CD2 HIS A 19 -0.588 -0.603 13.051 1.00 0.21 C ATOM 281 CE1 HIS A 19 0.752 -1.210 11.452 1.00 0.26 C ATOM 282 NE2 HIS A 19 0.659 -1.095 12.779 1.00 0.24 N ATOM 0 H HIS A 19 -3.297 -1.313 13.598 1.00 0.29 H new ATOM 0 HA HIS A 19 -2.812 1.509 13.095 1.00 0.32 H new ATOM 0 HB2 HIS A 19 -3.171 -0.766 11.136 1.00 0.29 H new ATOM 0 HB3 HIS A 19 -2.525 0.828 10.801 1.00 0.29 H new ATOM 0 HD2 HIS A 19 -0.996 -0.383 14.026 1.00 0.21 H new ATOM 0 HE1 HIS A 19 1.628 -1.570 10.933 1.00 0.26 H new ATOM 0 HE2 HIS A 19 1.381 -1.330 13.460 1.00 0.24 H new ATOM 290 N GLY A 20 -5.700 0.373 13.165 1.00 0.42 N ATOM 291 CA GLY A 20 -7.098 0.695 13.020 1.00 0.54 C ATOM 292 C GLY A 20 -7.807 -0.144 11.985 1.00 0.57 C ATOM 293 O GLY A 20 -8.400 0.395 11.057 1.00 0.79 O ATOM 0 H GLY A 20 -5.496 -0.310 13.895 1.00 0.42 H new ATOM 0 HA2 GLY A 20 -7.594 0.566 13.982 1.00 0.54 H new ATOM 0 HA3 GLY A 20 -7.194 1.747 12.751 1.00 0.54 H new ATOM 297 N LYS A 21 -7.796 -1.460 12.153 1.00 0.61 N ATOM 298 CA LYS A 21 -8.475 -2.324 11.203 1.00 0.95 C ATOM 299 C LYS A 21 -9.964 -2.419 11.546 1.00 0.89 C ATOM 300 O LYS A 21 -10.728 -3.144 10.911 1.00 1.05 O ATOM 301 CB LYS A 21 -7.801 -3.701 11.155 1.00 1.36 C ATOM 302 CG LYS A 21 -7.809 -4.473 12.468 1.00 1.79 C ATOM 303 CD LYS A 21 -9.061 -5.327 12.617 1.00 2.30 C ATOM 304 CE LYS A 21 -9.200 -6.343 11.484 1.00 2.66 C ATOM 305 NZ LYS A 21 -8.070 -7.313 11.438 1.00 3.31 N ATOM 0 H LYS A 21 -7.333 -1.943 12.923 1.00 0.61 H new ATOM 0 HA LYS A 21 -8.397 -1.894 10.205 1.00 0.95 H new ATOM 0 HB2 LYS A 21 -8.297 -4.304 10.394 1.00 1.36 H new ATOM 0 HB3 LYS A 21 -6.767 -3.571 10.835 1.00 1.36 H new ATOM 0 HG2 LYS A 21 -6.926 -5.111 12.520 1.00 1.79 H new ATOM 0 HG3 LYS A 21 -7.746 -3.773 13.301 1.00 1.79 H new ATOM 0 HD2 LYS A 21 -9.031 -5.851 13.572 1.00 2.30 H new ATOM 0 HD3 LYS A 21 -9.940 -4.682 12.635 1.00 2.30 H new ATOM 0 HE2 LYS A 21 -10.136 -6.888 11.603 1.00 2.66 H new ATOM 0 HE3 LYS A 21 -9.258 -5.814 10.533 1.00 2.66 H new ATOM 0 HZ1 LYS A 21 -8.240 -8.009 10.684 1.00 3.31 H new ATOM 0 HZ2 LYS A 21 -7.183 -6.804 11.246 1.00 3.31 H new ATOM 0 HZ3 LYS A 21 -7.996 -7.804 12.352 1.00 3.31 H new ATOM 319 N THR A 22 -10.358 -1.673 12.570 1.00 0.84 N ATOM 320 CA THR A 22 -11.753 -1.561 12.967 1.00 0.87 C ATOM 321 C THR A 22 -12.083 -0.100 13.279 1.00 0.79 C ATOM 322 O THR A 22 -13.110 0.431 12.849 1.00 0.79 O ATOM 323 CB THR A 22 -12.053 -2.442 14.192 1.00 1.02 C ATOM 324 OG1 THR A 22 -11.658 -3.794 13.919 1.00 1.21 O ATOM 325 CG2 THR A 22 -13.534 -2.410 14.549 1.00 1.18 C ATOM 0 H THR A 22 -9.718 -1.129 13.148 1.00 0.84 H new ATOM 0 HA THR A 22 -12.375 -1.907 12.142 1.00 0.87 H new ATOM 0 HB THR A 22 -11.489 -2.050 15.038 1.00 1.02 H new ATOM 0 HG1 THR A 22 -11.848 -4.354 14.700 1.00 1.21 H new ATOM 0 HG21 THR A 22 -13.712 -3.043 15.419 1.00 1.18 H new ATOM 0 HG22 THR A 22 -13.831 -1.387 14.778 1.00 1.18 H new ATOM 0 HG23 THR A 22 -14.119 -2.778 13.706 1.00 1.18 H new ATOM 333 N THR A 23 -11.185 0.551 14.016 1.00 0.75 N ATOM 334 CA THR A 23 -11.312 1.967 14.328 1.00 0.75 C ATOM 335 C THR A 23 -11.441 2.820 13.071 1.00 0.67 C ATOM 336 O THR A 23 -12.078 3.870 13.097 1.00 0.66 O ATOM 337 CB THR A 23 -10.111 2.444 15.148 1.00 0.82 C ATOM 338 OG1 THR A 23 -9.111 1.418 15.166 1.00 1.25 O ATOM 339 CG2 THR A 23 -10.522 2.789 16.571 1.00 1.17 C ATOM 0 H THR A 23 -10.354 0.111 14.411 1.00 0.75 H new ATOM 0 HA THR A 23 -12.225 2.085 14.911 1.00 0.75 H new ATOM 0 HB THR A 23 -9.709 3.345 14.684 1.00 0.82 H new ATOM 0 HG1 THR A 23 -8.340 1.722 15.689 1.00 1.25 H new ATOM 0 HG21 THR A 23 -9.649 3.125 17.131 1.00 1.17 H new ATOM 0 HG22 THR A 23 -11.268 3.583 16.552 1.00 1.17 H new ATOM 0 HG23 THR A 23 -10.944 1.906 17.052 1.00 1.17 H new ATOM 347 N LEU A 24 -10.856 2.369 11.963 1.00 0.65 N ATOM 348 CA LEU A 24 -10.982 3.095 10.705 1.00 0.63 C ATOM 349 C LEU A 24 -12.414 3.028 10.227 1.00 0.64 C ATOM 350 O LEU A 24 -12.979 4.014 9.788 1.00 0.65 O ATOM 351 CB LEU A 24 -10.096 2.499 9.641 1.00 0.67 C ATOM 352 CG LEU A 24 -9.831 3.401 8.433 1.00 0.84 C ATOM 353 CD1 LEU A 24 -8.993 4.604 8.840 1.00 1.49 C ATOM 354 CD2 LEU A 24 -9.150 2.624 7.320 1.00 1.30 C ATOM 0 H LEU A 24 -10.298 1.517 11.912 1.00 0.65 H new ATOM 0 HA LEU A 24 -10.681 4.128 10.880 1.00 0.63 H new ATOM 0 HB2 LEU A 24 -9.140 2.234 10.093 1.00 0.67 H new ATOM 0 HB3 LEU A 24 -10.550 1.572 9.290 1.00 0.67 H new ATOM 0 HG LEU A 24 -10.789 3.761 8.058 1.00 0.84 H new ATOM 0 HD11 LEU A 24 -8.814 5.234 7.969 1.00 1.49 H new ATOM 0 HD12 LEU A 24 -9.524 5.177 9.600 1.00 1.49 H new ATOM 0 HD13 LEU A 24 -8.039 4.263 9.243 1.00 1.49 H new ATOM 0 HD21 LEU A 24 -8.971 3.285 6.472 1.00 1.30 H new ATOM 0 HD22 LEU A 24 -8.199 2.230 7.680 1.00 1.30 H new ATOM 0 HD23 LEU A 24 -9.790 1.798 7.008 1.00 1.30 H new ATOM 366 N LEU A 25 -12.995 1.846 10.353 1.00 0.68 N ATOM 367 CA LEU A 25 -14.369 1.598 9.935 1.00 0.75 C ATOM 368 C LEU A 25 -15.349 2.355 10.835 1.00 0.74 C ATOM 369 O LEU A 25 -16.541 2.452 10.538 1.00 0.82 O ATOM 370 CB LEU A 25 -14.654 0.093 9.988 1.00 0.85 C ATOM 371 CG LEU A 25 -15.232 -0.518 8.711 1.00 0.92 C ATOM 372 CD1 LEU A 25 -16.650 -0.029 8.473 1.00 1.63 C ATOM 373 CD2 LEU A 25 -14.345 -0.186 7.519 1.00 1.69 C ATOM 0 H LEU A 25 -12.529 1.029 10.748 1.00 0.68 H new ATOM 0 HA LEU A 25 -14.500 1.954 8.913 1.00 0.75 H new ATOM 0 HB2 LEU A 25 -13.726 -0.426 10.229 1.00 0.85 H new ATOM 0 HB3 LEU A 25 -15.348 -0.098 10.807 1.00 0.85 H new ATOM 0 HG LEU A 25 -15.263 -1.601 8.831 1.00 0.92 H new ATOM 0 HD11 LEU A 25 -17.041 -0.477 7.559 1.00 1.63 H new ATOM 0 HD12 LEU A 25 -17.280 -0.315 9.315 1.00 1.63 H new ATOM 0 HD13 LEU A 25 -16.649 1.056 8.373 1.00 1.63 H new ATOM 0 HD21 LEU A 25 -14.768 -0.627 6.617 1.00 1.69 H new ATOM 0 HD22 LEU A 25 -14.285 0.896 7.400 1.00 1.69 H new ATOM 0 HD23 LEU A 25 -13.346 -0.589 7.686 1.00 1.69 H new ATOM 385 N ASP A 26 -14.839 2.885 11.940 1.00 0.71 N ATOM 386 CA ASP A 26 -15.648 3.685 12.850 1.00 0.75 C ATOM 387 C ASP A 26 -15.419 5.154 12.574 1.00 0.70 C ATOM 388 O ASP A 26 -16.337 5.972 12.603 1.00 0.76 O ATOM 389 CB ASP A 26 -15.274 3.392 14.285 1.00 0.81 C ATOM 390 CG ASP A 26 -16.262 3.984 15.265 1.00 1.01 C ATOM 391 OD1 ASP A 26 -16.096 5.162 15.653 1.00 1.23 O ATOM 392 OD2 ASP A 26 -17.219 3.278 15.645 1.00 1.13 O ATOM 0 H ASP A 26 -13.867 2.775 12.228 1.00 0.71 H new ATOM 0 HA ASP A 26 -16.697 3.434 12.694 1.00 0.75 H new ATOM 0 HB2 ASP A 26 -15.221 2.313 14.432 1.00 0.81 H new ATOM 0 HB3 ASP A 26 -14.280 3.790 14.488 1.00 0.81 H new ATOM 397 N ALA A 27 -14.171 5.466 12.295 1.00 0.63 N ATOM 398 CA ALA A 27 -13.753 6.828 12.007 1.00 0.61 C ATOM 399 C ALA A 27 -14.246 7.260 10.636 1.00 0.58 C ATOM 400 O ALA A 27 -14.589 8.423 10.413 1.00 0.62 O ATOM 401 CB ALA A 27 -12.243 6.901 12.069 1.00 0.61 C ATOM 0 H ALA A 27 -13.414 4.783 12.261 1.00 0.63 H new ATOM 0 HA ALA A 27 -14.184 7.503 12.747 1.00 0.61 H new ATOM 0 HB1 ALA A 27 -11.919 7.919 11.854 1.00 0.61 H new ATOM 0 HB2 ALA A 27 -11.906 6.615 13.065 1.00 0.61 H new ATOM 0 HB3 ALA A 27 -11.815 6.221 11.332 1.00 0.61 H new ATOM 407 N ILE A 28 -14.292 6.298 9.735 1.00 0.56 N ATOM 408 CA ILE A 28 -14.702 6.523 8.361 1.00 0.57 C ATOM 409 C ILE A 28 -16.197 6.831 8.295 1.00 0.64 C ATOM 410 O ILE A 28 -16.682 7.397 7.322 1.00 0.71 O ATOM 411 CB ILE A 28 -14.356 5.281 7.505 1.00 0.61 C ATOM 412 CG1 ILE A 28 -14.194 5.640 6.035 1.00 0.84 C ATOM 413 CG2 ILE A 28 -15.407 4.187 7.662 1.00 1.02 C ATOM 414 CD1 ILE A 28 -13.475 4.557 5.263 1.00 0.85 C ATOM 0 H ILE A 28 -14.044 5.330 9.937 1.00 0.56 H new ATOM 0 HA ILE A 28 -14.164 7.383 7.962 1.00 0.57 H new ATOM 0 HB ILE A 28 -13.402 4.901 7.872 1.00 0.61 H new ATOM 0 HG12 ILE A 28 -15.176 5.809 5.593 1.00 0.84 H new ATOM 0 HG13 ILE A 28 -13.640 6.575 5.949 1.00 0.84 H new ATOM 0 HG21 ILE A 28 -15.134 3.329 7.048 1.00 1.02 H new ATOM 0 HG22 ILE A 28 -15.462 3.882 8.707 1.00 1.02 H new ATOM 0 HG23 ILE A 28 -16.378 4.567 7.344 1.00 1.02 H new ATOM 0 HD11 ILE A 28 -13.382 4.855 4.219 1.00 0.85 H new ATOM 0 HD12 ILE A 28 -12.482 4.406 5.687 1.00 0.85 H new ATOM 0 HD13 ILE A 28 -14.042 3.628 5.326 1.00 0.85 H new ATOM 1221 N ILE A 81 -9.464 -4.291 -6.106 1.00 0.63 N ATOM 1222 CA ILE A 81 -8.618 -3.315 -5.432 1.00 0.42 C ATOM 1223 C ILE A 81 -8.626 -3.545 -3.924 1.00 0.38 C ATOM 1224 O ILE A 81 -9.688 -3.733 -3.320 1.00 0.57 O ATOM 1225 CB ILE A 81 -9.091 -1.871 -5.726 1.00 0.42 C ATOM 1226 CG1 ILE A 81 -9.089 -1.606 -7.234 1.00 0.56 C ATOM 1227 CG2 ILE A 81 -8.211 -0.855 -5.004 1.00 0.50 C ATOM 1228 CD1 ILE A 81 -9.653 -0.256 -7.616 1.00 0.71 C ATOM 0 HA ILE A 81 -7.605 -3.443 -5.814 1.00 0.42 H new ATOM 0 HB ILE A 81 -10.110 -1.763 -5.355 1.00 0.42 H new ATOM 0 HG12 ILE A 81 -8.067 -1.681 -7.605 1.00 0.56 H new ATOM 0 HG13 ILE A 81 -9.667 -2.385 -7.731 1.00 0.56 H new ATOM 0 HG21 ILE A 81 -8.562 0.153 -5.225 1.00 0.50 H new ATOM 0 HG22 ILE A 81 -8.261 -1.029 -3.929 1.00 0.50 H new ATOM 0 HG23 ILE A 81 -7.180 -0.962 -5.341 1.00 0.50 H new ATOM 0 HD11 ILE A 81 -9.619 -0.141 -8.699 1.00 0.71 H new ATOM 0 HD12 ILE A 81 -10.686 -0.184 -7.276 1.00 0.71 H new ATOM 0 HD13 ILE A 81 -9.061 0.531 -7.148 1.00 0.71 H new ATOM 1240 N VAL A 82 -7.445 -3.539 -3.318 1.00 0.27 N ATOM 1241 CA VAL A 82 -7.333 -3.706 -1.878 1.00 0.28 C ATOM 1242 C VAL A 82 -6.649 -2.518 -1.233 1.00 0.23 C ATOM 1243 O VAL A 82 -5.556 -2.114 -1.629 1.00 0.26 O ATOM 1244 CB VAL A 82 -6.591 -5.005 -1.498 1.00 0.35 C ATOM 1245 CG1 VAL A 82 -6.134 -4.981 -0.040 1.00 1.02 C ATOM 1246 CG2 VAL A 82 -7.502 -6.190 -1.732 1.00 1.17 C ATOM 0 H VAL A 82 -6.555 -3.421 -3.801 1.00 0.27 H new ATOM 0 HA VAL A 82 -8.352 -3.774 -1.498 1.00 0.28 H new ATOM 0 HB VAL A 82 -5.703 -5.089 -2.125 1.00 0.35 H new ATOM 0 HG11 VAL A 82 -5.615 -5.911 0.194 1.00 1.02 H new ATOM 0 HG12 VAL A 82 -5.459 -4.140 0.116 1.00 1.02 H new ATOM 0 HG13 VAL A 82 -7.001 -4.876 0.612 1.00 1.02 H new ATOM 0 HG21 VAL A 82 -6.980 -7.109 -1.464 1.00 1.17 H new ATOM 0 HG22 VAL A 82 -8.396 -6.088 -1.117 1.00 1.17 H new ATOM 0 HG23 VAL A 82 -7.787 -6.228 -2.783 1.00 1.17 H new ATOM 1256 N ILE A 83 -7.321 -1.955 -0.252 1.00 0.22 N ATOM 1257 CA ILE A 83 -6.747 -0.920 0.572 1.00 0.19 C ATOM 1258 C ILE A 83 -5.947 -1.543 1.681 1.00 0.19 C ATOM 1259 O ILE A 83 -6.406 -2.460 2.350 1.00 0.24 O ATOM 1260 CB ILE A 83 -7.816 0.012 1.164 1.00 0.22 C ATOM 1261 CG1 ILE A 83 -8.407 0.832 0.035 1.00 0.27 C ATOM 1262 CG2 ILE A 83 -7.226 0.915 2.248 1.00 0.24 C ATOM 1263 CD1 ILE A 83 -9.362 1.920 0.483 1.00 0.37 C ATOM 0 H ILE A 83 -8.279 -2.203 -0.006 1.00 0.22 H new ATOM 0 HA ILE A 83 -6.101 -0.314 -0.063 1.00 0.19 H new ATOM 0 HB ILE A 83 -8.597 -0.581 1.640 1.00 0.22 H new ATOM 0 HG12 ILE A 83 -7.594 1.289 -0.529 1.00 0.27 H new ATOM 0 HG13 ILE A 83 -8.932 0.163 -0.647 1.00 0.27 H new ATOM 0 HG21 ILE A 83 -8.007 1.562 2.647 1.00 0.24 H new ATOM 0 HG22 ILE A 83 -6.818 0.301 3.051 1.00 0.24 H new ATOM 0 HG23 ILE A 83 -6.432 1.526 1.820 1.00 0.24 H new ATOM 0 HD11 ILE A 83 -9.737 2.457 -0.389 1.00 0.37 H new ATOM 0 HD12 ILE A 83 -10.198 1.472 1.021 1.00 0.37 H new ATOM 0 HD13 ILE A 83 -8.839 2.615 1.140 1.00 0.37 H new ATOM 1275 N LEU A 84 -4.751 -1.049 1.867 1.00 0.19 N ATOM 1276 CA LEU A 84 -3.885 -1.569 2.889 1.00 0.23 C ATOM 1277 C LEU A 84 -3.539 -0.442 3.857 1.00 0.24 C ATOM 1278 O LEU A 84 -2.845 0.511 3.502 1.00 0.31 O ATOM 1279 CB LEU A 84 -2.652 -2.222 2.239 1.00 0.39 C ATOM 1280 CG LEU A 84 -1.533 -2.699 3.172 1.00 0.31 C ATOM 1281 CD1 LEU A 84 -0.635 -1.535 3.514 1.00 0.91 C ATOM 1282 CD2 LEU A 84 -2.085 -3.348 4.438 1.00 1.01 C ATOM 0 H LEU A 84 -4.354 -0.284 1.321 1.00 0.19 H new ATOM 0 HA LEU A 84 -4.377 -2.352 3.466 1.00 0.23 H new ATOM 0 HB2 LEU A 84 -2.992 -3.078 1.656 1.00 0.39 H new ATOM 0 HB3 LEU A 84 -2.223 -1.507 1.536 1.00 0.39 H new ATOM 0 HG LEU A 84 -0.955 -3.463 2.652 1.00 0.31 H new ATOM 0 HD11 LEU A 84 0.161 -1.872 4.177 1.00 0.91 H new ATOM 0 HD12 LEU A 84 -0.199 -1.131 2.600 1.00 0.91 H new ATOM 0 HD13 LEU A 84 -1.218 -0.760 4.012 1.00 0.91 H new ATOM 0 HD21 LEU A 84 -1.259 -3.672 5.071 1.00 1.01 H new ATOM 0 HD22 LEU A 84 -2.696 -2.626 4.980 1.00 1.01 H new ATOM 0 HD23 LEU A 84 -2.695 -4.210 4.169 1.00 1.01 H new ATOM 1294 N VAL A 85 -4.074 -0.537 5.056 1.00 0.21 N ATOM 1295 CA VAL A 85 -3.875 0.463 6.077 1.00 0.27 C ATOM 1296 C VAL A 85 -2.691 0.105 6.956 1.00 0.25 C ATOM 1297 O VAL A 85 -2.729 -0.878 7.700 1.00 0.29 O ATOM 1298 CB VAL A 85 -5.135 0.598 6.948 1.00 0.34 C ATOM 1299 CG1 VAL A 85 -4.942 1.663 8.005 1.00 0.43 C ATOM 1300 CG2 VAL A 85 -6.346 0.907 6.081 1.00 0.40 C ATOM 0 H VAL A 85 -4.663 -1.317 5.349 1.00 0.21 H new ATOM 0 HA VAL A 85 -3.675 1.413 5.582 1.00 0.27 H new ATOM 0 HB VAL A 85 -5.310 -0.351 7.455 1.00 0.34 H new ATOM 0 HG11 VAL A 85 -5.845 1.743 8.610 1.00 0.43 H new ATOM 0 HG12 VAL A 85 -4.100 1.394 8.643 1.00 0.43 H new ATOM 0 HG13 VAL A 85 -4.742 2.621 7.524 1.00 0.43 H new ATOM 0 HG21 VAL A 85 -7.231 1.000 6.711 1.00 0.40 H new ATOM 0 HG22 VAL A 85 -6.182 1.843 5.546 1.00 0.40 H new ATOM 0 HG23 VAL A 85 -6.495 0.100 5.363 1.00 0.40 H new ATOM 1310 N VAL A 86 -1.630 0.885 6.845 1.00 0.22 N ATOM 1311 CA VAL A 86 -0.463 0.708 7.678 1.00 0.20 C ATOM 1312 C VAL A 86 -0.172 1.960 8.479 1.00 0.17 C ATOM 1313 O VAL A 86 -0.126 3.064 7.941 1.00 0.22 O ATOM 1314 CB VAL A 86 0.784 0.347 6.853 1.00 0.23 C ATOM 1315 CG1 VAL A 86 0.782 -1.131 6.511 1.00 0.49 C ATOM 1316 CG2 VAL A 86 0.867 1.192 5.589 1.00 0.64 C ATOM 0 H VAL A 86 -1.557 1.653 6.178 1.00 0.22 H new ATOM 0 HA VAL A 86 -0.688 -0.118 8.353 1.00 0.20 H new ATOM 0 HB VAL A 86 1.665 0.562 7.457 1.00 0.23 H new ATOM 0 HG11 VAL A 86 1.671 -1.371 5.927 1.00 0.49 H new ATOM 0 HG12 VAL A 86 0.783 -1.717 7.430 1.00 0.49 H new ATOM 0 HG13 VAL A 86 -0.109 -1.369 5.930 1.00 0.49 H new ATOM 0 HG21 VAL A 86 1.758 0.916 5.025 1.00 0.64 H new ATOM 0 HG22 VAL A 86 -0.018 1.019 4.977 1.00 0.64 H new ATOM 0 HG23 VAL A 86 0.921 2.247 5.859 1.00 0.64 H new ATOM 1326 N ALA A 87 0.001 1.784 9.770 1.00 0.17 N ATOM 1327 CA ALA A 87 0.408 2.870 10.635 1.00 0.18 C ATOM 1328 C ALA A 87 1.817 3.313 10.287 1.00 0.16 C ATOM 1329 O ALA A 87 2.694 2.476 10.090 1.00 0.24 O ATOM 1330 CB ALA A 87 0.347 2.418 12.079 1.00 0.28 C ATOM 0 H ALA A 87 -0.135 0.893 10.247 1.00 0.17 H new ATOM 0 HA ALA A 87 -0.268 3.713 10.494 1.00 0.18 H new ATOM 0 HB1 ALA A 87 0.654 3.237 12.730 1.00 0.28 H new ATOM 0 HB2 ALA A 87 -0.673 2.122 12.325 1.00 0.28 H new ATOM 0 HB3 ALA A 87 1.016 1.570 12.223 1.00 0.28 H new ATOM 1336 N ALA A 88 2.054 4.615 10.219 1.00 0.12 N ATOM 1337 CA ALA A 88 3.376 5.109 9.862 1.00 0.14 C ATOM 1338 C ALA A 88 4.301 5.024 11.050 1.00 0.16 C ATOM 1339 O ALA A 88 5.504 5.256 10.937 1.00 0.22 O ATOM 1340 CB ALA A 88 3.314 6.541 9.364 1.00 0.17 C ATOM 0 H ALA A 88 1.360 5.339 10.403 1.00 0.12 H new ATOM 0 HA ALA A 88 3.760 4.483 9.057 1.00 0.14 H new ATOM 0 HB1 ALA A 88 4.317 6.880 9.106 1.00 0.17 H new ATOM 0 HB2 ALA A 88 2.675 6.592 8.482 1.00 0.17 H new ATOM 0 HB3 ALA A 88 2.905 7.181 10.146 1.00 0.17 H new ATOM 1346 N ASP A 89 3.731 4.695 12.187 1.00 0.16 N ATOM 1347 CA ASP A 89 4.500 4.630 13.421 1.00 0.21 C ATOM 1348 C ASP A 89 4.739 3.180 13.845 1.00 0.22 C ATOM 1349 O ASP A 89 5.271 2.916 14.926 1.00 0.37 O ATOM 1350 CB ASP A 89 3.796 5.409 14.534 1.00 0.30 C ATOM 1351 CG ASP A 89 2.667 4.639 15.200 1.00 0.39 C ATOM 1352 OD1 ASP A 89 1.953 3.898 14.488 1.00 0.47 O ATOM 1353 OD2 ASP A 89 2.498 4.755 16.429 1.00 0.58 O ATOM 0 H ASP A 89 2.742 4.468 12.289 1.00 0.16 H new ATOM 0 HA ASP A 89 5.471 5.090 13.238 1.00 0.21 H new ATOM 0 HB2 ASP A 89 4.530 5.687 15.291 1.00 0.30 H new ATOM 0 HB3 ASP A 89 3.397 6.335 14.121 1.00 0.30 H new ATOM 1358 N ASP A 90 4.358 2.247 12.981 1.00 0.19 N ATOM 1359 CA ASP A 90 4.493 0.822 13.284 1.00 0.23 C ATOM 1360 C ASP A 90 4.845 0.046 12.013 1.00 0.25 C ATOM 1361 O ASP A 90 5.686 -0.850 12.031 1.00 0.42 O ATOM 1362 CB ASP A 90 3.200 0.297 13.905 1.00 0.26 C ATOM 1363 CG ASP A 90 3.384 -1.033 14.609 1.00 0.36 C ATOM 1364 OD1 ASP A 90 4.320 -1.147 15.428 1.00 0.56 O ATOM 1365 OD2 ASP A 90 2.628 -1.978 14.308 1.00 0.46 O ATOM 0 H ASP A 90 3.954 2.448 12.066 1.00 0.19 H new ATOM 0 HA ASP A 90 5.300 0.682 14.003 1.00 0.23 H new ATOM 0 HB2 ASP A 90 2.820 1.030 14.617 1.00 0.26 H new ATOM 0 HB3 ASP A 90 2.446 0.189 13.126 1.00 0.26 H new ATOM 1370 N GLY A 91 4.200 0.406 10.912 1.00 0.20 N ATOM 1371 CA GLY A 91 4.585 -0.104 9.610 1.00 0.21 C ATOM 1372 C GLY A 91 3.880 -1.384 9.220 1.00 0.22 C ATOM 1373 O GLY A 91 2.656 -1.445 9.221 1.00 0.37 O ATOM 0 H GLY A 91 3.408 1.049 10.898 1.00 0.20 H new ATOM 0 HA2 GLY A 91 4.379 0.657 8.857 1.00 0.21 H new ATOM 0 HA3 GLY A 91 5.661 -0.277 9.602 1.00 0.21 H new ATOM 1377 N VAL A 92 4.652 -2.399 8.873 1.00 0.26 N ATOM 1378 CA VAL A 92 4.090 -3.670 8.448 1.00 0.26 C ATOM 1379 C VAL A 92 4.391 -4.739 9.491 1.00 0.24 C ATOM 1380 O VAL A 92 5.494 -4.813 10.040 1.00 0.28 O ATOM 1381 CB VAL A 92 4.620 -4.091 7.060 1.00 0.32 C ATOM 1382 CG1 VAL A 92 6.057 -4.580 7.141 1.00 0.96 C ATOM 1383 CG2 VAL A 92 3.717 -5.140 6.440 1.00 1.03 C ATOM 0 H VAL A 92 5.672 -2.368 8.877 1.00 0.26 H new ATOM 0 HA VAL A 92 3.010 -3.554 8.357 1.00 0.26 H new ATOM 0 HB VAL A 92 4.612 -3.212 6.415 1.00 0.32 H new ATOM 0 HG11 VAL A 92 6.400 -4.869 6.147 1.00 0.96 H new ATOM 0 HG12 VAL A 92 6.692 -3.782 7.526 1.00 0.96 H new ATOM 0 HG13 VAL A 92 6.111 -5.441 7.808 1.00 0.96 H new ATOM 0 HG21 VAL A 92 4.107 -5.424 5.463 1.00 1.03 H new ATOM 0 HG22 VAL A 92 3.682 -6.018 7.086 1.00 1.03 H new ATOM 0 HG23 VAL A 92 2.712 -4.733 6.326 1.00 1.03 H new ATOM 1393 N MET A 93 3.388 -5.543 9.767 1.00 0.22 N ATOM 1394 CA MET A 93 3.417 -6.496 10.861 1.00 0.22 C ATOM 1395 C MET A 93 2.756 -7.798 10.392 1.00 0.22 C ATOM 1396 O MET A 93 2.288 -7.857 9.256 1.00 0.23 O ATOM 1397 CB MET A 93 2.670 -5.878 12.044 1.00 0.21 C ATOM 1398 CG MET A 93 3.214 -4.518 12.457 1.00 0.23 C ATOM 1399 SD MET A 93 4.709 -4.640 13.441 1.00 0.28 S ATOM 1400 CE MET A 93 3.986 -5.165 14.987 1.00 0.27 C ATOM 0 H MET A 93 2.519 -5.556 9.234 1.00 0.22 H new ATOM 0 HA MET A 93 4.436 -6.726 11.172 1.00 0.22 H new ATOM 0 HB2 MET A 93 1.616 -5.777 11.786 1.00 0.21 H new ATOM 0 HB3 MET A 93 2.726 -6.557 12.895 1.00 0.21 H new ATOM 0 HG2 MET A 93 3.419 -3.927 11.564 1.00 0.23 H new ATOM 0 HG3 MET A 93 2.452 -3.984 13.025 1.00 0.23 H new ATOM 0 HE1 MET A 93 4.183 -4.416 15.754 1.00 0.27 H new ATOM 0 HE2 MET A 93 2.910 -5.284 14.863 1.00 0.27 H new ATOM 0 HE3 MET A 93 4.424 -6.117 15.289 1.00 0.27 H new ATOM 1410 N PRO A 94 2.712 -8.853 11.238 1.00 0.25 N ATOM 1411 CA PRO A 94 2.140 -10.161 10.869 1.00 0.30 C ATOM 1412 C PRO A 94 0.871 -10.090 10.007 1.00 0.28 C ATOM 1413 O PRO A 94 0.888 -10.494 8.841 1.00 0.31 O ATOM 1414 CB PRO A 94 1.825 -10.780 12.225 1.00 0.37 C ATOM 1415 CG PRO A 94 2.891 -10.259 13.126 1.00 0.58 C ATOM 1416 CD PRO A 94 3.247 -8.882 12.618 1.00 0.30 C ATOM 0 HA PRO A 94 2.833 -10.727 10.247 1.00 0.30 H new ATOM 0 HB2 PRO A 94 0.834 -10.491 12.573 1.00 0.37 H new ATOM 0 HB3 PRO A 94 1.841 -11.869 12.178 1.00 0.37 H new ATOM 0 HG2 PRO A 94 2.540 -10.213 14.157 1.00 0.58 H new ATOM 0 HG3 PRO A 94 3.762 -10.914 13.115 1.00 0.58 H new ATOM 0 HD2 PRO A 94 2.800 -8.102 13.235 1.00 0.30 H new ATOM 0 HD3 PRO A 94 4.325 -8.719 12.631 1.00 0.30 H new ATOM 1424 N GLN A 95 -0.223 -9.564 10.560 1.00 0.29 N ATOM 1425 CA GLN A 95 -1.499 -9.578 9.851 1.00 0.32 C ATOM 1426 C GLN A 95 -1.524 -8.551 8.723 1.00 0.31 C ATOM 1427 O GLN A 95 -2.356 -8.622 7.822 1.00 0.37 O ATOM 1428 CB GLN A 95 -2.680 -9.353 10.797 1.00 0.37 C ATOM 1429 CG GLN A 95 -2.906 -7.908 11.194 1.00 0.45 C ATOM 1430 CD GLN A 95 -4.277 -7.687 11.820 1.00 0.50 C ATOM 1431 OE1 GLN A 95 -5.253 -7.415 11.123 1.00 0.75 O ATOM 1432 NE2 GLN A 95 -4.371 -7.779 13.142 1.00 0.34 N ATOM 0 H GLN A 95 -0.250 -9.130 11.483 1.00 0.29 H new ATOM 0 HA GLN A 95 -1.602 -10.571 9.414 1.00 0.32 H new ATOM 0 HB2 GLN A 95 -3.585 -9.731 10.322 1.00 0.37 H new ATOM 0 HB3 GLN A 95 -2.523 -9.943 11.700 1.00 0.37 H new ATOM 0 HG2 GLN A 95 -2.134 -7.603 11.900 1.00 0.45 H new ATOM 0 HG3 GLN A 95 -2.804 -7.272 10.315 1.00 0.45 H new ATOM 0 HE21 GLN A 95 -3.546 -8.006 13.697 1.00 0.34 H new ATOM 0 HE22 GLN A 95 -5.268 -7.623 13.602 1.00 0.34 H new ATOM 1441 N THR A 96 -0.601 -7.608 8.775 1.00 0.26 N ATOM 1442 CA THR A 96 -0.471 -6.618 7.723 1.00 0.25 C ATOM 1443 C THR A 96 0.030 -7.288 6.466 1.00 0.25 C ATOM 1444 O THR A 96 -0.487 -7.075 5.367 1.00 0.31 O ATOM 1445 CB THR A 96 0.514 -5.520 8.110 1.00 0.25 C ATOM 1446 OG1 THR A 96 0.683 -5.513 9.525 1.00 0.24 O ATOM 1447 CG2 THR A 96 0.015 -4.166 7.641 1.00 0.28 C ATOM 0 H THR A 96 0.070 -7.507 9.536 1.00 0.26 H new ATOM 0 HA THR A 96 -1.451 -6.170 7.561 1.00 0.25 H new ATOM 0 HB THR A 96 1.472 -5.718 7.629 1.00 0.25 H new ATOM 0 HG1 THR A 96 1.116 -4.678 9.799 1.00 0.24 H new ATOM 0 HG21 THR A 96 0.731 -3.395 7.926 1.00 0.28 H new ATOM 0 HG22 THR A 96 -0.096 -4.175 6.557 1.00 0.28 H new ATOM 0 HG23 THR A 96 -0.949 -3.954 8.103 1.00 0.28 H new ATOM 1455 N VAL A 97 1.040 -8.124 6.645 1.00 0.25 N ATOM 1456 CA VAL A 97 1.634 -8.821 5.542 1.00 0.31 C ATOM 1457 C VAL A 97 0.702 -9.868 4.980 1.00 0.23 C ATOM 1458 O VAL A 97 0.591 -10.009 3.771 1.00 0.24 O ATOM 1459 CB VAL A 97 2.922 -9.539 5.916 1.00 0.48 C ATOM 1460 CG1 VAL A 97 3.557 -10.047 4.656 1.00 1.02 C ATOM 1461 CG2 VAL A 97 3.861 -8.636 6.667 1.00 1.38 C ATOM 0 H VAL A 97 1.459 -8.329 7.552 1.00 0.25 H new ATOM 0 HA VAL A 97 1.845 -8.045 4.807 1.00 0.31 H new ATOM 0 HB VAL A 97 2.694 -10.371 6.582 1.00 0.48 H new ATOM 0 HG11 VAL A 97 4.484 -10.566 4.899 1.00 1.02 H new ATOM 0 HG12 VAL A 97 2.875 -10.736 4.157 1.00 1.02 H new ATOM 0 HG13 VAL A 97 3.774 -9.208 3.994 1.00 1.02 H new ATOM 0 HG21 VAL A 97 4.770 -9.183 6.917 1.00 1.38 H new ATOM 0 HG22 VAL A 97 4.114 -7.777 6.046 1.00 1.38 H new ATOM 0 HG23 VAL A 97 3.381 -8.292 7.583 1.00 1.38 H new ATOM 1471 N GLU A 98 0.041 -10.612 5.854 1.00 0.24 N ATOM 1472 CA GLU A 98 -0.811 -11.711 5.398 1.00 0.29 C ATOM 1473 C GLU A 98 -1.923 -11.173 4.507 1.00 0.31 C ATOM 1474 O GLU A 98 -2.450 -11.883 3.646 1.00 0.37 O ATOM 1475 CB GLU A 98 -1.391 -12.505 6.573 1.00 0.39 C ATOM 1476 CG GLU A 98 -2.362 -11.732 7.444 1.00 0.92 C ATOM 1477 CD GLU A 98 -2.958 -12.588 8.541 1.00 1.64 C ATOM 1478 OE1 GLU A 98 -4.011 -13.216 8.307 1.00 1.97 O ATOM 1479 OE2 GLU A 98 -2.375 -12.645 9.644 1.00 2.35 O ATOM 0 H GLU A 98 0.073 -10.483 6.865 1.00 0.24 H new ATOM 0 HA GLU A 98 -0.194 -12.398 4.819 1.00 0.29 H new ATOM 0 HB2 GLU A 98 -1.898 -13.387 6.182 1.00 0.39 H new ATOM 0 HB3 GLU A 98 -0.569 -12.859 7.195 1.00 0.39 H new ATOM 0 HG2 GLU A 98 -1.848 -10.880 7.890 1.00 0.92 H new ATOM 0 HG3 GLU A 98 -3.163 -11.331 6.823 1.00 0.92 H new ATOM 1486 N ALA A 99 -2.251 -9.908 4.712 1.00 0.31 N ATOM 1487 CA ALA A 99 -3.184 -9.204 3.856 1.00 0.35 C ATOM 1488 C ALA A 99 -2.564 -8.923 2.488 1.00 0.34 C ATOM 1489 O ALA A 99 -3.212 -9.099 1.456 1.00 0.44 O ATOM 1490 CB ALA A 99 -3.621 -7.913 4.525 1.00 0.39 C ATOM 0 H ALA A 99 -1.878 -9.344 5.475 1.00 0.31 H new ATOM 0 HA ALA A 99 -4.060 -9.834 3.699 1.00 0.35 H new ATOM 0 HB1 ALA A 99 -4.323 -7.387 3.877 1.00 0.39 H new ATOM 0 HB2 ALA A 99 -4.105 -8.141 5.475 1.00 0.39 H new ATOM 0 HB3 ALA A 99 -2.750 -7.283 4.704 1.00 0.39 H new ATOM 1496 N ILE A 100 -1.290 -8.535 2.478 1.00 0.28 N ATOM 1497 CA ILE A 100 -0.606 -8.220 1.239 1.00 0.29 C ATOM 1498 C ILE A 100 -0.300 -9.507 0.493 1.00 0.29 C ATOM 1499 O ILE A 100 -0.414 -9.589 -0.731 1.00 0.34 O ATOM 1500 CB ILE A 100 0.709 -7.479 1.515 1.00 0.32 C ATOM 1501 CG1 ILE A 100 0.434 -6.134 2.191 1.00 0.35 C ATOM 1502 CG2 ILE A 100 1.474 -7.300 0.219 1.00 0.36 C ATOM 1503 CD1 ILE A 100 1.677 -5.455 2.723 1.00 0.41 C ATOM 0 H ILE A 100 -0.717 -8.433 3.316 1.00 0.28 H new ATOM 0 HA ILE A 100 -1.253 -7.579 0.640 1.00 0.29 H new ATOM 0 HB ILE A 100 1.320 -8.070 2.197 1.00 0.32 H new ATOM 0 HG12 ILE A 100 -0.054 -5.471 1.476 1.00 0.35 H new ATOM 0 HG13 ILE A 100 -0.266 -6.287 3.013 1.00 0.35 H new ATOM 0 HG21 ILE A 100 2.408 -6.773 0.417 1.00 0.36 H new ATOM 0 HG22 ILE A 100 1.693 -8.277 -0.212 1.00 0.36 H new ATOM 0 HG23 ILE A 100 0.873 -6.721 -0.482 1.00 0.36 H new ATOM 0 HD11 ILE A 100 1.403 -4.508 3.188 1.00 0.41 H new ATOM 0 HD12 ILE A 100 2.154 -6.098 3.463 1.00 0.41 H new ATOM 0 HD13 ILE A 100 2.370 -5.269 1.902 1.00 0.41 H new ATOM 1515 N ASN A 101 0.077 -10.509 1.264 1.00 0.29 N ATOM 1516 CA ASN A 101 0.376 -11.827 0.749 1.00 0.34 C ATOM 1517 C ASN A 101 -0.844 -12.431 0.080 1.00 0.36 C ATOM 1518 O ASN A 101 -0.719 -13.196 -0.868 1.00 0.43 O ATOM 1519 CB ASN A 101 0.878 -12.721 1.886 1.00 0.44 C ATOM 1520 CG ASN A 101 2.359 -12.573 2.123 1.00 0.53 C ATOM 1521 OD1 ASN A 101 3.128 -12.313 1.197 1.00 0.67 O ATOM 1522 ND2 ASN A 101 2.776 -12.724 3.364 1.00 0.64 N ATOM 0 H ASN A 101 0.185 -10.428 2.275 1.00 0.29 H new ATOM 0 HA ASN A 101 1.159 -11.746 -0.005 1.00 0.34 H new ATOM 0 HB2 ASN A 101 0.340 -12.476 2.802 1.00 0.44 H new ATOM 0 HB3 ASN A 101 0.652 -13.762 1.653 1.00 0.44 H new ATOM 0 HD21 ASN A 101 3.767 -12.626 3.585 1.00 0.64 H new ATOM 0 HD22 ASN A 101 2.108 -12.939 4.104 1.00 0.64 H new ATOM 1529 N HIS A 102 -2.025 -12.070 0.566 1.00 0.35 N ATOM 1530 CA HIS A 102 -3.259 -12.507 -0.060 1.00 0.43 C ATOM 1531 C HIS A 102 -3.558 -11.641 -1.286 1.00 0.37 C ATOM 1532 O HIS A 102 -4.086 -12.130 -2.286 1.00 0.41 O ATOM 1533 CB HIS A 102 -4.426 -12.460 0.936 1.00 0.61 C ATOM 1534 CG HIS A 102 -5.615 -13.243 0.472 1.00 1.18 C ATOM 1535 ND1 HIS A 102 -6.112 -14.345 1.136 1.00 2.07 N ATOM 1536 CD2 HIS A 102 -6.389 -13.088 -0.620 1.00 1.10 C ATOM 1537 CE1 HIS A 102 -7.136 -14.834 0.464 1.00 2.50 C ATOM 1538 NE2 HIS A 102 -7.327 -14.086 -0.607 1.00 1.91 N ATOM 0 H HIS A 102 -2.151 -11.479 1.388 1.00 0.35 H new ATOM 0 HA HIS A 102 -3.138 -13.541 -0.382 1.00 0.43 H new ATOM 0 HB2 HIS A 102 -4.093 -12.849 1.898 1.00 0.61 H new ATOM 0 HB3 HIS A 102 -4.720 -11.423 1.096 1.00 0.61 H new ATOM 0 HD2 HIS A 102 -6.288 -12.317 -1.369 1.00 1.10 H new ATOM 0 HE1 HIS A 102 -7.719 -15.699 0.742 1.00 2.50 H new ATOM 0 HE2 HIS A 102 -8.053 -14.228 -1.309 1.00 1.91 H new ATOM 1547 N ALA A 103 -3.206 -10.364 -1.206 1.00 0.37 N ATOM 1548 CA ALA A 103 -3.427 -9.436 -2.311 1.00 0.41 C ATOM 1549 C ALA A 103 -2.568 -9.798 -3.521 1.00 0.40 C ATOM 1550 O ALA A 103 -3.054 -9.835 -4.648 1.00 0.44 O ATOM 1551 CB ALA A 103 -3.139 -8.006 -1.871 1.00 0.47 C ATOM 0 H ALA A 103 -2.766 -9.946 -0.387 1.00 0.37 H new ATOM 0 HA ALA A 103 -4.474 -9.512 -2.605 1.00 0.41 H new ATOM 0 HB1 ALA A 103 -3.309 -7.327 -2.707 1.00 0.47 H new ATOM 0 HB2 ALA A 103 -3.800 -7.739 -1.046 1.00 0.47 H new ATOM 0 HB3 ALA A 103 -2.102 -7.928 -1.545 1.00 0.47 H new ATOM 1557 N LYS A 104 -1.291 -10.076 -3.284 1.00 0.41 N ATOM 1558 CA LYS A 104 -0.374 -10.435 -4.360 1.00 0.49 C ATOM 1559 C LYS A 104 -0.683 -11.822 -4.863 1.00 0.54 C ATOM 1560 O LYS A 104 -0.535 -12.122 -6.045 1.00 0.66 O ATOM 1561 CB LYS A 104 1.056 -10.372 -3.856 1.00 0.61 C ATOM 1562 CG LYS A 104 1.414 -9.004 -3.343 1.00 0.70 C ATOM 1563 CD LYS A 104 1.424 -7.988 -4.478 1.00 0.84 C ATOM 1564 CE LYS A 104 1.612 -6.570 -3.970 1.00 0.99 C ATOM 1565 NZ LYS A 104 1.705 -5.591 -5.091 1.00 1.66 N ATOM 0 H LYS A 104 -0.867 -10.060 -2.356 1.00 0.41 H new ATOM 0 HA LYS A 104 -0.495 -9.729 -5.182 1.00 0.49 H new ATOM 0 HB2 LYS A 104 1.192 -11.104 -3.060 1.00 0.61 H new ATOM 0 HB3 LYS A 104 1.737 -10.646 -4.662 1.00 0.61 H new ATOM 0 HG2 LYS A 104 0.698 -8.697 -2.580 1.00 0.70 H new ATOM 0 HG3 LYS A 104 2.394 -9.034 -2.867 1.00 0.70 H new ATOM 0 HD2 LYS A 104 2.225 -8.232 -5.176 1.00 0.84 H new ATOM 0 HD3 LYS A 104 0.487 -8.054 -5.032 1.00 0.84 H new ATOM 0 HE2 LYS A 104 0.778 -6.302 -3.321 1.00 0.99 H new ATOM 0 HE3 LYS A 104 2.517 -6.517 -3.365 1.00 0.99 H new ATOM 0 HZ1 LYS A 104 1.226 -4.708 -4.821 1.00 1.66 H new ATOM 0 HZ2 LYS A 104 2.705 -5.394 -5.297 1.00 1.66 H new ATOM 0 HZ3 LYS A 104 1.249 -5.988 -5.937 1.00 1.66 H new ATOM 1579 N ALA A 105 -1.108 -12.658 -3.938 1.00 0.51 N ATOM 1580 CA ALA A 105 -1.563 -14.011 -4.270 1.00 0.61 C ATOM 1581 C ALA A 105 -2.718 -13.986 -5.271 1.00 0.62 C ATOM 1582 O ALA A 105 -2.869 -14.898 -6.086 1.00 0.77 O ATOM 1583 CB ALA A 105 -1.981 -14.768 -3.021 1.00 0.65 C ATOM 0 H ALA A 105 -1.151 -12.432 -2.944 1.00 0.51 H new ATOM 0 HA ALA A 105 -0.721 -14.527 -4.731 1.00 0.61 H new ATOM 0 HB1 ALA A 105 -2.314 -15.769 -3.296 1.00 0.65 H new ATOM 0 HB2 ALA A 105 -1.133 -14.842 -2.340 1.00 0.65 H new ATOM 0 HB3 ALA A 105 -2.796 -14.237 -2.529 1.00 0.65 H new ATOM 1589 N ALA A 106 -3.541 -12.948 -5.199 1.00 0.54 N ATOM 1590 CA ALA A 106 -4.662 -12.809 -6.118 1.00 0.64 C ATOM 1591 C ALA A 106 -4.264 -11.997 -7.348 1.00 0.64 C ATOM 1592 O ALA A 106 -4.933 -12.052 -8.380 1.00 0.74 O ATOM 1593 CB ALA A 106 -5.848 -12.170 -5.416 1.00 0.68 C ATOM 0 H ALA A 106 -3.454 -12.194 -4.518 1.00 0.54 H new ATOM 0 HA ALA A 106 -4.952 -13.805 -6.452 1.00 0.64 H new ATOM 0 HB1 ALA A 106 -6.677 -12.073 -6.117 1.00 0.68 H new ATOM 0 HB2 ALA A 106 -6.154 -12.794 -4.576 1.00 0.68 H new ATOM 0 HB3 ALA A 106 -5.566 -11.183 -5.050 1.00 0.68 H new ATOM 1599 N ASN A 107 -3.173 -11.239 -7.201 1.00 0.59 N ATOM 1600 CA ASN A 107 -2.610 -10.415 -8.271 1.00 0.65 C ATOM 1601 C ASN A 107 -3.450 -9.162 -8.413 1.00 0.60 C ATOM 1602 O ASN A 107 -4.216 -8.991 -9.360 1.00 0.85 O ATOM 1603 CB ASN A 107 -2.507 -11.173 -9.590 1.00 0.85 C ATOM 1604 CG ASN A 107 -1.777 -10.413 -10.655 1.00 1.04 C ATOM 1605 OD1 ASN A 107 -0.546 -10.401 -10.701 1.00 1.17 O ATOM 1606 ND2 ASN A 107 -2.519 -9.810 -11.542 1.00 1.41 N ATOM 0 H ASN A 107 -2.652 -11.181 -6.326 1.00 0.59 H new ATOM 0 HA ASN A 107 -1.589 -10.142 -8.005 1.00 0.65 H new ATOM 0 HB2 ASN A 107 -1.999 -12.122 -9.417 1.00 0.85 H new ATOM 0 HB3 ASN A 107 -3.510 -11.409 -9.945 1.00 0.85 H new ATOM 0 HD21 ASN A 107 -2.083 -9.303 -12.312 1.00 1.41 H new ATOM 0 HD22 ASN A 107 -3.536 -9.846 -11.466 1.00 1.41 H new ATOM 1613 N VAL A 108 -3.302 -8.294 -7.430 1.00 0.44 N ATOM 1614 CA VAL A 108 -4.184 -7.167 -7.261 1.00 0.42 C ATOM 1615 C VAL A 108 -3.409 -5.881 -7.003 1.00 0.37 C ATOM 1616 O VAL A 108 -2.412 -5.877 -6.268 1.00 0.38 O ATOM 1617 CB VAL A 108 -5.132 -7.447 -6.083 1.00 0.49 C ATOM 1618 CG1 VAL A 108 -5.640 -6.158 -5.481 1.00 1.06 C ATOM 1619 CG2 VAL A 108 -6.290 -8.326 -6.530 1.00 1.35 C ATOM 0 H VAL A 108 -2.564 -8.355 -6.728 1.00 0.44 H new ATOM 0 HA VAL A 108 -4.752 -7.032 -8.182 1.00 0.42 H new ATOM 0 HB VAL A 108 -4.572 -7.979 -5.314 1.00 0.49 H new ATOM 0 HG11 VAL A 108 -6.308 -6.383 -4.650 1.00 1.06 H new ATOM 0 HG12 VAL A 108 -4.797 -5.568 -5.120 1.00 1.06 H new ATOM 0 HG13 VAL A 108 -6.181 -5.591 -6.239 1.00 1.06 H new ATOM 0 HG21 VAL A 108 -6.951 -8.515 -5.684 1.00 1.35 H new ATOM 0 HG22 VAL A 108 -6.846 -7.821 -7.320 1.00 1.35 H new ATOM 0 HG23 VAL A 108 -5.904 -9.273 -6.907 1.00 1.35 H new ATOM 1629 N PRO A 109 -3.850 -4.781 -7.633 1.00 0.35 N ATOM 1630 CA PRO A 109 -3.356 -3.434 -7.345 1.00 0.33 C ATOM 1631 C PRO A 109 -3.779 -2.963 -5.959 1.00 0.28 C ATOM 1632 O PRO A 109 -4.896 -3.233 -5.515 1.00 0.29 O ATOM 1633 CB PRO A 109 -4.025 -2.561 -8.408 1.00 0.37 C ATOM 1634 CG PRO A 109 -4.530 -3.507 -9.441 1.00 0.47 C ATOM 1635 CD PRO A 109 -4.858 -4.768 -8.706 1.00 0.40 C ATOM 0 HA PRO A 109 -2.267 -3.392 -7.363 1.00 0.33 H new ATOM 0 HB2 PRO A 109 -4.839 -1.976 -7.980 1.00 0.37 H new ATOM 0 HB3 PRO A 109 -3.316 -1.853 -8.837 1.00 0.37 H new ATOM 0 HG2 PRO A 109 -5.410 -3.106 -9.943 1.00 0.47 H new ATOM 0 HG3 PRO A 109 -3.778 -3.686 -10.210 1.00 0.47 H new ATOM 0 HD2 PRO A 109 -5.873 -4.754 -8.309 1.00 0.40 H new ATOM 0 HD3 PRO A 109 -4.779 -5.645 -9.348 1.00 0.40 H new ATOM 1643 N ILE A 110 -2.911 -2.237 -5.279 1.00 0.25 N ATOM 1644 CA ILE A 110 -3.189 -1.864 -3.907 1.00 0.21 C ATOM 1645 C ILE A 110 -3.473 -0.367 -3.783 1.00 0.19 C ATOM 1646 O ILE A 110 -3.051 0.443 -4.609 1.00 0.23 O ATOM 1647 CB ILE A 110 -2.010 -2.264 -2.982 1.00 0.23 C ATOM 1648 CG1 ILE A 110 -1.805 -3.787 -2.989 1.00 0.38 C ATOM 1649 CG2 ILE A 110 -2.209 -1.770 -1.558 1.00 0.21 C ATOM 1650 CD1 ILE A 110 -2.959 -4.565 -2.388 1.00 0.60 C ATOM 0 H ILE A 110 -2.022 -1.899 -5.648 1.00 0.25 H new ATOM 0 HA ILE A 110 -4.082 -2.405 -3.593 1.00 0.21 H new ATOM 0 HB ILE A 110 -1.116 -1.782 -3.378 1.00 0.23 H new ATOM 0 HG12 ILE A 110 -1.652 -4.118 -4.016 1.00 0.38 H new ATOM 0 HG13 ILE A 110 -0.894 -4.024 -2.439 1.00 0.38 H new ATOM 0 HG21 ILE A 110 -1.360 -2.073 -0.946 1.00 0.21 H new ATOM 0 HG22 ILE A 110 -2.287 -0.683 -1.558 1.00 0.21 H new ATOM 0 HG23 ILE A 110 -3.123 -2.200 -1.148 1.00 0.21 H new ATOM 0 HD11 ILE A 110 -2.739 -5.632 -2.429 1.00 0.60 H new ATOM 0 HD12 ILE A 110 -3.100 -4.264 -1.350 1.00 0.60 H new ATOM 0 HD13 ILE A 110 -3.869 -4.360 -2.952 1.00 0.60 H new ATOM 1662 N ILE A 111 -4.213 -0.037 -2.748 1.00 0.18 N ATOM 1663 CA ILE A 111 -4.470 1.330 -2.342 1.00 0.18 C ATOM 1664 C ILE A 111 -4.058 1.455 -0.888 1.00 0.16 C ATOM 1665 O ILE A 111 -4.857 1.252 0.024 1.00 0.18 O ATOM 1666 CB ILE A 111 -5.961 1.731 -2.509 1.00 0.25 C ATOM 1667 CG1 ILE A 111 -6.313 1.863 -3.987 1.00 0.32 C ATOM 1668 CG2 ILE A 111 -6.263 3.047 -1.790 1.00 0.27 C ATOM 1669 CD1 ILE A 111 -5.762 3.120 -4.615 1.00 0.37 C ATOM 0 H ILE A 111 -4.665 -0.728 -2.149 1.00 0.18 H new ATOM 0 HA ILE A 111 -3.899 2.004 -2.980 1.00 0.18 H new ATOM 0 HB ILE A 111 -6.569 0.944 -2.062 1.00 0.25 H new ATOM 0 HG12 ILE A 111 -5.929 0.996 -4.525 1.00 0.32 H new ATOM 0 HG13 ILE A 111 -7.397 1.853 -4.099 1.00 0.32 H new ATOM 0 HG21 ILE A 111 -7.314 3.302 -1.925 1.00 0.27 H new ATOM 0 HG22 ILE A 111 -6.049 2.938 -0.727 1.00 0.27 H new ATOM 0 HG23 ILE A 111 -5.641 3.840 -2.206 1.00 0.27 H new ATOM 0 HD11 ILE A 111 -6.046 3.156 -5.667 1.00 0.37 H new ATOM 0 HD12 ILE A 111 -6.166 3.991 -4.100 1.00 0.37 H new ATOM 0 HD13 ILE A 111 -4.675 3.122 -4.533 1.00 0.37 H new ATOM 1681 N VAL A 112 -2.789 1.711 -0.667 1.00 0.16 N ATOM 1682 CA VAL A 112 -2.297 1.845 0.673 1.00 0.18 C ATOM 1683 C VAL A 112 -2.748 3.149 1.266 1.00 0.20 C ATOM 1684 O VAL A 112 -2.888 4.155 0.575 1.00 0.22 O ATOM 1685 CB VAL A 112 -0.770 1.773 0.755 1.00 0.19 C ATOM 1686 CG1 VAL A 112 -0.311 1.905 2.177 1.00 0.26 C ATOM 1687 CG2 VAL A 112 -0.266 0.472 0.195 1.00 0.19 C ATOM 0 H VAL A 112 -2.087 1.829 -1.397 1.00 0.16 H new ATOM 0 HA VAL A 112 -2.706 1.005 1.234 1.00 0.18 H new ATOM 0 HB VAL A 112 -0.368 2.597 0.166 1.00 0.19 H new ATOM 0 HG11 VAL A 112 0.777 1.851 2.215 1.00 0.26 H new ATOM 0 HG12 VAL A 112 -0.641 2.863 2.578 1.00 0.26 H new ATOM 0 HG13 VAL A 112 -0.735 1.097 2.773 1.00 0.26 H new ATOM 0 HG21 VAL A 112 0.821 0.443 0.264 1.00 0.19 H new ATOM 0 HG22 VAL A 112 -0.688 -0.357 0.764 1.00 0.19 H new ATOM 0 HG23 VAL A 112 -0.566 0.385 -0.849 1.00 0.19 H new ATOM 1697 N ALA A 113 -2.962 3.108 2.541 1.00 0.21 N ATOM 1698 CA ALA A 113 -3.359 4.267 3.289 1.00 0.24 C ATOM 1699 C ALA A 113 -2.779 4.206 4.683 1.00 0.25 C ATOM 1700 O ALA A 113 -3.218 3.437 5.536 1.00 0.28 O ATOM 1701 CB ALA A 113 -4.868 4.397 3.297 1.00 0.29 C ATOM 0 H ALA A 113 -2.866 2.262 3.103 1.00 0.21 H new ATOM 0 HA ALA A 113 -2.964 5.163 2.811 1.00 0.24 H new ATOM 0 HB1 ALA A 113 -5.154 5.280 3.868 1.00 0.29 H new ATOM 0 HB2 ALA A 113 -5.230 4.493 2.274 1.00 0.29 H new ATOM 0 HB3 ALA A 113 -5.307 3.511 3.755 1.00 0.29 H new ATOM 1707 N ILE A 114 -1.748 4.998 4.871 1.00 0.24 N ATOM 1708 CA ILE A 114 -1.044 5.078 6.128 1.00 0.27 C ATOM 1709 C ILE A 114 -1.893 5.796 7.170 1.00 0.30 C ATOM 1710 O ILE A 114 -2.610 6.723 6.836 1.00 0.50 O ATOM 1711 CB ILE A 114 0.306 5.813 5.946 1.00 0.33 C ATOM 1712 CG1 ILE A 114 1.312 4.932 5.199 1.00 0.38 C ATOM 1713 CG2 ILE A 114 0.876 6.243 7.280 1.00 0.44 C ATOM 1714 CD1 ILE A 114 1.159 4.946 3.693 1.00 0.59 C ATOM 0 H ILE A 114 -1.372 5.611 4.147 1.00 0.24 H new ATOM 0 HA ILE A 114 -0.847 4.064 6.475 1.00 0.27 H new ATOM 0 HB ILE A 114 0.118 6.706 5.350 1.00 0.33 H new ATOM 0 HG12 ILE A 114 2.321 5.258 5.452 1.00 0.38 H new ATOM 0 HG13 ILE A 114 1.211 3.906 5.553 1.00 0.38 H new ATOM 0 HG21 ILE A 114 1.824 6.757 7.122 1.00 0.44 H new ATOM 0 HG22 ILE A 114 0.176 6.917 7.774 1.00 0.44 H new ATOM 0 HG23 ILE A 114 1.039 5.366 7.906 1.00 0.44 H new ATOM 0 HD11 ILE A 114 1.911 4.296 3.245 1.00 0.59 H new ATOM 0 HD12 ILE A 114 0.164 4.589 3.425 1.00 0.59 H new ATOM 0 HD13 ILE A 114 1.292 5.963 3.323 1.00 0.59 H new ATOM 1726 N ASN A 115 -1.804 5.370 8.417 1.00 0.19 N ATOM 1727 CA ASN A 115 -2.536 6.008 9.506 1.00 0.22 C ATOM 1728 C ASN A 115 -1.534 6.443 10.527 1.00 0.20 C ATOM 1729 O ASN A 115 -0.348 6.108 10.433 1.00 0.22 O ATOM 1730 CB ASN A 115 -3.600 5.053 10.095 1.00 0.33 C ATOM 1731 CG ASN A 115 -3.206 4.351 11.389 1.00 0.84 C ATOM 1732 OD1 ASN A 115 -2.062 3.996 11.610 1.00 1.85 O ATOM 1733 ND2 ASN A 115 -4.175 4.144 12.261 1.00 0.56 N ATOM 0 H ASN A 115 -1.228 4.579 8.706 1.00 0.19 H new ATOM 0 HA ASN A 115 -3.086 6.877 9.145 1.00 0.22 H new ATOM 0 HB2 ASN A 115 -4.513 5.620 10.273 1.00 0.33 H new ATOM 0 HB3 ASN A 115 -3.836 4.295 9.348 1.00 0.33 H new ATOM 0 HD21 ASN A 115 -3.974 3.677 13.145 1.00 0.56 H new ATOM 0 HD22 ASN A 115 -5.125 4.452 12.051 1.00 0.56 H new ATOM 1740 N LYS A 116 -2.000 7.216 11.466 1.00 0.19 N ATOM 1741 CA LYS A 116 -1.173 7.703 12.521 1.00 0.20 C ATOM 1742 C LYS A 116 -0.124 8.689 12.027 1.00 0.21 C ATOM 1743 O LYS A 116 1.007 8.717 12.510 1.00 0.26 O ATOM 1744 CB LYS A 116 -0.568 6.532 13.286 1.00 0.25 C ATOM 1745 CG LYS A 116 -1.517 6.036 14.356 1.00 0.32 C ATOM 1746 CD LYS A 116 -0.859 5.080 15.335 1.00 0.40 C ATOM 1747 CE LYS A 116 -1.017 3.634 14.907 1.00 0.51 C ATOM 1748 NZ LYS A 116 -0.195 2.730 15.751 1.00 0.59 N ATOM 0 H LYS A 116 -2.971 7.525 11.517 1.00 0.19 H new ATOM 0 HA LYS A 116 -1.796 8.271 13.212 1.00 0.20 H new ATOM 0 HB2 LYS A 116 -0.338 5.721 12.595 1.00 0.25 H new ATOM 0 HB3 LYS A 116 0.373 6.838 13.743 1.00 0.25 H new ATOM 0 HG2 LYS A 116 -1.917 6.890 14.903 1.00 0.32 H new ATOM 0 HG3 LYS A 116 -2.362 5.537 13.882 1.00 0.32 H new ATOM 0 HD2 LYS A 116 0.201 5.320 15.420 1.00 0.40 H new ATOM 0 HD3 LYS A 116 -1.296 5.216 16.324 1.00 0.40 H new ATOM 0 HE2 LYS A 116 -2.066 3.345 14.975 1.00 0.51 H new ATOM 0 HE3 LYS A 116 -0.724 3.527 13.863 1.00 0.51 H new ATOM 0 HZ1 LYS A 116 -0.638 1.790 15.787 1.00 0.59 H new ATOM 0 HZ2 LYS A 116 0.759 2.648 15.345 1.00 0.59 H new ATOM 0 HZ3 LYS A 116 -0.129 3.118 16.713 1.00 0.59 H new ATOM 1762 N MET A 117 -0.528 9.509 11.065 1.00 0.21 N ATOM 1763 CA MET A 117 0.236 10.689 10.686 1.00 0.28 C ATOM 1764 C MET A 117 0.043 11.772 11.726 1.00 0.29 C ATOM 1765 O MET A 117 0.741 12.786 11.732 1.00 0.37 O ATOM 1766 CB MET A 117 -0.198 11.195 9.320 1.00 0.38 C ATOM 1767 CG MET A 117 0.412 10.395 8.201 1.00 0.48 C ATOM 1768 SD MET A 117 2.179 10.657 8.071 1.00 0.77 S ATOM 1769 CE MET A 117 2.565 9.251 7.066 1.00 0.92 C ATOM 0 H MET A 117 -1.386 9.376 10.530 1.00 0.21 H new ATOM 0 HA MET A 117 1.291 10.421 10.631 1.00 0.28 H new ATOM 0 HB2 MET A 117 -1.285 11.151 9.246 1.00 0.38 H new ATOM 0 HB3 MET A 117 0.087 12.242 9.214 1.00 0.38 H new ATOM 0 HG2 MET A 117 0.214 9.336 8.364 1.00 0.48 H new ATOM 0 HG3 MET A 117 -0.065 10.667 7.259 1.00 0.48 H new ATOM 0 HE1 MET A 117 3.320 8.643 7.565 1.00 0.92 H new ATOM 0 HE2 MET A 117 1.665 8.656 6.911 1.00 0.92 H new ATOM 0 HE3 MET A 117 2.948 9.587 6.102 1.00 0.92 H new ATOM 1779 N ASP A 118 -0.929 11.547 12.597 1.00 0.27 N ATOM 1780 CA ASP A 118 -1.136 12.424 13.749 1.00 0.34 C ATOM 1781 C ASP A 118 -0.030 12.177 14.757 1.00 0.33 C ATOM 1782 O ASP A 118 0.376 13.074 15.500 1.00 0.47 O ATOM 1783 CB ASP A 118 -2.494 12.167 14.411 1.00 0.39 C ATOM 1784 CG ASP A 118 -2.546 10.841 15.144 1.00 0.55 C ATOM 1785 OD1 ASP A 118 -2.546 9.797 14.468 1.00 0.67 O ATOM 1786 OD2 ASP A 118 -2.607 10.836 16.389 1.00 0.76 O ATOM 0 H ASP A 118 -1.586 10.770 12.533 1.00 0.27 H new ATOM 0 HA ASP A 118 -1.119 13.458 13.405 1.00 0.34 H new ATOM 0 HB2 ASP A 118 -2.710 12.973 15.112 1.00 0.39 H new ATOM 0 HB3 ASP A 118 -3.274 12.188 13.650 1.00 0.39 H new ATOM 1791 N LYS A 119 0.461 10.949 14.757 1.00 0.23 N ATOM 1792 CA LYS A 119 1.518 10.542 15.661 1.00 0.26 C ATOM 1793 C LYS A 119 2.842 11.168 15.257 1.00 0.28 C ATOM 1794 O LYS A 119 3.185 11.212 14.077 1.00 0.26 O ATOM 1795 CB LYS A 119 1.651 9.021 15.661 1.00 0.29 C ATOM 1796 CG LYS A 119 0.461 8.299 16.271 1.00 0.36 C ATOM 1797 CD LYS A 119 0.416 8.454 17.785 1.00 0.72 C ATOM 1798 CE LYS A 119 1.649 7.863 18.464 1.00 0.87 C ATOM 1799 NZ LYS A 119 1.699 6.380 18.362 1.00 1.17 N ATOM 0 H LYS A 119 0.138 10.210 14.132 1.00 0.23 H new ATOM 0 HA LYS A 119 1.260 10.884 16.663 1.00 0.26 H new ATOM 0 HB2 LYS A 119 1.785 8.678 14.635 1.00 0.29 H new ATOM 0 HB3 LYS A 119 2.551 8.745 16.210 1.00 0.29 H new ATOM 0 HG2 LYS A 119 -0.460 8.689 15.839 1.00 0.36 H new ATOM 0 HG3 LYS A 119 0.509 7.240 16.016 1.00 0.36 H new ATOM 0 HD2 LYS A 119 0.336 9.511 18.038 1.00 0.72 H new ATOM 0 HD3 LYS A 119 -0.478 7.966 18.172 1.00 0.72 H new ATOM 0 HE2 LYS A 119 2.546 8.286 18.012 1.00 0.87 H new ATOM 0 HE3 LYS A 119 1.655 8.152 19.515 1.00 0.87 H new ATOM 0 HZ1 LYS A 119 2.384 6.008 19.050 1.00 1.17 H new ATOM 0 HZ2 LYS A 119 0.758 5.986 18.563 1.00 1.17 H new ATOM 0 HZ3 LYS A 119 1.991 6.108 17.402 1.00 1.17 H new ATOM 1813 N PRO A 120 3.599 11.676 16.240 1.00 0.38 N ATOM 1814 CA PRO A 120 4.944 12.217 16.016 1.00 0.45 C ATOM 1815 C PRO A 120 5.917 11.152 15.524 1.00 0.40 C ATOM 1816 O PRO A 120 6.998 11.461 15.024 1.00 0.45 O ATOM 1817 CB PRO A 120 5.377 12.714 17.399 1.00 0.57 C ATOM 1818 CG PRO A 120 4.477 12.032 18.369 1.00 0.58 C ATOM 1819 CD PRO A 120 3.183 11.797 17.649 1.00 0.48 C ATOM 0 HA PRO A 120 4.940 12.993 15.251 1.00 0.45 H new ATOM 0 HB2 PRO A 120 6.421 12.469 17.594 1.00 0.57 H new ATOM 0 HB3 PRO A 120 5.284 13.798 17.473 1.00 0.57 H new ATOM 0 HG2 PRO A 120 4.911 11.091 18.706 1.00 0.58 H new ATOM 0 HG3 PRO A 120 4.323 12.648 19.255 1.00 0.58 H new ATOM 0 HD2 PRO A 120 2.685 10.894 18.001 1.00 0.48 H new ATOM 0 HD3 PRO A 120 2.486 12.622 17.794 1.00 0.48 H new ATOM 1827 N GLU A 121 5.516 9.897 15.679 1.00 0.35 N ATOM 1828 CA GLU A 121 6.335 8.755 15.286 1.00 0.37 C ATOM 1829 C GLU A 121 6.161 8.452 13.800 1.00 0.30 C ATOM 1830 O GLU A 121 6.866 7.610 13.248 1.00 0.37 O ATOM 1831 CB GLU A 121 5.932 7.527 16.096 1.00 0.48 C ATOM 1832 CG GLU A 121 5.520 7.837 17.525 1.00 0.62 C ATOM 1833 CD GLU A 121 6.640 8.434 18.348 1.00 1.04 C ATOM 1834 OE1 GLU A 121 7.644 7.736 18.592 1.00 1.40 O ATOM 1835 OE2 GLU A 121 6.520 9.601 18.761 1.00 1.45 O ATOM 0 H GLU A 121 4.614 9.641 16.081 1.00 0.35 H new ATOM 0 HA GLU A 121 7.379 9.001 15.478 1.00 0.37 H new ATOM 0 HB2 GLU A 121 5.106 7.027 15.591 1.00 0.48 H new ATOM 0 HB3 GLU A 121 6.767 6.826 16.113 1.00 0.48 H new ATOM 0 HG2 GLU A 121 4.678 8.529 17.512 1.00 0.62 H new ATOM 0 HG3 GLU A 121 5.173 6.921 18.004 1.00 0.62 H new ATOM 1842 N ALA A 122 5.189 9.127 13.187 1.00 0.24 N ATOM 1843 CA ALA A 122 4.894 8.985 11.758 1.00 0.22 C ATOM 1844 C ALA A 122 6.165 8.938 10.915 1.00 0.21 C ATOM 1845 O ALA A 122 6.878 9.935 10.780 1.00 0.26 O ATOM 1846 CB ALA A 122 4.000 10.131 11.297 1.00 0.27 C ATOM 0 H ALA A 122 4.581 9.790 13.667 1.00 0.24 H new ATOM 0 HA ALA A 122 4.375 8.037 11.619 1.00 0.22 H new ATOM 0 HB1 ALA A 122 3.785 10.020 10.234 1.00 0.27 H new ATOM 0 HB2 ALA A 122 3.067 10.114 11.860 1.00 0.27 H new ATOM 0 HB3 ALA A 122 4.509 11.080 11.467 1.00 0.27 H new ATOM 1852 N ASN A 123 6.444 7.764 10.366 1.00 0.21 N ATOM 1853 CA ASN A 123 7.575 7.570 9.482 1.00 0.23 C ATOM 1854 C ASN A 123 7.078 6.923 8.211 1.00 0.23 C ATOM 1855 O ASN A 123 7.258 5.725 7.988 1.00 0.25 O ATOM 1856 CB ASN A 123 8.621 6.669 10.127 1.00 0.26 C ATOM 1857 CG ASN A 123 10.009 6.937 9.646 1.00 0.42 C ATOM 1858 OD1 ASN A 123 10.983 6.767 10.377 1.00 0.95 O ATOM 1859 ND2 ASN A 123 10.123 7.349 8.417 1.00 0.52 N ATOM 0 H ASN A 123 5.890 6.922 10.523 1.00 0.21 H new ATOM 0 HA ASN A 123 8.036 8.535 9.273 1.00 0.23 H new ATOM 0 HB2 ASN A 123 8.587 6.801 11.208 1.00 0.26 H new ATOM 0 HB3 ASN A 123 8.368 5.628 9.925 1.00 0.26 H new ATOM 0 HD21 ASN A 123 11.046 7.543 8.028 1.00 0.52 H new ATOM 0 HD22 ASN A 123 9.290 7.478 7.843 1.00 0.52 H new ATOM 1866 N PRO A 124 6.449 7.720 7.362 1.00 0.25 N ATOM 1867 CA PRO A 124 5.814 7.234 6.139 1.00 0.32 C ATOM 1868 C PRO A 124 6.770 6.536 5.209 1.00 0.33 C ATOM 1869 O PRO A 124 6.597 5.364 4.904 1.00 0.35 O ATOM 1870 CB PRO A 124 5.278 8.499 5.501 1.00 0.40 C ATOM 1871 CG PRO A 124 6.043 9.617 6.121 1.00 0.32 C ATOM 1872 CD PRO A 124 6.288 9.175 7.526 1.00 0.27 C ATOM 0 HA PRO A 124 5.052 6.485 6.354 1.00 0.32 H new ATOM 0 HB2 PRO A 124 5.417 8.482 4.420 1.00 0.40 H new ATOM 0 HB3 PRO A 124 4.209 8.607 5.684 1.00 0.40 H new ATOM 0 HG2 PRO A 124 6.980 9.796 5.593 1.00 0.32 H new ATOM 0 HG3 PRO A 124 5.477 10.548 6.092 1.00 0.32 H new ATOM 0 HD2 PRO A 124 7.178 9.639 7.951 1.00 0.27 H new ATOM 0 HD3 PRO A 124 5.454 9.422 8.183 1.00 0.27 H new ATOM 1880 N ASP A 125 7.780 7.272 4.778 1.00 0.37 N ATOM 1881 CA ASP A 125 8.835 6.749 3.911 1.00 0.44 C ATOM 1882 C ASP A 125 9.340 5.400 4.399 1.00 0.34 C ATOM 1883 O ASP A 125 9.763 4.562 3.608 1.00 0.33 O ATOM 1884 CB ASP A 125 10.005 7.724 3.874 1.00 0.61 C ATOM 1885 CG ASP A 125 9.624 9.068 3.300 1.00 0.99 C ATOM 1886 OD1 ASP A 125 8.864 9.809 3.959 1.00 1.44 O ATOM 1887 OD2 ASP A 125 10.071 9.388 2.178 1.00 1.13 O ATOM 0 H ASP A 125 7.897 8.256 5.018 1.00 0.37 H new ATOM 0 HA ASP A 125 8.411 6.625 2.915 1.00 0.44 H new ATOM 0 HB2 ASP A 125 10.391 7.861 4.884 1.00 0.61 H new ATOM 0 HB3 ASP A 125 10.812 7.295 3.280 1.00 0.61 H new ATOM 1892 N ARG A 126 9.259 5.182 5.700 1.00 0.31 N ATOM 1893 CA ARG A 126 9.773 3.952 6.281 1.00 0.31 C ATOM 1894 C ARG A 126 8.780 2.829 6.046 1.00 0.27 C ATOM 1895 O ARG A 126 9.067 1.858 5.347 1.00 0.30 O ATOM 1896 CB ARG A 126 10.035 4.111 7.782 1.00 0.35 C ATOM 1897 CG ARG A 126 10.501 2.827 8.454 1.00 0.51 C ATOM 1898 CD ARG A 126 10.663 2.991 9.959 1.00 1.24 C ATOM 1899 NE ARG A 126 11.566 4.088 10.299 1.00 1.92 N ATOM 1900 CZ ARG A 126 12.813 3.931 10.735 1.00 2.94 C ATOM 1901 NH1 ARG A 126 13.315 2.715 10.923 1.00 3.49 N ATOM 1902 NH2 ARG A 126 13.552 4.997 10.999 1.00 3.79 N ATOM 0 H ARG A 126 8.847 5.832 6.369 1.00 0.31 H new ATOM 0 HA ARG A 126 10.721 3.715 5.799 1.00 0.31 H new ATOM 0 HB2 ARG A 126 10.788 4.885 7.932 1.00 0.35 H new ATOM 0 HB3 ARG A 126 9.122 4.456 8.268 1.00 0.35 H new ATOM 0 HG2 ARG A 126 9.783 2.032 8.252 1.00 0.51 H new ATOM 0 HG3 ARG A 126 11.451 2.516 8.020 1.00 0.51 H new ATOM 0 HD2 ARG A 126 9.688 3.172 10.410 1.00 1.24 H new ATOM 0 HD3 ARG A 126 11.044 2.063 10.385 1.00 1.24 H new ATOM 0 HE ARG A 126 11.216 5.040 10.195 1.00 1.92 H new ATOM 0 HH11 ARG A 126 12.743 1.892 10.733 1.00 3.49 H new ATOM 0 HH12 ARG A 126 14.272 2.605 11.258 1.00 3.49 H new ATOM 0 HH21 ARG A 126 13.165 5.931 10.868 1.00 3.79 H new ATOM 0 HH22 ARG A 126 14.509 4.884 11.334 1.00 3.79 H new ATOM 1916 N VAL A 127 7.598 3.002 6.611 1.00 0.25 N ATOM 1917 CA VAL A 127 6.551 1.984 6.555 1.00 0.28 C ATOM 1918 C VAL A 127 6.063 1.741 5.119 1.00 0.28 C ATOM 1919 O VAL A 127 5.546 0.672 4.789 1.00 0.33 O ATOM 1920 CB VAL A 127 5.383 2.373 7.488 1.00 0.36 C ATOM 1921 CG1 VAL A 127 5.952 2.748 8.840 1.00 0.59 C ATOM 1922 CG2 VAL A 127 4.534 3.521 6.940 1.00 0.44 C ATOM 0 H VAL A 127 7.333 3.845 7.120 1.00 0.25 H new ATOM 0 HA VAL A 127 6.977 1.043 6.903 1.00 0.28 H new ATOM 0 HB VAL A 127 4.718 1.513 7.568 1.00 0.36 H new ATOM 0 HG11 VAL A 127 5.140 3.026 9.512 1.00 0.59 H new ATOM 0 HG12 VAL A 127 6.492 1.898 9.256 1.00 0.59 H new ATOM 0 HG13 VAL A 127 6.634 3.591 8.727 1.00 0.59 H new ATOM 0 HG21 VAL A 127 3.731 3.746 7.641 1.00 0.44 H new ATOM 0 HG22 VAL A 127 5.159 4.404 6.808 1.00 0.44 H new ATOM 0 HG23 VAL A 127 4.107 3.231 5.980 1.00 0.44 H new ATOM 1932 N MET A 128 6.276 2.735 4.278 1.00 0.27 N ATOM 1933 CA MET A 128 5.927 2.692 2.859 1.00 0.31 C ATOM 1934 C MET A 128 6.944 1.861 2.072 1.00 0.26 C ATOM 1935 O MET A 128 6.603 1.208 1.084 1.00 0.35 O ATOM 1936 CB MET A 128 5.882 4.145 2.378 1.00 0.52 C ATOM 1937 CG MET A 128 5.766 4.366 0.892 1.00 0.81 C ATOM 1938 SD MET A 128 5.815 6.133 0.499 1.00 0.67 S ATOM 1939 CE MET A 128 4.654 6.257 -0.857 1.00 0.46 C ATOM 0 H MET A 128 6.705 3.616 4.562 1.00 0.27 H new ATOM 0 HA MET A 128 4.962 2.211 2.702 1.00 0.31 H new ATOM 0 HB2 MET A 128 5.038 4.637 2.861 1.00 0.52 H new ATOM 0 HB3 MET A 128 6.785 4.646 2.726 1.00 0.52 H new ATOM 0 HG2 MET A 128 6.579 3.852 0.379 1.00 0.81 H new ATOM 0 HG3 MET A 128 4.834 3.933 0.527 1.00 0.81 H new ATOM 0 HE1 MET A 128 5.199 6.380 -1.793 1.00 0.46 H new ATOM 0 HE2 MET A 128 4.052 5.350 -0.904 1.00 0.46 H new ATOM 0 HE3 MET A 128 4.003 7.117 -0.701 1.00 0.46 H new ATOM 1949 N GLN A 129 8.191 1.879 2.521 1.00 0.24 N ATOM 1950 CA GLN A 129 9.231 1.061 1.898 1.00 0.27 C ATOM 1951 C GLN A 129 9.132 -0.395 2.340 1.00 0.30 C ATOM 1952 O GLN A 129 9.445 -1.298 1.566 1.00 0.33 O ATOM 1953 CB GLN A 129 10.626 1.613 2.193 1.00 0.32 C ATOM 1954 CG GLN A 129 10.984 2.821 1.346 1.00 0.42 C ATOM 1955 CD GLN A 129 12.319 3.434 1.720 1.00 0.54 C ATOM 1956 OE1 GLN A 129 12.706 3.309 2.981 1.00 1.17 O flip ATOM 1957 NE2 GLN A 129 13.001 4.015 0.876 1.00 1.31 N flip ATOM 0 H GLN A 129 8.509 2.445 3.308 1.00 0.24 H new ATOM 0 HA GLN A 129 9.069 1.102 0.821 1.00 0.27 H new ATOM 0 HB2 GLN A 129 10.686 1.886 3.247 1.00 0.32 H new ATOM 0 HB3 GLN A 129 11.363 0.828 2.024 1.00 0.32 H new ATOM 0 HG2 GLN A 129 11.007 2.528 0.296 1.00 0.42 H new ATOM 0 HG3 GLN A 129 10.203 3.574 1.450 1.00 0.42 H new ATOM 0 HE21 GLN A 129 12.668 4.090 -0.085 1.00 1.31 H new ATOM 0 HE22 GLN A 129 13.899 4.421 1.138 1.00 1.31 H new ATOM 1966 N GLU A 130 8.692 -0.628 3.572 1.00 0.37 N ATOM 1967 CA GLU A 130 8.425 -1.991 4.042 1.00 0.43 C ATOM 1968 C GLU A 130 7.407 -2.630 3.108 1.00 0.36 C ATOM 1969 O GLU A 130 7.498 -3.806 2.726 1.00 0.35 O ATOM 1970 CB GLU A 130 7.840 -1.978 5.457 1.00 0.61 C ATOM 1971 CG GLU A 130 8.466 -0.956 6.386 1.00 0.63 C ATOM 1972 CD GLU A 130 9.908 -1.259 6.727 1.00 1.04 C ATOM 1973 OE1 GLU A 130 10.799 -0.911 5.931 1.00 1.64 O ATOM 1974 OE2 GLU A 130 10.153 -1.837 7.803 1.00 1.63 O ATOM 0 H GLU A 130 8.512 0.101 4.262 1.00 0.37 H new ATOM 0 HA GLU A 130 9.361 -2.549 4.053 1.00 0.43 H new ATOM 0 HB2 GLU A 130 6.769 -1.784 5.392 1.00 0.61 H new ATOM 0 HB3 GLU A 130 7.958 -2.969 5.895 1.00 0.61 H new ATOM 0 HG2 GLU A 130 8.409 0.029 5.922 1.00 0.63 H new ATOM 0 HG3 GLU A 130 7.885 -0.909 7.307 1.00 0.63 H new ATOM 1981 N LEU A 131 6.454 -1.798 2.725 1.00 0.36 N ATOM 1982 CA LEU A 131 5.374 -2.172 1.850 1.00 0.37 C ATOM 1983 C LEU A 131 5.904 -2.612 0.499 1.00 0.29 C ATOM 1984 O LEU A 131 5.451 -3.609 -0.065 1.00 0.32 O ATOM 1985 CB LEU A 131 4.452 -0.964 1.712 1.00 0.49 C ATOM 1986 CG LEU A 131 3.097 -1.094 2.397 1.00 0.71 C ATOM 1987 CD1 LEU A 131 3.239 -1.685 3.779 1.00 1.36 C ATOM 1988 CD2 LEU A 131 2.457 0.264 2.511 1.00 1.18 C ATOM 0 H LEU A 131 6.415 -0.824 3.024 1.00 0.36 H new ATOM 0 HA LEU A 131 4.824 -3.017 2.264 1.00 0.37 H new ATOM 0 HB2 LEU A 131 4.963 -0.090 2.117 1.00 0.49 H new ATOM 0 HB3 LEU A 131 4.287 -0.773 0.652 1.00 0.49 H new ATOM 0 HG LEU A 131 2.476 -1.757 1.794 1.00 0.71 H new ATOM 0 HD11 LEU A 131 2.256 -1.766 4.243 1.00 1.36 H new ATOM 0 HD12 LEU A 131 3.688 -2.675 3.707 1.00 1.36 H new ATOM 0 HD13 LEU A 131 3.875 -1.041 4.386 1.00 1.36 H new ATOM 0 HD21 LEU A 131 1.488 0.170 3.001 1.00 1.18 H new ATOM 0 HD22 LEU A 131 3.099 0.920 3.099 1.00 1.18 H new ATOM 0 HD23 LEU A 131 2.320 0.687 1.516 1.00 1.18 H new ATOM 2000 N MET A 132 6.897 -1.898 -0.005 1.00 0.25 N ATOM 2001 CA MET A 132 7.423 -2.213 -1.315 1.00 0.26 C ATOM 2002 C MET A 132 8.434 -3.353 -1.253 1.00 0.30 C ATOM 2003 O MET A 132 8.838 -3.882 -2.286 1.00 0.37 O ATOM 2004 CB MET A 132 8.011 -0.977 -2.000 1.00 0.32 C ATOM 2005 CG MET A 132 9.278 -0.426 -1.364 1.00 0.88 C ATOM 2006 SD MET A 132 10.770 -1.095 -2.119 1.00 1.60 S ATOM 2007 CE MET A 132 10.515 -0.588 -3.819 1.00 1.61 C ATOM 0 H MET A 132 7.345 -1.112 0.465 1.00 0.25 H new ATOM 0 HA MET A 132 6.586 -2.553 -1.926 1.00 0.26 H new ATOM 0 HB2 MET A 132 8.223 -1.224 -3.040 1.00 0.32 H new ATOM 0 HB3 MET A 132 7.256 -0.191 -2.007 1.00 0.32 H new ATOM 0 HG2 MET A 132 9.284 0.660 -1.454 1.00 0.88 H new ATOM 0 HG3 MET A 132 9.277 -0.658 -0.299 1.00 0.88 H new ATOM 0 HE1 MET A 132 11.476 -0.356 -4.278 1.00 1.61 H new ATOM 0 HE2 MET A 132 10.035 -1.396 -4.371 1.00 1.61 H new ATOM 0 HE3 MET A 132 9.878 0.296 -3.843 1.00 1.61 H new ATOM 2017 N GLU A 133 8.821 -3.752 -0.047 1.00 0.32 N ATOM 2018 CA GLU A 133 9.631 -4.945 0.121 1.00 0.40 C ATOM 2019 C GLU A 133 8.768 -6.166 -0.129 1.00 0.38 C ATOM 2020 O GLU A 133 9.253 -7.218 -0.540 1.00 0.45 O ATOM 2021 CB GLU A 133 10.234 -5.011 1.517 1.00 0.54 C ATOM 2022 CG GLU A 133 11.301 -3.966 1.775 1.00 0.79 C ATOM 2023 CD GLU A 133 12.027 -4.197 3.082 1.00 1.07 C ATOM 2024 OE1 GLU A 133 12.993 -4.979 3.096 1.00 1.67 O ATOM 2025 OE2 GLU A 133 11.640 -3.583 4.101 1.00 1.53 O ATOM 0 H GLU A 133 8.588 -3.269 0.821 1.00 0.32 H new ATOM 0 HA GLU A 133 10.453 -4.915 -0.594 1.00 0.40 H new ATOM 0 HB2 GLU A 133 9.438 -4.892 2.252 1.00 0.54 H new ATOM 0 HB3 GLU A 133 10.664 -6.001 1.670 1.00 0.54 H new ATOM 0 HG2 GLU A 133 12.020 -3.975 0.956 1.00 0.79 H new ATOM 0 HG3 GLU A 133 10.843 -2.977 1.786 1.00 0.79 H new ATOM 2032 N TYR A 134 7.477 -6.014 0.131 1.00 0.35 N ATOM 2033 CA TYR A 134 6.507 -7.026 -0.242 1.00 0.40 C ATOM 2034 C TYR A 134 6.054 -6.812 -1.682 1.00 0.41 C ATOM 2035 O TYR A 134 5.053 -7.374 -2.137 1.00 0.50 O ATOM 2036 CB TYR A 134 5.343 -7.008 0.730 1.00 0.46 C ATOM 2037 CG TYR A 134 5.782 -7.306 2.141 1.00 0.55 C ATOM 2038 CD1 TYR A 134 6.508 -8.454 2.423 1.00 0.98 C ATOM 2039 CD2 TYR A 134 5.515 -6.427 3.178 1.00 0.88 C ATOM 2040 CE1 TYR A 134 6.948 -8.723 3.702 1.00 1.08 C ATOM 2041 CE2 TYR A 134 5.961 -6.684 4.456 1.00 0.95 C ATOM 2042 CZ TYR A 134 6.675 -7.834 4.712 1.00 0.80 C ATOM 2043 OH TYR A 134 7.130 -8.092 5.985 1.00 0.95 O ATOM 0 H TYR A 134 7.080 -5.199 0.599 1.00 0.35 H new ATOM 0 HA TYR A 134 6.967 -8.013 -0.188 1.00 0.40 H new ATOM 0 HB2 TYR A 134 4.860 -6.031 0.699 1.00 0.46 H new ATOM 0 HB3 TYR A 134 4.599 -7.742 0.419 1.00 0.46 H new ATOM 0 HD1 TYR A 134 6.732 -9.149 1.627 1.00 0.98 H new ATOM 0 HD2 TYR A 134 4.950 -5.528 2.982 1.00 0.88 H new ATOM 0 HE1 TYR A 134 7.503 -9.626 3.908 1.00 1.08 H new ATOM 0 HE2 TYR A 134 5.752 -5.987 5.254 1.00 0.95 H new ATOM 0 HH TYR A 134 6.855 -7.367 6.584 1.00 0.95 H new ATOM 2053 N ASN A 135 6.816 -5.972 -2.374 1.00 0.36 N ATOM 2054 CA ASN A 135 6.681 -5.726 -3.802 1.00 0.43 C ATOM 2055 C ASN A 135 5.327 -5.119 -4.142 1.00 0.48 C ATOM 2056 O ASN A 135 4.607 -5.574 -5.035 1.00 0.64 O ATOM 2057 CB ASN A 135 6.940 -7.013 -4.596 1.00 0.58 C ATOM 2058 CG ASN A 135 7.020 -6.791 -6.088 1.00 0.71 C ATOM 2059 OD1 ASN A 135 7.381 -5.711 -6.556 1.00 0.89 O ATOM 2060 ND2 ASN A 135 6.715 -7.824 -6.845 1.00 1.10 N ATOM 0 H ASN A 135 7.565 -5.429 -1.944 1.00 0.36 H new ATOM 0 HA ASN A 135 7.435 -4.994 -4.091 1.00 0.43 H new ATOM 0 HB2 ASN A 135 7.872 -7.462 -4.252 1.00 0.58 H new ATOM 0 HB3 ASN A 135 6.145 -7.728 -4.385 1.00 0.58 H new ATOM 0 HD21 ASN A 135 6.774 -7.747 -7.860 1.00 1.10 H new ATOM 0 HD22 ASN A 135 6.420 -8.701 -6.416 1.00 1.10 H new ATOM 2067 N LEU A 136 4.972 -4.103 -3.392 1.00 0.44 N ATOM 2068 CA LEU A 136 3.896 -3.238 -3.762 1.00 0.54 C ATOM 2069 C LEU A 136 4.434 -1.811 -3.753 1.00 0.41 C ATOM 2070 O LEU A 136 4.799 -1.265 -2.714 1.00 0.47 O ATOM 2071 CB LEU A 136 2.708 -3.464 -2.824 1.00 0.78 C ATOM 2072 CG LEU A 136 2.784 -2.841 -1.438 1.00 0.64 C ATOM 2073 CD1 LEU A 136 2.080 -1.505 -1.444 1.00 1.36 C ATOM 2074 CD2 LEU A 136 2.172 -3.765 -0.405 1.00 1.17 C ATOM 0 H LEU A 136 5.425 -3.860 -2.511 1.00 0.44 H new ATOM 0 HA LEU A 136 3.520 -3.447 -4.764 1.00 0.54 H new ATOM 0 HB2 LEU A 136 1.813 -3.084 -3.316 1.00 0.78 H new ATOM 0 HB3 LEU A 136 2.573 -4.539 -2.704 1.00 0.78 H new ATOM 0 HG LEU A 136 3.830 -2.688 -1.173 1.00 0.64 H new ATOM 0 HD11 LEU A 136 2.135 -1.060 -0.450 1.00 1.36 H new ATOM 0 HD12 LEU A 136 2.561 -0.844 -2.165 1.00 1.36 H new ATOM 0 HD13 LEU A 136 1.035 -1.646 -1.721 1.00 1.36 H new ATOM 0 HD21 LEU A 136 2.236 -3.303 0.580 1.00 1.17 H new ATOM 0 HD22 LEU A 136 1.126 -3.947 -0.654 1.00 1.17 H new ATOM 0 HD23 LEU A 136 2.713 -4.711 -0.397 1.00 1.17 H new ATOM 2086 N VAL A 137 4.548 -1.237 -4.931 1.00 0.31 N ATOM 2087 CA VAL A 137 5.289 0.000 -5.090 1.00 0.27 C ATOM 2088 C VAL A 137 4.362 1.185 -5.266 1.00 0.29 C ATOM 2089 O VAL A 137 3.435 1.149 -6.077 1.00 0.33 O ATOM 2090 CB VAL A 137 6.253 -0.060 -6.289 1.00 0.29 C ATOM 2091 CG1 VAL A 137 7.016 1.251 -6.424 1.00 0.43 C ATOM 2092 CG2 VAL A 137 7.211 -1.224 -6.149 1.00 0.41 C ATOM 0 H VAL A 137 4.140 -1.603 -5.791 1.00 0.31 H new ATOM 0 HA VAL A 137 5.868 0.127 -4.175 1.00 0.27 H new ATOM 0 HB VAL A 137 5.666 -0.212 -7.195 1.00 0.29 H new ATOM 0 HG11 VAL A 137 7.693 1.192 -7.276 1.00 0.43 H new ATOM 0 HG12 VAL A 137 6.311 2.068 -6.577 1.00 0.43 H new ATOM 0 HG13 VAL A 137 7.591 1.433 -5.516 1.00 0.43 H new ATOM 0 HG21 VAL A 137 7.883 -1.247 -7.007 1.00 0.41 H new ATOM 0 HG22 VAL A 137 7.793 -1.108 -5.235 1.00 0.41 H new ATOM 0 HG23 VAL A 137 6.647 -2.156 -6.104 1.00 0.41 H new ATOM 2102 N PRO A 138 4.594 2.226 -4.465 1.00 0.34 N ATOM 2103 CA PRO A 138 3.916 3.505 -4.565 1.00 0.43 C ATOM 2104 C PRO A 138 3.806 4.002 -5.984 1.00 0.43 C ATOM 2105 O PRO A 138 4.717 3.842 -6.801 1.00 0.45 O ATOM 2106 CB PRO A 138 4.819 4.439 -3.776 1.00 0.53 C ATOM 2107 CG PRO A 138 5.457 3.578 -2.755 1.00 0.54 C ATOM 2108 CD PRO A 138 5.519 2.197 -3.332 1.00 0.39 C ATOM 0 HA PRO A 138 2.891 3.440 -4.199 1.00 0.43 H new ATOM 0 HB2 PRO A 138 5.564 4.906 -4.420 1.00 0.53 H new ATOM 0 HB3 PRO A 138 4.248 5.244 -3.313 1.00 0.53 H new ATOM 0 HG2 PRO A 138 6.456 3.941 -2.512 1.00 0.54 H new ATOM 0 HG3 PRO A 138 4.882 3.585 -1.829 1.00 0.54 H new ATOM 0 HD2 PRO A 138 6.530 1.947 -3.653 1.00 0.39 H new ATOM 0 HD3 PRO A 138 5.223 1.448 -2.598 1.00 0.39 H new ATOM 2116 N GLU A 139 2.688 4.630 -6.247 1.00 0.48 N ATOM 2117 CA GLU A 139 2.439 5.251 -7.544 1.00 0.56 C ATOM 2118 C GLU A 139 3.375 6.429 -7.730 1.00 0.56 C ATOM 2119 O GLU A 139 3.814 6.730 -8.837 1.00 0.64 O ATOM 2120 CB GLU A 139 0.988 5.711 -7.672 1.00 0.71 C ATOM 2121 CG GLU A 139 0.026 4.585 -7.982 1.00 1.35 C ATOM 2122 CD GLU A 139 0.319 3.945 -9.315 1.00 2.40 C ATOM 2123 OE1 GLU A 139 1.135 3.001 -9.362 1.00 3.08 O ATOM 2124 OE2 GLU A 139 -0.268 4.377 -10.319 1.00 2.78 O ATOM 0 H GLU A 139 1.923 4.731 -5.580 1.00 0.48 H new ATOM 0 HA GLU A 139 2.623 4.508 -8.320 1.00 0.56 H new ATOM 0 HB2 GLU A 139 0.684 6.193 -6.743 1.00 0.71 H new ATOM 0 HB3 GLU A 139 0.921 6.463 -8.458 1.00 0.71 H new ATOM 0 HG2 GLU A 139 0.085 3.831 -7.197 1.00 1.35 H new ATOM 0 HG3 GLU A 139 -0.994 4.969 -7.980 1.00 1.35 H new ATOM 2131 N GLU A 140 3.690 7.073 -6.616 1.00 0.54 N ATOM 2132 CA GLU A 140 4.656 8.156 -6.589 1.00 0.60 C ATOM 2133 C GLU A 140 6.034 7.671 -7.038 1.00 0.56 C ATOM 2134 O GLU A 140 6.845 8.460 -7.520 1.00 0.65 O ATOM 2135 CB GLU A 140 4.736 8.780 -5.183 1.00 0.67 C ATOM 2136 CG GLU A 140 4.479 7.805 -4.046 1.00 0.63 C ATOM 2137 CD GLU A 140 3.002 7.625 -3.743 1.00 1.12 C ATOM 2138 OE1 GLU A 140 2.452 8.413 -2.947 1.00 1.27 O ATOM 2139 OE2 GLU A 140 2.386 6.698 -4.307 1.00 1.57 O ATOM 0 H GLU A 140 3.282 6.858 -5.706 1.00 0.54 H new ATOM 0 HA GLU A 140 4.321 8.922 -7.288 1.00 0.60 H new ATOM 0 HB2 GLU A 140 5.724 9.221 -5.051 1.00 0.67 H new ATOM 0 HB3 GLU A 140 4.013 9.593 -5.118 1.00 0.67 H new ATOM 0 HG2 GLU A 140 4.913 6.838 -4.299 1.00 0.63 H new ATOM 0 HG3 GLU A 140 4.988 8.158 -3.149 1.00 0.63 H new ATOM 2146 N TRP A 141 6.300 6.374 -6.884 1.00 0.47 N ATOM 2147 CA TRP A 141 7.579 5.810 -7.266 1.00 0.49 C ATOM 2148 C TRP A 141 7.471 5.065 -8.591 1.00 0.51 C ATOM 2149 O TRP A 141 8.474 4.641 -9.163 1.00 0.66 O ATOM 2150 CB TRP A 141 8.082 4.880 -6.184 1.00 0.45 C ATOM 2151 CG TRP A 141 8.198 5.516 -4.831 1.00 0.46 C ATOM 2152 CD1 TRP A 141 8.028 6.834 -4.514 1.00 0.54 C ATOM 2153 CD2 TRP A 141 8.501 4.851 -3.608 1.00 0.44 C ATOM 2154 NE1 TRP A 141 8.193 7.023 -3.167 1.00 0.55 N ATOM 2155 CE2 TRP A 141 8.487 5.818 -2.587 1.00 0.49 C ATOM 2156 CE3 TRP A 141 8.776 3.526 -3.283 1.00 0.45 C ATOM 2157 CZ2 TRP A 141 8.737 5.497 -1.257 1.00 0.52 C ATOM 2158 CZ3 TRP A 141 9.026 3.204 -1.963 1.00 0.50 C ATOM 2159 CH2 TRP A 141 9.003 4.185 -0.963 1.00 0.52 C ATOM 0 H TRP A 141 5.641 5.699 -6.496 1.00 0.47 H new ATOM 0 HA TRP A 141 8.289 6.627 -7.391 1.00 0.49 H new ATOM 0 HB2 TRP A 141 7.410 4.025 -6.114 1.00 0.45 H new ATOM 0 HB3 TRP A 141 9.059 4.495 -6.477 1.00 0.45 H new ATOM 0 HD1 TRP A 141 7.797 7.615 -5.223 1.00 0.54 H new ATOM 0 HE1 TRP A 141 8.110 7.914 -2.677 1.00 0.55 H new ATOM 0 HE3 TRP A 141 8.794 2.764 -4.048 1.00 0.45 H new ATOM 0 HZ2 TRP A 141 8.722 6.253 -0.485 1.00 0.52 H new ATOM 0 HZ3 TRP A 141 9.243 2.180 -1.698 1.00 0.50 H new ATOM 0 HH2 TRP A 141 9.199 3.902 0.061 1.00 0.52 H new ATOM 2170 N GLY A 142 6.243 4.899 -9.068 1.00 0.45 N ATOM 2171 CA GLY A 142 6.020 4.263 -10.352 1.00 0.50 C ATOM 2172 C GLY A 142 5.826 2.762 -10.250 1.00 0.45 C ATOM 2173 O GLY A 142 6.227 2.023 -11.145 1.00 0.53 O ATOM 0 H GLY A 142 5.394 5.195 -8.586 1.00 0.45 H new ATOM 0 HA2 GLY A 142 5.141 4.705 -10.821 1.00 0.50 H new ATOM 0 HA3 GLY A 142 6.868 4.470 -11.005 1.00 0.50 H new ATOM 2177 N GLY A 143 5.232 2.304 -9.156 1.00 0.39 N ATOM 2178 CA GLY A 143 4.922 0.892 -9.029 1.00 0.41 C ATOM 2179 C GLY A 143 3.524 0.574 -9.501 1.00 0.45 C ATOM 2180 O GLY A 143 3.249 0.616 -10.700 1.00 0.60 O ATOM 0 H GLY A 143 4.961 2.880 -8.359 1.00 0.39 H new ATOM 0 HA2 GLY A 143 5.640 0.310 -9.606 1.00 0.41 H new ATOM 0 HA3 GLY A 143 5.030 0.590 -7.987 1.00 0.41 H new ATOM 2184 N ASP A 144 2.642 0.253 -8.561 1.00 0.40 N ATOM 2185 CA ASP A 144 1.232 0.050 -8.879 1.00 0.45 C ATOM 2186 C ASP A 144 0.397 0.001 -7.601 1.00 0.33 C ATOM 2187 O ASP A 144 -0.236 -1.021 -7.253 1.00 0.35 O ATOM 2188 CB ASP A 144 1.029 -1.220 -9.698 1.00 0.64 C ATOM 2189 CG ASP A 144 -0.286 -1.232 -10.453 1.00 1.33 C ATOM 2190 OD1 ASP A 144 -0.340 -0.673 -11.568 1.00 1.91 O ATOM 2191 OD2 ASP A 144 -1.266 -1.825 -9.957 1.00 1.91 O ATOM 0 H ASP A 144 2.876 0.128 -7.576 1.00 0.40 H new ATOM 0 HA ASP A 144 0.899 0.895 -9.481 1.00 0.45 H new ATOM 0 HB2 ASP A 144 1.850 -1.324 -10.407 1.00 0.64 H new ATOM 0 HB3 ASP A 144 1.069 -2.084 -9.035 1.00 0.64 H new ATOM 2196 N THR A 145 0.400 1.120 -6.902 1.00 0.26 N ATOM 2197 CA THR A 145 -0.313 1.256 -5.648 1.00 0.24 C ATOM 2198 C THR A 145 -0.443 2.723 -5.266 1.00 0.27 C ATOM 2199 O THR A 145 0.561 3.391 -5.020 1.00 0.37 O ATOM 2200 CB THR A 145 0.404 0.513 -4.502 1.00 0.25 C ATOM 2201 OG1 THR A 145 0.452 -0.898 -4.762 1.00 0.30 O ATOM 2202 CG2 THR A 145 -0.300 0.771 -3.181 1.00 0.30 C ATOM 0 H THR A 145 0.899 1.962 -7.189 1.00 0.26 H new ATOM 0 HA THR A 145 -1.300 0.816 -5.794 1.00 0.24 H new ATOM 0 HB THR A 145 1.425 0.891 -4.440 1.00 0.25 H new ATOM 0 HG1 THR A 145 -0.135 -1.112 -5.517 1.00 0.30 H new ATOM 0 HG21 THR A 145 0.218 0.240 -2.383 1.00 0.30 H new ATOM 0 HG22 THR A 145 -0.295 1.840 -2.969 1.00 0.30 H new ATOM 0 HG23 THR A 145 -1.330 0.419 -3.243 1.00 0.30 H new ATOM 2210 N ILE A 146 -1.666 3.230 -5.220 1.00 0.26 N ATOM 2211 CA ILE A 146 -1.884 4.575 -4.742 1.00 0.28 C ATOM 2212 C ILE A 146 -1.647 4.616 -3.240 1.00 0.23 C ATOM 2213 O ILE A 146 -2.446 4.109 -2.449 1.00 0.24 O ATOM 2214 CB ILE A 146 -3.303 5.084 -5.078 1.00 0.36 C ATOM 2215 CG1 ILE A 146 -3.430 5.390 -6.573 1.00 0.53 C ATOM 2216 CG2 ILE A 146 -3.642 6.311 -4.251 1.00 0.34 C ATOM 2217 CD1 ILE A 146 -2.583 6.562 -7.026 1.00 0.63 C ATOM 0 H ILE A 146 -2.509 2.733 -5.505 1.00 0.26 H new ATOM 0 HA ILE A 146 -1.180 5.236 -5.247 1.00 0.28 H new ATOM 0 HB ILE A 146 -4.014 4.296 -4.830 1.00 0.36 H new ATOM 0 HG12 ILE A 146 -3.145 4.505 -7.142 1.00 0.53 H new ATOM 0 HG13 ILE A 146 -4.475 5.596 -6.806 1.00 0.53 H new ATOM 0 HG21 ILE A 146 -4.646 6.654 -4.503 1.00 0.34 H new ATOM 0 HG22 ILE A 146 -3.600 6.059 -3.191 1.00 0.34 H new ATOM 0 HG23 ILE A 146 -2.924 7.103 -4.464 1.00 0.34 H new ATOM 0 HD11 ILE A 146 -2.723 6.721 -8.095 1.00 0.63 H new ATOM 0 HD12 ILE A 146 -2.883 7.459 -6.484 1.00 0.63 H new ATOM 0 HD13 ILE A 146 -1.533 6.351 -6.825 1.00 0.63 H new ATOM 2229 N PHE A 147 -0.511 5.165 -2.866 1.00 0.25 N ATOM 2230 CA PHE A 147 -0.144 5.303 -1.471 1.00 0.30 C ATOM 2231 C PHE A 147 -0.693 6.589 -0.881 1.00 0.32 C ATOM 2232 O PHE A 147 -0.282 7.685 -1.257 1.00 0.50 O ATOM 2233 CB PHE A 147 1.365 5.312 -1.322 1.00 0.41 C ATOM 2234 CG PHE A 147 1.976 3.965 -1.113 1.00 0.33 C ATOM 2235 CD1 PHE A 147 1.978 3.036 -2.128 1.00 0.32 C ATOM 2236 CD2 PHE A 147 2.565 3.636 0.096 1.00 0.37 C ATOM 2237 CE1 PHE A 147 2.553 1.800 -1.949 1.00 0.33 C ATOM 2238 CE2 PHE A 147 3.146 2.401 0.280 1.00 0.36 C ATOM 2239 CZ PHE A 147 3.141 1.481 -0.744 1.00 0.33 C ATOM 0 H PHE A 147 0.184 5.528 -3.519 1.00 0.25 H new ATOM 0 HA PHE A 147 -0.570 4.453 -0.938 1.00 0.30 H new ATOM 0 HB2 PHE A 147 1.803 5.761 -2.214 1.00 0.41 H new ATOM 0 HB3 PHE A 147 1.630 5.952 -0.480 1.00 0.41 H new ATOM 0 HD1 PHE A 147 1.523 3.281 -3.076 1.00 0.32 H new ATOM 0 HD2 PHE A 147 2.569 4.355 0.902 1.00 0.37 H new ATOM 0 HE1 PHE A 147 2.544 1.079 -2.753 1.00 0.33 H new ATOM 0 HE2 PHE A 147 3.605 2.155 1.226 1.00 0.36 H new ATOM 0 HZ PHE A 147 3.597 0.512 -0.604 1.00 0.33 H new ATOM 2249 N CYS A 148 -1.616 6.445 0.040 1.00 0.26 N ATOM 2250 CA CYS A 148 -2.165 7.571 0.768 1.00 0.27 C ATOM 2251 C CYS A 148 -1.533 7.649 2.153 1.00 0.31 C ATOM 2252 O CYS A 148 -1.354 6.630 2.813 1.00 0.53 O ATOM 2253 CB CYS A 148 -3.677 7.416 0.885 1.00 0.30 C ATOM 2254 SG CYS A 148 -4.526 7.252 -0.702 1.00 0.68 S ATOM 0 H CYS A 148 -2.010 5.543 0.308 1.00 0.26 H new ATOM 0 HA CYS A 148 -1.944 8.493 0.230 1.00 0.27 H new ATOM 0 HB2 CYS A 148 -3.896 6.539 1.494 1.00 0.30 H new ATOM 0 HB3 CYS A 148 -4.080 8.280 1.413 1.00 0.30 H new ATOM 0 HG CYS A 148 -5.521 8.088 -0.750 1.00 0.68 H new ATOM 2260 N LYS A 149 -1.171 8.849 2.580 1.00 0.29 N ATOM 2261 CA LYS A 149 -0.612 9.049 3.910 1.00 0.28 C ATOM 2262 C LYS A 149 -1.601 9.831 4.756 1.00 0.28 C ATOM 2263 O LYS A 149 -1.718 11.047 4.622 1.00 0.40 O ATOM 2264 CB LYS A 149 0.721 9.807 3.846 1.00 0.36 C ATOM 2265 CG LYS A 149 1.781 9.157 2.960 1.00 0.56 C ATOM 2266 CD LYS A 149 1.689 9.639 1.520 1.00 0.89 C ATOM 2267 CE LYS A 149 2.885 9.179 0.700 1.00 1.01 C ATOM 2268 NZ LYS A 149 2.877 9.748 -0.677 1.00 1.44 N ATOM 0 H LYS A 149 -1.254 9.701 2.025 1.00 0.29 H new ATOM 0 HA LYS A 149 -0.425 8.072 4.356 1.00 0.28 H new ATOM 0 HB2 LYS A 149 0.532 10.817 3.482 1.00 0.36 H new ATOM 0 HB3 LYS A 149 1.119 9.901 4.856 1.00 0.36 H new ATOM 0 HG2 LYS A 149 2.772 9.381 3.355 1.00 0.56 H new ATOM 0 HG3 LYS A 149 1.664 8.074 2.989 1.00 0.56 H new ATOM 0 HD2 LYS A 149 0.771 9.264 1.068 1.00 0.89 H new ATOM 0 HD3 LYS A 149 1.632 10.727 1.503 1.00 0.89 H new ATOM 0 HE2 LYS A 149 3.805 9.472 1.207 1.00 1.01 H new ATOM 0 HE3 LYS A 149 2.886 8.091 0.641 1.00 1.01 H new ATOM 0 HZ1 LYS A 149 2.451 9.063 -1.333 1.00 1.44 H new ATOM 0 HZ2 LYS A 149 2.322 10.627 -0.686 1.00 1.44 H new ATOM 0 HZ3 LYS A 149 3.853 9.952 -0.974 1.00 1.44 H new ATOM 2282 N LEU A 150 -2.326 9.136 5.619 1.00 0.21 N ATOM 2283 CA LEU A 150 -3.375 9.764 6.379 1.00 0.22 C ATOM 2284 C LEU A 150 -3.224 9.508 7.869 1.00 0.19 C ATOM 2285 O LEU A 150 -2.225 8.987 8.355 1.00 0.17 O ATOM 2286 CB LEU A 150 -4.749 9.269 5.902 1.00 0.25 C ATOM 2287 CG LEU A 150 -5.052 7.783 6.065 1.00 0.26 C ATOM 2288 CD1 LEU A 150 -5.814 7.498 7.348 1.00 0.79 C ATOM 2289 CD2 LEU A 150 -5.820 7.264 4.860 1.00 0.84 C ATOM 0 H LEU A 150 -2.202 8.141 5.804 1.00 0.21 H new ATOM 0 HA LEU A 150 -3.298 10.839 6.214 1.00 0.22 H new ATOM 0 HB2 LEU A 150 -5.514 9.830 6.438 1.00 0.25 H new ATOM 0 HB3 LEU A 150 -4.850 9.520 4.846 1.00 0.25 H new ATOM 0 HG LEU A 150 -4.099 7.258 6.130 1.00 0.26 H new ATOM 0 HD11 LEU A 150 -6.010 6.428 7.425 1.00 0.79 H new ATOM 0 HD12 LEU A 150 -5.220 7.821 8.203 1.00 0.79 H new ATOM 0 HD13 LEU A 150 -6.760 8.040 7.338 1.00 0.79 H new ATOM 0 HD21 LEU A 150 -6.029 6.202 4.991 1.00 0.84 H new ATOM 0 HD22 LEU A 150 -6.759 7.809 4.765 1.00 0.84 H new ATOM 0 HD23 LEU A 150 -5.224 7.408 3.959 1.00 0.84 H new ATOM 2301 N SER A 151 -4.259 9.884 8.562 1.00 0.26 N ATOM 2302 CA SER A 151 -4.423 9.643 9.970 1.00 0.29 C ATOM 2303 C SER A 151 -5.875 9.878 10.257 1.00 0.25 C ATOM 2304 O SER A 151 -6.341 11.016 10.218 1.00 0.29 O ATOM 2305 CB SER A 151 -3.570 10.554 10.830 1.00 0.46 C ATOM 2306 OG SER A 151 -3.102 9.837 11.948 1.00 1.77 O ATOM 0 H SER A 151 -5.044 10.387 8.148 1.00 0.26 H new ATOM 0 HA SER A 151 -4.103 8.629 10.211 1.00 0.29 H new ATOM 0 HB2 SER A 151 -2.729 10.937 10.251 1.00 0.46 H new ATOM 0 HB3 SER A 151 -4.152 11.416 11.155 1.00 0.46 H new ATOM 0 HG SER A 151 -3.442 10.252 12.768 1.00 1.77 H new ATOM 2312 N ALA A 152 -6.606 8.811 10.483 1.00 0.28 N ATOM 2313 CA ALA A 152 -8.028 8.936 10.749 1.00 0.31 C ATOM 2314 C ALA A 152 -8.224 9.642 12.070 1.00 0.33 C ATOM 2315 O ALA A 152 -9.307 10.123 12.389 1.00 0.41 O ATOM 2316 CB ALA A 152 -8.697 7.585 10.741 1.00 0.41 C ATOM 0 H ALA A 152 -6.249 7.856 10.489 1.00 0.28 H new ATOM 0 HA ALA A 152 -8.494 9.527 9.961 1.00 0.31 H new ATOM 0 HB1 ALA A 152 -9.761 7.705 10.943 1.00 0.41 H new ATOM 0 HB2 ALA A 152 -8.563 7.118 9.765 1.00 0.41 H new ATOM 0 HB3 ALA A 152 -8.251 6.954 11.509 1.00 0.41 H new ATOM 2322 N LYS A 153 -7.140 9.689 12.826 1.00 0.30 N ATOM 2323 CA LYS A 153 -7.078 10.483 14.030 1.00 0.34 C ATOM 2324 C LYS A 153 -7.246 11.967 13.701 1.00 0.36 C ATOM 2325 O LYS A 153 -8.145 12.622 14.223 1.00 0.49 O ATOM 2326 CB LYS A 153 -5.744 10.251 14.704 1.00 0.35 C ATOM 2327 CG LYS A 153 -5.803 10.184 16.213 1.00 0.60 C ATOM 2328 CD LYS A 153 -6.244 11.501 16.828 1.00 1.12 C ATOM 2329 CE LYS A 153 -5.757 11.632 18.258 1.00 1.65 C ATOM 2330 NZ LYS A 153 -4.283 11.795 18.317 1.00 2.30 N ATOM 0 H LYS A 153 -6.283 9.177 12.618 1.00 0.30 H new ATOM 0 HA LYS A 153 -7.886 10.187 14.699 1.00 0.34 H new ATOM 0 HB2 LYS A 153 -5.320 9.320 14.329 1.00 0.35 H new ATOM 0 HB3 LYS A 153 -5.062 11.051 14.416 1.00 0.35 H new ATOM 0 HG2 LYS A 153 -6.493 9.395 16.513 1.00 0.60 H new ATOM 0 HG3 LYS A 153 -4.821 9.914 16.602 1.00 0.60 H new ATOM 0 HD2 LYS A 153 -5.859 12.329 16.233 1.00 1.12 H new ATOM 0 HD3 LYS A 153 -7.332 11.570 16.804 1.00 1.12 H new ATOM 0 HE2 LYS A 153 -6.238 12.488 18.730 1.00 1.65 H new ATOM 0 HE3 LYS A 153 -6.050 10.749 18.826 1.00 1.65 H new ATOM 0 HZ1 LYS A 153 -3.895 11.179 19.060 1.00 2.30 H new ATOM 0 HZ2 LYS A 153 -3.868 11.534 17.400 1.00 2.30 H new ATOM 0 HZ3 LYS A 153 -4.052 12.786 18.533 1.00 2.30 H new ATOM 2344 N THR A 154 -6.392 12.492 12.818 1.00 0.30 N ATOM 2345 CA THR A 154 -6.440 13.910 12.489 1.00 0.39 C ATOM 2346 C THR A 154 -7.468 14.220 11.408 1.00 0.36 C ATOM 2347 O THR A 154 -7.772 15.385 11.137 1.00 0.41 O ATOM 2348 CB THR A 154 -5.060 14.429 12.065 1.00 0.47 C ATOM 2349 OG1 THR A 154 -4.358 13.408 11.341 1.00 0.50 O ATOM 2350 CG2 THR A 154 -4.247 14.858 13.276 1.00 0.70 C ATOM 0 H THR A 154 -5.671 11.962 12.327 1.00 0.30 H new ATOM 0 HA THR A 154 -6.748 14.426 13.398 1.00 0.39 H new ATOM 0 HB THR A 154 -5.201 15.298 11.422 1.00 0.47 H new ATOM 0 HG1 THR A 154 -3.586 13.803 10.884 1.00 0.50 H new ATOM 0 HG21 THR A 154 -3.273 15.222 12.950 1.00 0.70 H new ATOM 0 HG22 THR A 154 -4.773 15.653 13.804 1.00 0.70 H new ATOM 0 HG23 THR A 154 -4.111 14.007 13.943 1.00 0.70 H new ATOM 2358 N LYS A 155 -7.990 13.158 10.793 1.00 0.30 N ATOM 2359 CA LYS A 155 -9.044 13.264 9.786 1.00 0.32 C ATOM 2360 C LYS A 155 -8.560 14.055 8.590 1.00 0.34 C ATOM 2361 O LYS A 155 -9.198 15.008 8.148 1.00 0.41 O ATOM 2362 CB LYS A 155 -10.306 13.902 10.362 1.00 0.38 C ATOM 2363 CG LYS A 155 -11.128 12.954 11.208 1.00 0.40 C ATOM 2364 CD LYS A 155 -11.510 11.713 10.420 1.00 0.45 C ATOM 2365 CE LYS A 155 -12.616 10.941 11.119 1.00 0.61 C ATOM 2366 NZ LYS A 155 -13.808 11.794 11.375 1.00 1.36 N ATOM 0 H LYS A 155 -7.693 12.200 10.980 1.00 0.30 H new ATOM 0 HA LYS A 155 -9.294 12.253 9.465 1.00 0.32 H new ATOM 0 HB2 LYS A 155 -10.025 14.765 10.966 1.00 0.38 H new ATOM 0 HB3 LYS A 155 -10.922 14.273 9.543 1.00 0.38 H new ATOM 0 HG2 LYS A 155 -10.561 12.667 12.094 1.00 0.40 H new ATOM 0 HG3 LYS A 155 -12.029 13.460 11.556 1.00 0.40 H new ATOM 0 HD2 LYS A 155 -11.838 11.999 9.421 1.00 0.45 H new ATOM 0 HD3 LYS A 155 -10.636 11.073 10.298 1.00 0.45 H new ATOM 0 HE2 LYS A 155 -12.905 10.086 10.508 1.00 0.61 H new ATOM 0 HE3 LYS A 155 -12.242 10.545 12.063 1.00 0.61 H new ATOM 0 HZ1 LYS A 155 -14.657 11.196 11.429 1.00 1.36 H new ATOM 0 HZ2 LYS A 155 -13.684 12.302 12.274 1.00 1.36 H new ATOM 0 HZ3 LYS A 155 -13.916 12.480 10.601 1.00 1.36 H new ATOM 2380 N GLU A 156 -7.427 13.644 8.073 1.00 0.30 N ATOM 2381 CA GLU A 156 -6.822 14.336 6.940 1.00 0.33 C ATOM 2382 C GLU A 156 -6.917 13.489 5.684 1.00 0.28 C ATOM 2383 O GLU A 156 -7.621 13.815 4.723 1.00 0.30 O ATOM 2384 CB GLU A 156 -5.353 14.634 7.235 1.00 0.40 C ATOM 2385 CG GLU A 156 -5.120 15.129 8.647 1.00 1.30 C ATOM 2386 CD GLU A 156 -3.670 15.452 8.925 1.00 1.70 C ATOM 2387 OE1 GLU A 156 -3.253 16.594 8.646 1.00 1.52 O ATOM 2388 OE2 GLU A 156 -2.950 14.571 9.446 1.00 2.48 O ATOM 0 H GLU A 156 -6.901 12.838 8.411 1.00 0.30 H new ATOM 0 HA GLU A 156 -7.362 15.269 6.781 1.00 0.33 H new ATOM 0 HB2 GLU A 156 -4.765 13.731 7.071 1.00 0.40 H new ATOM 0 HB3 GLU A 156 -4.991 15.382 6.530 1.00 0.40 H new ATOM 0 HG2 GLU A 156 -5.725 16.019 8.819 1.00 1.30 H new ATOM 0 HG3 GLU A 156 -5.460 14.371 9.353 1.00 1.30 H new ATOM 2395 N GLY A 157 -6.215 12.377 5.726 1.00 0.29 N ATOM 2396 CA GLY A 157 -6.081 11.537 4.570 1.00 0.28 C ATOM 2397 C GLY A 157 -7.341 10.776 4.206 1.00 0.27 C ATOM 2398 O GLY A 157 -7.385 10.151 3.158 1.00 0.29 O ATOM 0 H GLY A 157 -5.728 12.038 6.556 1.00 0.29 H new ATOM 0 HA2 GLY A 157 -5.783 12.152 3.721 1.00 0.28 H new ATOM 0 HA3 GLY A 157 -5.276 10.823 4.745 1.00 0.28 H new ATOM 2402 N LEU A 158 -8.362 10.804 5.066 1.00 0.26 N ATOM 2403 CA LEU A 158 -9.605 10.107 4.765 1.00 0.28 C ATOM 2404 C LEU A 158 -10.349 10.854 3.676 1.00 0.30 C ATOM 2405 O LEU A 158 -10.922 10.250 2.769 1.00 0.33 O ATOM 2406 CB LEU A 158 -10.474 9.970 6.015 1.00 0.31 C ATOM 2407 CG LEU A 158 -9.956 8.991 7.072 1.00 0.47 C ATOM 2408 CD1 LEU A 158 -10.934 8.893 8.228 1.00 0.73 C ATOM 2409 CD2 LEU A 158 -9.715 7.620 6.459 1.00 0.80 C ATOM 0 H LEU A 158 -8.350 11.294 5.960 1.00 0.26 H new ATOM 0 HA LEU A 158 -9.370 9.101 4.416 1.00 0.28 H new ATOM 0 HB2 LEU A 158 -10.577 10.953 6.474 1.00 0.31 H new ATOM 0 HB3 LEU A 158 -11.472 9.654 5.710 1.00 0.31 H new ATOM 0 HG LEU A 158 -9.007 9.367 7.454 1.00 0.47 H new ATOM 0 HD11 LEU A 158 -10.551 8.193 8.970 1.00 0.73 H new ATOM 0 HD12 LEU A 158 -11.057 9.875 8.685 1.00 0.73 H new ATOM 0 HD13 LEU A 158 -11.898 8.540 7.860 1.00 0.73 H new ATOM 0 HD21 LEU A 158 -9.347 6.938 7.226 1.00 0.80 H new ATOM 0 HD22 LEU A 158 -10.649 7.235 6.049 1.00 0.80 H new ATOM 0 HD23 LEU A 158 -8.976 7.703 5.662 1.00 0.80 H new ATOM 2421 N ASP A 159 -10.312 12.179 3.764 1.00 0.32 N ATOM 2422 CA ASP A 159 -10.850 13.021 2.708 1.00 0.38 C ATOM 2423 C ASP A 159 -10.054 12.804 1.430 1.00 0.32 C ATOM 2424 O ASP A 159 -10.616 12.630 0.349 1.00 0.33 O ATOM 2425 CB ASP A 159 -10.811 14.508 3.095 1.00 0.50 C ATOM 2426 CG ASP A 159 -11.792 14.867 4.194 1.00 1.25 C ATOM 2427 OD1 ASP A 159 -12.981 15.092 3.894 1.00 1.42 O ATOM 2428 OD2 ASP A 159 -11.376 14.935 5.371 1.00 2.20 O ATOM 0 H ASP A 159 -9.916 12.689 4.553 1.00 0.32 H new ATOM 0 HA ASP A 159 -11.892 12.742 2.551 1.00 0.38 H new ATOM 0 HB2 ASP A 159 -9.803 14.766 3.419 1.00 0.50 H new ATOM 0 HB3 ASP A 159 -11.027 15.112 2.213 1.00 0.50 H new ATOM 2433 N HIS A 160 -8.731 12.772 1.564 1.00 0.30 N ATOM 2434 CA HIS A 160 -7.858 12.582 0.415 1.00 0.30 C ATOM 2435 C HIS A 160 -7.933 11.144 -0.112 1.00 0.28 C ATOM 2436 O HIS A 160 -7.524 10.862 -1.240 1.00 0.33 O ATOM 2437 CB HIS A 160 -6.422 12.945 0.792 1.00 0.34 C ATOM 2438 CG HIS A 160 -5.447 12.835 -0.340 1.00 0.41 C ATOM 2439 ND1 HIS A 160 -5.548 13.573 -1.496 1.00 0.52 N ATOM 2440 CD2 HIS A 160 -4.356 12.055 -0.486 1.00 0.46 C ATOM 2441 CE1 HIS A 160 -4.558 13.253 -2.308 1.00 0.58 C ATOM 2442 NE2 HIS A 160 -3.819 12.332 -1.718 1.00 0.54 N ATOM 0 H HIS A 160 -8.244 12.875 2.454 1.00 0.30 H new ATOM 0 HA HIS A 160 -8.194 13.241 -0.386 1.00 0.30 H new ATOM 0 HB2 HIS A 160 -6.405 13.966 1.174 1.00 0.34 H new ATOM 0 HB3 HIS A 160 -6.095 12.295 1.604 1.00 0.34 H new ATOM 0 HD1 HIS A 160 -6.275 14.261 -1.695 1.00 0.52 H new ATOM 0 HD2 HIS A 160 -3.976 11.345 0.233 1.00 0.46 H new ATOM 0 HE1 HIS A 160 -4.383 13.673 -3.287 1.00 0.58 H new ATOM 2451 N LEU A 161 -8.478 10.246 0.698 1.00 0.27 N ATOM 2452 CA LEU A 161 -8.578 8.842 0.329 1.00 0.28 C ATOM 2453 C LEU A 161 -9.619 8.674 -0.758 1.00 0.29 C ATOM 2454 O LEU A 161 -9.346 8.117 -1.822 1.00 0.31 O ATOM 2455 CB LEU A 161 -8.959 7.993 1.541 1.00 0.29 C ATOM 2456 CG LEU A 161 -8.952 6.480 1.314 1.00 0.57 C ATOM 2457 CD1 LEU A 161 -7.556 5.998 0.949 1.00 1.15 C ATOM 2458 CD2 LEU A 161 -9.465 5.754 2.546 1.00 1.16 C ATOM 0 H LEU A 161 -8.859 10.467 1.618 1.00 0.27 H new ATOM 0 HA LEU A 161 -7.608 8.509 -0.039 1.00 0.28 H new ATOM 0 HB2 LEU A 161 -8.272 8.224 2.355 1.00 0.29 H new ATOM 0 HB3 LEU A 161 -9.955 8.289 1.871 1.00 0.29 H new ATOM 0 HG LEU A 161 -9.618 6.255 0.481 1.00 0.57 H new ATOM 0 HD11 LEU A 161 -7.573 4.920 0.792 1.00 1.15 H new ATOM 0 HD12 LEU A 161 -7.228 6.493 0.035 1.00 1.15 H new ATOM 0 HD13 LEU A 161 -6.866 6.236 1.758 1.00 1.15 H new ATOM 0 HD21 LEU A 161 -9.453 4.679 2.366 1.00 1.16 H new ATOM 0 HD22 LEU A 161 -8.826 5.987 3.398 1.00 1.16 H new ATOM 0 HD23 LEU A 161 -10.485 6.075 2.759 1.00 1.16 H new ATOM 2470 N LEU A 162 -10.806 9.187 -0.486 1.00 0.31 N ATOM 2471 CA LEU A 162 -11.904 9.124 -1.428 1.00 0.37 C ATOM 2472 C LEU A 162 -11.561 9.893 -2.705 1.00 0.38 C ATOM 2473 O LEU A 162 -12.058 9.565 -3.778 1.00 0.45 O ATOM 2474 CB LEU A 162 -13.190 9.644 -0.767 1.00 0.47 C ATOM 2475 CG LEU A 162 -13.153 11.083 -0.231 1.00 0.85 C ATOM 2476 CD1 LEU A 162 -13.485 12.083 -1.328 1.00 1.49 C ATOM 2477 CD2 LEU A 162 -14.107 11.235 0.946 1.00 1.51 C ATOM 0 H LEU A 162 -11.033 9.656 0.391 1.00 0.31 H new ATOM 0 HA LEU A 162 -12.075 8.087 -1.716 1.00 0.37 H new ATOM 0 HB2 LEU A 162 -14.000 9.571 -1.493 1.00 0.47 H new ATOM 0 HB3 LEU A 162 -13.442 8.979 0.059 1.00 0.47 H new ATOM 0 HG LEU A 162 -12.141 11.292 0.115 1.00 0.85 H new ATOM 0 HD11 LEU A 162 -13.452 13.094 -0.921 1.00 1.49 H new ATOM 0 HD12 LEU A 162 -12.758 11.992 -2.135 1.00 1.49 H new ATOM 0 HD13 LEU A 162 -14.484 11.880 -1.715 1.00 1.49 H new ATOM 0 HD21 LEU A 162 -14.069 12.260 1.315 1.00 1.51 H new ATOM 0 HD22 LEU A 162 -15.122 11.002 0.624 1.00 1.51 H new ATOM 0 HD23 LEU A 162 -13.813 10.552 1.743 1.00 1.51 H new ATOM 2489 N GLU A 163 -10.697 10.902 -2.587 1.00 0.37 N ATOM 2490 CA GLU A 163 -10.203 11.625 -3.756 1.00 0.44 C ATOM 2491 C GLU A 163 -9.425 10.683 -4.665 1.00 0.41 C ATOM 2492 O GLU A 163 -9.657 10.629 -5.873 1.00 0.50 O ATOM 2493 CB GLU A 163 -9.295 12.786 -3.345 1.00 0.56 C ATOM 2494 CG GLU A 163 -9.963 13.814 -2.453 1.00 1.03 C ATOM 2495 CD GLU A 163 -9.052 14.989 -2.153 1.00 1.78 C ATOM 2496 OE1 GLU A 163 -7.861 14.765 -1.852 1.00 2.57 O ATOM 2497 OE2 GLU A 163 -9.519 16.141 -2.241 1.00 2.14 O ATOM 0 H GLU A 163 -10.327 11.235 -1.697 1.00 0.37 H new ATOM 0 HA GLU A 163 -11.066 12.025 -4.288 1.00 0.44 H new ATOM 0 HB2 GLU A 163 -8.423 12.385 -2.828 1.00 0.56 H new ATOM 0 HB3 GLU A 163 -8.931 13.284 -4.244 1.00 0.56 H new ATOM 0 HG2 GLU A 163 -10.872 14.175 -2.934 1.00 1.03 H new ATOM 0 HG3 GLU A 163 -10.263 13.341 -1.518 1.00 1.03 H new ATOM 2504 N MET A 164 -8.505 9.929 -4.069 1.00 0.37 N ATOM 2505 CA MET A 164 -7.668 8.998 -4.818 1.00 0.39 C ATOM 2506 C MET A 164 -8.503 7.849 -5.363 1.00 0.37 C ATOM 2507 O MET A 164 -8.339 7.440 -6.513 1.00 0.43 O ATOM 2508 CB MET A 164 -6.543 8.455 -3.938 1.00 0.43 C ATOM 2509 CG MET A 164 -5.567 9.513 -3.438 1.00 0.64 C ATOM 2510 SD MET A 164 -4.555 10.247 -4.747 1.00 0.58 S ATOM 2511 CE MET A 164 -5.687 11.431 -5.478 1.00 0.53 C ATOM 0 H MET A 164 -8.320 9.945 -3.066 1.00 0.37 H new ATOM 0 HA MET A 164 -7.226 9.539 -5.655 1.00 0.39 H new ATOM 0 HB2 MET A 164 -6.983 7.949 -3.079 1.00 0.43 H new ATOM 0 HB3 MET A 164 -5.989 7.704 -4.501 1.00 0.43 H new ATOM 0 HG2 MET A 164 -6.127 10.303 -2.938 1.00 0.64 H new ATOM 0 HG3 MET A 164 -4.911 9.065 -2.692 1.00 0.64 H new ATOM 0 HE1 MET A 164 -5.171 12.378 -5.636 1.00 0.53 H new ATOM 0 HE2 MET A 164 -6.045 11.049 -6.434 1.00 0.53 H new ATOM 0 HE3 MET A 164 -6.533 11.586 -4.809 1.00 0.53 H new ATOM 2521 N ILE A 165 -9.398 7.338 -4.531 1.00 0.34 N ATOM 2522 CA ILE A 165 -10.310 6.276 -4.939 1.00 0.38 C ATOM 2523 C ILE A 165 -11.169 6.729 -6.119 1.00 0.44 C ATOM 2524 O ILE A 165 -11.397 5.974 -7.062 1.00 0.52 O ATOM 2525 CB ILE A 165 -11.228 5.853 -3.775 1.00 0.40 C ATOM 2526 CG1 ILE A 165 -10.399 5.254 -2.634 1.00 0.42 C ATOM 2527 CG2 ILE A 165 -12.279 4.862 -4.256 1.00 0.50 C ATOM 2528 CD1 ILE A 165 -11.219 4.892 -1.413 1.00 0.50 C ATOM 0 H ILE A 165 -9.514 7.642 -3.564 1.00 0.34 H new ATOM 0 HA ILE A 165 -9.704 5.421 -5.238 1.00 0.38 H new ATOM 0 HB ILE A 165 -11.742 6.737 -3.399 1.00 0.40 H new ATOM 0 HG12 ILE A 165 -9.889 4.361 -2.996 1.00 0.42 H new ATOM 0 HG13 ILE A 165 -9.627 5.967 -2.344 1.00 0.42 H new ATOM 0 HG21 ILE A 165 -12.918 4.575 -3.421 1.00 0.50 H new ATOM 0 HG22 ILE A 165 -12.886 5.324 -5.034 1.00 0.50 H new ATOM 0 HG23 ILE A 165 -11.787 3.976 -4.658 1.00 0.50 H new ATOM 0 HD11 ILE A 165 -10.566 4.474 -0.647 1.00 0.50 H new ATOM 0 HD12 ILE A 165 -11.708 5.786 -1.025 1.00 0.50 H new ATOM 0 HD13 ILE A 165 -11.974 4.155 -1.687 1.00 0.50 H new ATOM 2540 N LEU A 166 -11.640 7.967 -6.054 1.00 0.46 N ATOM 2541 CA LEU A 166 -12.452 8.539 -7.120 1.00 0.57 C ATOM 2542 C LEU A 166 -11.644 8.706 -8.397 1.00 0.61 C ATOM 2543 O LEU A 166 -12.151 8.469 -9.491 1.00 0.70 O ATOM 2544 CB LEU A 166 -13.027 9.887 -6.681 1.00 0.66 C ATOM 2545 CG LEU A 166 -13.453 10.810 -7.818 1.00 1.07 C ATOM 2546 CD1 LEU A 166 -14.936 11.135 -7.728 1.00 1.73 C ATOM 2547 CD2 LEU A 166 -12.620 12.079 -7.799 1.00 1.38 C ATOM 0 H LEU A 166 -11.473 8.598 -5.270 1.00 0.46 H new ATOM 0 HA LEU A 166 -13.272 7.851 -7.325 1.00 0.57 H new ATOM 0 HB2 LEU A 166 -13.889 9.705 -6.039 1.00 0.66 H new ATOM 0 HB3 LEU A 166 -12.282 10.402 -6.075 1.00 0.66 H new ATOM 0 HG LEU A 166 -13.283 10.296 -8.764 1.00 1.07 H new ATOM 0 HD11 LEU A 166 -15.214 11.795 -8.550 1.00 1.73 H new ATOM 0 HD12 LEU A 166 -15.515 10.213 -7.790 1.00 1.73 H new ATOM 0 HD13 LEU A 166 -15.143 11.630 -6.779 1.00 1.73 H new ATOM 0 HD21 LEU A 166 -12.932 12.731 -8.615 1.00 1.38 H new ATOM 0 HD22 LEU A 166 -12.762 12.593 -6.849 1.00 1.38 H new ATOM 0 HD23 LEU A 166 -11.567 11.825 -7.920 1.00 1.38 H new ATOM 2559 N LEU A 167 -10.399 9.121 -8.254 1.00 0.56 N ATOM 2560 CA LEU A 167 -9.483 9.195 -9.385 1.00 0.64 C ATOM 2561 C LEU A 167 -9.436 7.850 -10.090 1.00 0.66 C ATOM 2562 O LEU A 167 -9.482 7.767 -11.317 1.00 0.75 O ATOM 2563 CB LEU A 167 -8.081 9.571 -8.909 1.00 0.64 C ATOM 2564 CG LEU A 167 -7.075 9.908 -10.015 1.00 0.81 C ATOM 2565 CD1 LEU A 167 -7.529 11.131 -10.794 1.00 1.47 C ATOM 2566 CD2 LEU A 167 -5.692 10.126 -9.425 1.00 1.51 C ATOM 0 H LEU A 167 -9.995 9.414 -7.364 1.00 0.56 H new ATOM 0 HA LEU A 167 -9.838 9.960 -10.076 1.00 0.64 H new ATOM 0 HB2 LEU A 167 -8.161 10.429 -8.242 1.00 0.64 H new ATOM 0 HB3 LEU A 167 -7.683 8.745 -8.320 1.00 0.64 H new ATOM 0 HG LEU A 167 -7.023 9.066 -10.705 1.00 0.81 H new ATOM 0 HD11 LEU A 167 -6.802 11.355 -11.575 1.00 1.47 H new ATOM 0 HD12 LEU A 167 -8.500 10.933 -11.248 1.00 1.47 H new ATOM 0 HD13 LEU A 167 -7.611 11.983 -10.119 1.00 1.47 H new ATOM 0 HD21 LEU A 167 -4.989 10.364 -10.223 1.00 1.51 H new ATOM 0 HD22 LEU A 167 -5.726 10.951 -8.713 1.00 1.51 H new ATOM 0 HD23 LEU A 167 -5.367 9.219 -8.914 1.00 1.51 H new ATOM 2578 N VAL A 168 -9.357 6.803 -9.286 1.00 0.61 N ATOM 2579 CA VAL A 168 -9.394 5.444 -9.786 1.00 0.69 C ATOM 2580 C VAL A 168 -10.769 5.119 -10.373 1.00 0.77 C ATOM 2581 O VAL A 168 -10.865 4.515 -11.438 1.00 0.89 O ATOM 2582 CB VAL A 168 -9.048 4.439 -8.672 1.00 0.68 C ATOM 2583 CG1 VAL A 168 -9.118 3.023 -9.197 1.00 0.84 C ATOM 2584 CG2 VAL A 168 -7.667 4.726 -8.103 1.00 0.66 C ATOM 0 H VAL A 168 -9.266 6.873 -8.273 1.00 0.61 H new ATOM 0 HA VAL A 168 -8.647 5.360 -10.575 1.00 0.69 H new ATOM 0 HB VAL A 168 -9.780 4.548 -7.872 1.00 0.68 H new ATOM 0 HG11 VAL A 168 -8.871 2.326 -8.397 1.00 0.84 H new ATOM 0 HG12 VAL A 168 -10.126 2.818 -9.558 1.00 0.84 H new ATOM 0 HG13 VAL A 168 -8.408 2.903 -10.015 1.00 0.84 H new ATOM 0 HG21 VAL A 168 -7.440 4.005 -7.317 1.00 0.66 H new ATOM 0 HG22 VAL A 168 -6.923 4.645 -8.895 1.00 0.66 H new ATOM 0 HG23 VAL A 168 -7.647 5.734 -7.688 1.00 0.66 H new